A0A3Q0KLH8_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KLH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 408 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.1	Low	53.9	Low	231 Å²	231	154.5 Å²	154.5	100%	1.138	80%	0.796	S	S	*	*				0	95.3	0	-152.9	170.7	-173.5	0	0	106	T3	M1-T3 PolarHBondContact O-N 3.01Å
2	F	49.6	Very low	53.7	Low	212 Å²	212	149.8 Å²	149.8	93%	0.93	78%	0.779	S	S	*	*			trans	-76.9	103.9	-168.1	-78.6	-89.6	0	0	0	110.2	L4	F2-L4 PolarHBondContact O-N 2.86Å
3	T	55.3	Low	53.4	Low	115 Å²	115	146.5 Å²	146.5	71%	0.706	77%	0.77	S	S	*	*			trans	-80.7	99.5	171.9	40.1	0	0	0	0	109.2	M1 F5	M1-T3 PolarHBondContact O-N 3.01Å; T3-F5 PolarHBondContact O-N 3.48Å; T3-F5 VanDerWaalsContact O-N 3.16Å
4	L	56.7	Low	53.1	Low	168 Å²	168	147.1 Å²	147.1	88%	0.88	77%	0.773	S	S	*	*			trans	-66.3	102.4	168.9	-77.9	152.2	0	0	0	108.8	F2 P6	F2-L4 PolarHBondContact O-N 2.86Å; L4-P6 VanDerWaalsContact O-CD 3.29Å; L4-P6 WeakPolarHBondContact O-CD 3.46Å
5	F	50.9	Low	52.7	Low	181 Å²	181	146.8 Å²	146.8	79%	0.794	77%	0.771	S	S	*	*			trans	-80.1	113.2	164.5	-88.3	-91.2	0	0	0	108.3	T3 S7	T3-F5 PolarHBondContact O-N 3.48Å; T3-F5 VanDerWaalsContact O-N 3.16Å; F5-S7 PolarHBondContact O-N 3.33Å; F5-S7 VanDerWaalsContact O-N 3.08Å
6	P	59.5	Low	52.6	Low	108 Å²	108	143.3 Å²	143.3	70%	0.701	76%	0.759	S	S	*	*			trans	-71.5	106.6	170.1	28.7	-29.7	0	0	0	107.5	L4 V8	L4-P6 VanDerWaalsContact O-CD 3.29Å; L4-P6 WeakPolarHBondContact O-CD 3.46Å; P6-V8 VanDerWaalsContact C-N 3.26Å; P6-V8 PolarHBondContact O-N 3.47Å
7	S	57	Low	52.6	Low	101 Å²	101	143.5 Å²	143.5	71%	0.706	76%	0.76	S	S	*	*			trans	-58.4	92.3	167	-57.9	0	0	0	0	108.6	F5 L9	F5-S7 PolarHBondContact O-N 3.33Å; F5-S7 VanDerWaalsContact O-N 3.08Å; S7-L9 PolarHBondContact O-N 2.99Å
8	V	53.6	Low	52.9	Low	119 Å²	119	144.6 Å²	144.6	72%	0.721	76%	0.759	S	S	*	*			trans	-65.9	84.4	163.4	-179.4	0	0	0	0	105.8	P6 L10	P6-V8 VanDerWaalsContact C-N 3.26Å; P6-V8 PolarHBondContact O-N 3.47Å; V8-L10 HydrophobicContact CG1-CD1 4.23Å; V8-L10 PolarHBondContact O-N 3.27Å
9	L	54.6	Low	53.6	Low	132 Å²	132	139.9 Å²	139.9	69%	0.691	73%	0.734	S	S	*	*			trans	-62.2	86.5	164.7	-90.6	149.3	0	0	0	106.6	S7 Y11	S7-L9 PolarHBondContact O-N 2.99Å; L9-Y11 HydrophobicContact CB-CD2 4.19Å; L9-Y11 HydrophobicContact CB-CE2 4.27Å; L9-Y11 HydrophobicContact CD2-CE2 4.47Å; L9-Y11 PolarHBondContact O-N 3.19Å
10	L	51.2	Low	54.9	Low	139 Å²	139	136.6 Å²	136.6	73%	0.728	72%	0.719	S	S	*	*			trans	-61.4	86.1	163	-119.8	120.5	0	0	0	106.3	V8 V12	V8-L10 HydrophobicContact CG1-CD1 4.23Å; V8-L10 PolarHBondContact O-N 3.27Å; L10-V12 HydrophobicContact CB-CG2 4.48Å; L10-V12 HydrophobicContact CD2-CG2 3.64Å; L10-V12 PolarHBondContact O-N 3.11Å
11	Y	52.3	Low	56.5	Low	194 Å²	194	130.6 Å²	130.6	76%	0.761	69%	0.688	S	S	*	*			trans	-65	79.6	159.3	-88.6	-92.5	0	0	0	106.4	L9 T13	L9-Y11 HydrophobicContact CB-CD2 4.19Å; L9-Y11 HydrophobicContact CB-CE2 4.27Å; L9-Y11 HydrophobicContact CD2-CE2 4.47Å; L9-Y11 PolarHBondContact O-N 3.19Å; Y11-T13 PolarHBondContact O-N 3.48Å
12	V	51.7	Low	58.4	Low	98 Å²	98	123.6 Å²	123.6	59%	0.594	66%	0.658	S	S	*	*			trans	-65.3	91.6	158.5	-178.5	0	0	0	0	104.2	L10 L14	L10-V12 HydrophobicContact CB-CG2 4.48Å; L10-V12 HydrophobicContact CD2-CG2 3.64Å; L10-V12 PolarHBondContact O-N 3.11Å; V12-L14 HydrophobicContact CG1-CG 4.31Å; V12-L14 PolarHBondContact O-N 3.3Å
13	T	49.4	Very low	60.5	Low	107 Å²	107	114.8 Å²	114.8	66%	0.656	62%	0.619	S	S	*	*			trans	-60.2	88.8	161.5	41.7	0	0	0	0	105.8	Y11 L15	Y11-T13 PolarHBondContact O-N 3.48Å; T13-L15 PolarHBondContact O-N 3.08Å
14	L	49.8	Very low	62.4	Low	155 Å²	155	112 Å²	112	81%	0.812	60%	0.604	S	S	*	*			trans	-58.6	81.4	160.4	-82.5	147.6	0	0	0	105.8	V12 P16	V12-L14 HydrophobicContact CG1-CG 4.31Å; V12-L14 PolarHBondContact O-N 3.3Å; L14-P16 WeakPolarHBondContact O-CD 3.27Å
15	L	47.2	Very low	64.2	Low	142 Å²	142	105.1 Å²	105.1	74%	0.743	57%	0.569	S	S	*	*			trans	-50.2	115.7	163.8	-85.4	134.3	0	0	0	104.8	T13 L17	T13-L15 PolarHBondContact O-N 3.08Å; L15-L17 PolarHBondContact O-N 3.26Å
16	P	51	Low	66.1	Low	91 Å²	91	100.7 Å²	100.7	59%	0.591	55%	0.553	S	S	*	*			trans	-57.4	117.1	179	23.4	-31.1	0	0	0	105.6	L14 H18	L14-P16 WeakPolarHBondContact O-CD 3.27Å; P16-H18 VanDerWaalsContact C-N 3.25Å; P16-H18 PolarHBondContact O-N 3.01Å
17	L	53.2	Low	67.4	Low	146 Å²	146	96.8 Å²	96.8	76%	0.764	53%	0.528	S	S	*	.			trans	-52.9	100.1	170.7	-114.1	97.7	0	0	0	105.9	L15 Q19	L15-L17 PolarHBondContact O-N 3.26Å; L17-Q19 VanDerWaalsContact C-N 3.3Å; L17-Q19 PolarHBondContact O-N 3.1Å
18	H	57.7	Low	69.1	Low	163 Å²	163	93.9 Å²	93.9	76%	0.755	51%	0.508	S	S	*	.			trans	-69.7	96.7	176.7	-82.9	-51.6	0	0	0	105.9	P16 T20	P16-H18 VanDerWaalsContact C-N 3.25Å; P16-H18 PolarHBondContact O-N 3.01Å; H18-T20 PolarHBondContact O-N 3.18Å
19	Q	65.2	Low	70.9	Confident	57 Å²	57	92.2 Å²	92.2	27%	0.266	50%	0.495	S	S	.	.			trans	-62.4	109.4	174.7	-70.8	178.5	-2.8	0	0	108.4	L17 I21 H100 S104	L17-Q19 VanDerWaalsContact C-N 3.3Å; L17-Q19 PolarHBondContact O-N 3.1Å; Q19-I21 PolarHBondContact O-N 3.02Å; Q19-H100 PolarHBondContact OE1-CE1 3.34Å; Q19-H100 PolarHBondContact OE1-ND1 3.37Å; Q19-S104 PolarHBondContact O-OG 3.06Å
20	T	79.7	Confident	72.8	Confident	72 Å²	72	87.8 Å²	87.8	44%	0.442	47%	0.473	S	S	.	.			trans	-82.1	97.7	-178.6	34	0	0	0	0	109.6	H18 E44	H18-T20 PolarHBondContact O-N 3.18Å; T20-E44 VanDerWaalsContact OG1-CD 3.27Å; T20-E44 PolarHBondContact OG1-OE1 2.97Å
21	I	89.3	Confident	74.8	Confident	12 Å²	12	81.2 Å²	81.2	6%	0.062	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.3	166.7	-167.2	176.5	0	0	0	108.7	Q19 C41 S42 C98 H100 K106	Q19-I21 PolarHBondContact O-N 3.02Å; I21-C41 VanDerWaalsContact CD1-SG 3.52Å; I21-S42 WeakPolarHBondContact CA-O 3.42Å; I21-C98 VanDerWaalsContact CD1-SG 3.58Å; I21-H100 HydrophobicContact CD1-CB 3.86Å; I21-K106 HydrophobicContact CG2-CG 3.58Å
22	T	91.3	Very high	76.6	Confident	83 Å²	83	73 Å²	73	51%	0.509	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.2	171.8	60.8	0	0	0	0	108.9	C41 S42	T22-C41 CarbonylContact O-C 3.58Å; T22-C41 VanDerWaalsContact O-CA 3.29Å; T22-C41 WeakPolarHBondContact O-CA 3.38Å; T22-S42 PolarHBondContact N-O 3.41Å; T22-S42 PolarHBondContact O-N 2.83Å; T22-S42 WeakPolarHBondContact OG1-CB 3.24Å; T22-S42 PolarHBondContact OG1-O 3.21Å
23	F	94.1	Very high	78.5	Confident	28 Å²	28	70.4 Å²	70.4	12%	0.123	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.1	177.7	-173.7	-145.9	0	0	0	108.6	L39 S40 C41 W52 W96 C98 K106 I108	F23-L39 HydrophobicContact CE2-CB 4.12Å; F23-L39 HydrophobicContact CZ-CD2 4.41Å; F23-S40 WeakPolarHBondContact CA-O 3.5Å; F23-S40 WeakPolarHBondContact CD2-O 3.26Å; F23-C41 HydrophobicContact CD2-CB 4.08Å; F23-W52 HydrophobicContact CD2-CH2 4.45Å; F23-W52 HydrophobicContact CD2-CZ3 4.35Å; F23-W52 AromaticContact CE2-CH2 3.93Å; F23-W52 HydrophobicContact CE2-CH2 3.93Å; F23-W52 AromaticContact CE2-CZ3 3.51Å; F23-W52 HydrophobicContact CE2-CZ3 3.51Å; F23-W52 HydrophobicContact CZ-CZ3 4.03Å; F23-W96 HydrophobicContact CE1-CB 4.48Å; F23-W96 WeakPolarHBondContact CE1-O 3.49Å; F23-W96 HydrophobicContact CZ-CB 4.16Å; F23-C98 HydrophobicContact CD2-CB 4.42Å; F23-K106 HydrophobicContact CB-CB 3.63Å; F23-K106 HydrophobicContact CB-CG 4.34Å; F23-K106 HydrophobicContact CD1-CB 4.03Å; F23-K106 HydrophobicContact CG-CB 4.27Å; F23-I108 HydrophobicContact CB-CD1 4.31Å; F23-I108 HydrophobicContact CD1-CB 4.15Å; F23-I108 HydrophobicContact CD1-CD1 3.45Å; F23-I108 VanDerWaalsContact CD1-CD1 3.45Å; F23-I108 HydrophobicContact CD1-CG1 3.47Å; F23-I108 VanDerWaalsContact CD1-CG1 3.47Å; F23-I108 HydrophobicContact CD2-CD1 4.27Å; F23-I108 HydrophobicContact CE1-CB 3.7Å; F23-I108 HydrophobicContact CE1-CD1 3.67Å; F23-I108 HydrophobicContact CE1-CG1 3.58Å; F23-I108 HydrophobicContact CE2-CD1 4.43Å; F23-I108 HydrophobicContact CG-CD1 3.75Å; F23-I108 HydrophobicContact CG-CG1 4.27Å; F23-I108 HydrophobicContact CZ-CB 4.4Å; F23-I108 HydrophobicContact CZ-CD1 4.16Å; F23-I108 HydrophobicContact CZ-CG1 4.44Å
24	S	95.4	Very high	80.4	Confident	56 Å²	56	67.6 Å²	67.6	39%	0.392	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	161.4	-173.5	66.9	0	0	0	0	111.7	S40	S24-S40 PolarHBondContact N-O 3.34Å; S24-S40 PolarHBondContact O-N 3.23Å; S24-S40 PolarHBondContact OG-O 2.97Å
25	T	94.3	Very high	82.3	Confident	24 Å²	24	60.3 Å²	60.3	15%	0.147	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.8	-177.4	60.6	0	0	0	0	111.6	N29 K38 L39 I108 I110	T25-N29 PolarHBondContact OG1-N 3.01Å; T25-K38 CarbonylContact C-O 3.59Å; T25-K38 WeakPolarHBondContact CA-O 3.4Å; T25-L39 HydrophobicContact CG2-CD2 3.33Å; T25-I108 HydrophobicContact CG2-CB 4.4Å; T25-I108 HydrophobicContact CG2-CD1 3.72Å; T25-I108 HydrophobicContact CG2-CG2 3.95Å; T25-I110 HydrophobicContact CG2-CD1 3.69Å
26	L	91.5	Very high	84.5	Confident	87 Å²	87	55.1 Å²	55.1	46%	0.455	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.6	172.3	-68.1	169.8	0	0	0	109.7	K38	L26-K38 HydrophobicContact CB-CB 4.25Å; L26-K38 PolarHBondContact N-O 3.48Å; L26-K38 PolarHBondContact O-N 2.83Å
27	P	86.7	Confident	86.5	Confident	27 Å²	27	50.8 Å²	50.8	18%	0.175	29%	0.291	C	S	.	.	S	Bend	cis	-80.3	-26.5	3.5	32.7	-36.4	0	0	0	114.4	Y303	P27-Y303 HydrophobicContact CB-CD1 3.79Å; P27-Y303 HydrophobicContact CB-CE1 3.13Å; P27-Y303 HydrophobicContact CB-CE2 4.21Å; P27-Y303 WeakPolarHBondContact CB-OH 3.36Å; P27-Y303 HydrophobicContact CG-CD1 4.02Å; P27-Y303 HydrophobicContact CG-CE1 3.71Å
28	S	90.9	Very high	88.5	Confident	39 Å²	39	46.5 Å²	46.5	27%	0.273	27%	0.266	S	S	.	.			trans	-158.1	179.2	173.8	87	0	0	0	0	110.1	V30	S28-V30 PolarHBondContact O-N 3.39Å; S28-V30 PolarHBondContact OG-N 2.88Å; S28-V30 PolarHBondContact OG-O 3.38Å
29	N	92.9	Very high	90.4	Very high	84 Å²	84	38.8 Å²	38.8	45%	0.449	23%	0.23	S	C	.	.	S	Bend	trans	-73.9	-8.4	172.1	62.1	-24.2	0	0	0	113.4	T25 I108 I110 D111	T25-N29 PolarHBondContact OG1-N 3.01Å; N29-I108 HydrophobicContact CB-CG2 4.17Å; N29-I110 HydrophobicContact CB-CD1 4.43Å; N29-I110 WeakPolarHBondContact O-CA 3.45Å; N29-D111 PolarHBondContact O-N 2.78Å
30	V	93.1	Very high	91.8	Very high	40 Å²	40	36.9 Å²	36.9	24%	0.242	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.2	171.8	-173.9	0	0	0	0	108.5	S28 D111 L113 L300	S28-V30 PolarHBondContact O-N 3.39Å; S28-V30 PolarHBondContact OG-N 2.88Å; S28-V30 PolarHBondContact OG-O 3.38Å; V30-D111 WeakPolarHBondContact CA-O 3.28Å; V30-D111 HydrophobicContact CG1-CB 4.43Å; V30-D111 HydrophobicContact CG2-CB 4.28Å; V30-L113 HydrophobicContact CG1-CD1 3.81Å; V30-L113 HydrophobicContact CG1-CD2 4.31Å; V30-L113 HydrophobicContact CG1-CG 3.8Å; V30-L300 HydrophobicContact CG1-CD1 4.13Å; V30-L300 WeakPolarHBondContact O-CD2 3.13Å
31	T	93.1	Very high	92.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	165.7	-178.1	-166.8	0	0	0	0	112	S35 V88 I110 D111 V112 L113	T31-S35 PolarHBondContact OG1-OG 3.33Å; T31-V88 HydrophobicContact CG2-CB 4.33Å; T31-V88 HydrophobicContact CG2-CG1 3.74Å; T31-V88 HydrophobicContact CG2-CG2 4.22Å; T31-I110 HydrophobicContact CG2-CG2 4.49Å; T31-D111 PolarHBondContact N-O 2.04Å; T31-V112 HydrophobicContact CG2-CG2 4.09Å; T31-V112 WeakPolarHBondContact O-CA 3.46Å; T31-L113 PolarHBondContact O-N 3.4Å
32	L	91.4	Very high	92.7	Very high	22 Å²	22	34.2 Å²	34.2	12%	0.115	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.8	178.2	-167.3	75.2	0	0	0	109.7	G34 S35 L113 L297	L32-G34 PolarHBondContact O-N 3.45Å; L32-S35 PolarHBondContact N-OG 3.33Å; L32-S35 VanDerWaalsContact O-CB 3.29Å; L32-S35 WeakPolarHBondContact O-CB 3.38Å; L32-S35 PolarHBondContact O-N 2.88Å; L32-S35 VanDerWaalsContact O-N 3.1Å; L32-S35 PolarHBondContact O-OG 3Å; L32-L113 CarbonylContact C-O 3.59Å; L32-L113 WeakPolarHBondContact CA-O 3.38Å; L32-L113 HydrophobicContact CD1-CB 4.33Å; L32-L113 WeakPolarHBondContact CD1-O 3.32Å; L32-L297 HydrophobicContact CD1-CD2 3.57Å
33	S	91.4	Very high	92.6	Very high	43 Å²	43	30.5 Å²	30.5	30%	0.301	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	141.2	169.1	-170.4	0	0	0	0	111.1	S35 V88 L113	S33-S35 VanDerWaalsContact C-N 3.28Å; S33-V88 CarbonylContact C-O 3.53Å; S33-V88 VanDerWaalsContact CA-O 3.24Å; S33-V88 WeakPolarHBondContact CA-O 3.26Å; S33-V88 PolarHBondContact OG-O 3.43Å; S33-L113 PolarHBondContact N-O 3.37Å
34	G	88.2	Confident	92.1	Very high	47 Å²	47	35.8 Å²	35.8	49%	0.485	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	-16.2	-172.2	0	0	0	0	0	114.3	L32 N87 V88	L32-G34 PolarHBondContact O-N 3.45Å; G34-N87 WeakPolarHBondContact CA-OD1 3.48Å; G34-V88 PolarHBondContact N-O 2.88Å
35	S	91	Very high	91.3	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.021	21%	0.209	C	C	.	.	S	Bend	trans	-93.1	-178.8	179.8	75.8	0	0	0	0	112.3	T31 L32 S33 N87 V88 N304	T31-S35 PolarHBondContact OG1-OG 3.33Å; L32-S35 PolarHBondContact N-OG 3.33Å; L32-S35 VanDerWaalsContact O-CB 3.29Å; L32-S35 WeakPolarHBondContact O-CB 3.38Å; L32-S35 PolarHBondContact O-N 2.88Å; L32-S35 VanDerWaalsContact O-N 3.1Å; L32-S35 PolarHBondContact O-OG 3Å; S33-S35 VanDerWaalsContact C-N 3.28Å; S35-N87 CarbonylContact O-C 3.54Å; S35-N87 WeakPolarHBondContact O-CA 3.31Å; S35-V88 WeakPolarHBondContact O-CB 3.34Å; S35-V88 VanDerWaalsContact O-CG2 3.26Å; S35-V88 WeakPolarHBondContact O-CG2 3.44Å; S35-V88 PolarHBondContact O-N 2.85Å; S35-N304 WeakPolarHBondContact CB-ND2 3.37Å; S35-N304 WeakPolarHBondContact CB-OD1 3.46Å
36	Y	92.5	Very high	90.4	Very high	32 Å²	32	39.2 Å²	39.2	13%	0.125	22%	0.221	C	C	.	.			trans	-95.4	155.2	176.9	79.2	-86.8	0	0	0	112.5	Y84 I85 Q307	Y36-Y84 HydrophobicContact CD2-CD2 4.34Å; Y36-Y84 AromaticContact CD2-CE2 3.59Å; Y36-Y84 HydrophobicContact CD2-CE2 3.59Å; Y36-Y84 HydrophobicContact CE2-CE2 4.49Å; Y36-Y84 AromaticContact CG-CE2 3.92Å; Y36-Y84 HydrophobicContact CG-CE2 3.92Å; Y36-I85 CarbonylContact C-O 3.55Å; Y36-I85 WeakPolarHBondContact CA-O 3.16Å; Y36-I85 WeakPolarHBondContact CB-O 3.22Å; Y36-Q307 HydrophobicContact CE1-CB 4.27Å; Y36-Q307 HydrophobicContact CE1-CG 4.24Å
37	L	94.3	Very high	90.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.4	167.7	179.3	68.4	0	0	0	109	L39 I85 V88 I110	L37-L39 HydrophobicContact CD1-CD2 4.32Å; L37-L39 HydrophobicContact CD2-CD2 4.03Å; L37-L39 HydrophobicContact CD2-CG 4.31Å; L37-L39 HydrophobicContact CG-CD2 4.09Å; L37-L39 HydrophobicContact CG-CG 4.31Å; L37-I85 HydrophobicContact CB-CB 4.29Å; L37-I85 HydrophobicContact CB-CD1 4.46Å; L37-I85 HydrophobicContact CD2-CD1 4.09Å; L37-I85 PolarHBondContact N-O 3.49Å; L37-I85 PolarHBondContact O-N 2.96Å; L37-V88 HydrophobicContact CB-CG2 3.45Å; L37-V88 VanDerWaalsContact CB-CG2 3.45Å; L37-I110 HydrophobicContact CD2-CG1 4.27Å; L37-I110 HydrophobicContact CD2-CG2 3.8Å
38	K	95.1	Very high	90.1	Very high	57 Å²	57	43.9 Å²	43.9	25%	0.248	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.8	173.9	-177.4	179.9	178.3	-179.5	0	109.2	T25 L26 E82 I83 Y84	T25-K38 CarbonylContact C-O 3.59Å; T25-K38 WeakPolarHBondContact CA-O 3.4Å; L26-K38 HydrophobicContact CB-CB 4.25Å; L26-K38 PolarHBondContact N-O 3.48Å; L26-K38 PolarHBondContact O-N 2.83Å; K38-E82 WeakPolarHBondContact CE-OE1 3.46Å; K38-E82 WeakPolarHBondContact CE-OE2 3.47Å; K38-E82 IonicContact NZ-OE1 2.67Å; K38-E82 PolarHBondContact NZ-OE1 3.31Å; K38-E82 IonicContact NZ-OE2 3.99Å; K38-E82 PolarHBondContact NZ-OE2 2.98Å; K38-I83 CarbonylContact C-O 3.51Å; K38-I83 WeakPolarHBondContact CA-O 3.22Å; K38-Y84 HydrophobicContact CB-CD2 4.29Å
39	L	96.4	Very high	90.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.3	174.4	-56.9	176.5	0	0	0	107.6	F23 T25 L37 W52 E82 I83 W96 I110	F23-L39 HydrophobicContact CE2-CB 4.12Å; F23-L39 HydrophobicContact CZ-CD2 4.41Å; T25-L39 HydrophobicContact CG2-CD2 3.33Å; L37-L39 HydrophobicContact CD1-CD2 4.32Å; L37-L39 HydrophobicContact CD2-CD2 4.03Å; L37-L39 HydrophobicContact CD2-CG 4.31Å; L37-L39 HydrophobicContact CG-CD2 4.09Å; L37-L39 HydrophobicContact CG-CG 4.31Å; L39-W52 HydrophobicContact CB-CH2 4.02Å; L39-W52 HydrophobicContact CB-CZ3 3.81Å; L39-W52 HydrophobicContact CD1-CZ3 4.38Å; L39-E82 CarbonylContact O-C 3.6Å; L39-E82 WeakPolarHBondContact O-CA 3.44Å; L39-I83 HydrophobicContact CB-CB 4.29Å; L39-I83 PolarHBondContact N-O 3.23Å; L39-I83 PolarHBondContact O-N 3.25Å; L39-W96 HydrophobicContact CD1-CB 4.17Å; L39-W96 HydrophobicContact CD1-CD2 3.4Å; L39-W96 VanDerWaalsContact CD1-CD2 3.4Å; L39-W96 HydrophobicContact CD1-CE3 3.15Å; L39-W96 HydrophobicContact CD1-CG 3.85Å; L39-W96 HydrophobicContact CD1-CH2 4.34Å; L39-W96 HydrophobicContact CD1-CZ3 3.64Å; L39-I110 HydrophobicContact CD2-CD1 4.15Å; L39-I110 HydrophobicContact CD2-CG1 4.45Å
40	S	95.8	Very high	90.1	Very high	18 Å²	18	39.8 Å²	39.8	13%	0.126	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	123.4	-177.6	-178.2	0	0	0	0	109.7	F23 S24 V80 Y81	F23-S40 WeakPolarHBondContact CA-O 3.5Å; F23-S40 WeakPolarHBondContact CD2-O 3.26Å; S24-S40 PolarHBondContact N-O 3.34Å; S24-S40 PolarHBondContact O-N 3.23Å; S24-S40 PolarHBondContact OG-O 2.97Å; S40-V80 WeakPolarHBondContact OG-CG1 3.31Å; S40-Y81 WeakPolarHBondContact CA-O 3.29Å
41	C	94.9	Very high	90.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.2	179	-171.4	0	0	0	0	109.8	I21 T22 F23 W52 Y81 C98	I21-C41 VanDerWaalsContact CD1-SG 3.52Å; T22-C41 CarbonylContact O-C 3.58Å; T22-C41 VanDerWaalsContact O-CA 3.29Å; T22-C41 WeakPolarHBondContact O-CA 3.38Å; F23-C41 HydrophobicContact CD2-CB 4.08Å; C41-W52 HydrophobicContact CB-CH2 3.51Å; C41-W52 HydrophobicContact CB-CZ2 3.56Å; C41-W52 HydrophobicContact CB-CZ3 4.38Å; C41-Y81 PolarHBondContact N-O 3.19Å; C41-Y81 PolarHBondContact O-N 3.07Å; C41-C98 HydrophobicContact CB-CB 3.62Å; C41-C98 WeakPolarHBondContact CB-SG 3.48Å; C41-C98 WeakPolarHBondContact SG-CB 3.48Å; C41-C98 CovalentContact SG-SG 2.05Å; C41-C98 PolarHBondContact SG-SG 3.3Å
42	S	92.5	Very high	90.2	Very high	28 Å²	28	39.7 Å²	39.7	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.7	179.5	-166.6	0	0	0	0	110.5	I21 T22 D79	I21-S42 WeakPolarHBondContact CA-O 3.42Å; T22-S42 PolarHBondContact N-O 3.41Å; T22-S42 PolarHBondContact O-N 2.83Å; T22-S42 WeakPolarHBondContact OG1-CB 3.24Å; T22-S42 PolarHBondContact OG1-O 3.21Å; S42-D79 WeakPolarHBondContact CA-O 3.3Å; S42-D79 PolarHBondContact OG-O 3.44Å
43	S	88.7	Confident	90.4	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.028	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.2	175.6	-175.6	0	0	0	0	108.9	N45 D79 H100	S43-N45 PolarHBondContact O-N 2.81Å; S43-N45 PolarHBondContact OG-O 2.94Å; S43-N45 VanDerWaalsContact OG-O 3.14Å; S43-D79 PolarHBondContact N-O 2.84Å; S43-H100 PolarHBondContact OG-ND1 3.44Å
44	E	84.8	Confident	90.6	Very high	139 Å²	139	38.4 Å²	38.4	65%	0.65	20%	0.204	S	C	*	.	S	Bend	trans	-64.1	-28.4	-177.5	-69.4	171.6	-157	0	0	113.2	T20	T20-E44 VanDerWaalsContact OG1-CD 3.27Å; T20-E44 PolarHBondContact OG1-OE1 2.97Å
45	N	78.4	Confident	90.9	Very high	66 Å²	66	40.7 Å²	40.7	35%	0.353	21%	0.205	S	C	.	.			trans	-119	124.4	-178.8	-74.3	-39.1	0	0	0	108.8	S43 I47 H100	S43-N45 PolarHBondContact O-N 2.81Å; S43-N45 PolarHBondContact OG-O 2.94Å; S43-N45 VanDerWaalsContact OG-O 3.14Å; N45-I47 VanDerWaalsContact C-N 3.31Å; N45-I47 HydrophobicContact CB-CD1 4.47Å; N45-I47 HydrophobicContact CB-CG1 4.44Å; N45-I47 PolarHBondContact O-N 2.92Å; N45-H100 PolarHBondContact O-CE1 3.15Å; N45-H100 PolarHBondContact O-NE2 2.66Å
46	Q	75.2	Confident	91	Very high	86 Å²	86	44 Å²	44	40%	0.402	24%	0.24	S	C	.	.			trans	-94.3	34.1	-179.3	-60.1	-178.7	-2.2	0	0	113.2	F48 N78 D79	Q46-F48 VanDerWaalsContact C-N 3.3Å; Q46-N78 PolarHBondContact NE2-O 3.24Å; Q46-D79 PolarHBondContact NE2-OD1 3.28Å
47	I	84.6	Confident	91.1	Very high	119 Å²	119	48.3 Å²	48.3	61%	0.61	26%	0.259	S	S	*	.	S	Bend	trans	-69	-35.8	-178.1	-59.9	171.5	0	0	0	110.4	N45	N45-I47 VanDerWaalsContact C-N 3.31Å; N45-I47 HydrophobicContact CB-CD1 4.47Å; N45-I47 HydrophobicContact CB-CG1 4.44Å; N45-I47 PolarHBondContact O-N 2.92Å
48	F	87.8	Confident	91	Very high	94 Å²	94	52.9 Å²	52.9	41%	0.412	28%	0.281	S	S	.	.	S	Bend	trans	-113.2	153	179.8	-58.1	-68.4	0	0	0	110.6	Q46 H100	Q46-F48 VanDerWaalsContact C-N 3.3Å; F48-H100 AromaticContact CD2-CE1 3.83Å; F48-H100 PolarHBondContact N-NE2 3.42Å; F48-H100 PolarHBondContact O-CD2 2.78Å; F48-H100 PolarHBondContact O-NE2 3.48Å
49	P	90.1	Very high	90.9	Very high	36 Å²	36	51.5 Å²	51.5	23%	0.234	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-65.6	150.5	172.3	28.9	-35.9	0	0	0	111.4	E61 N62	P49-E61 HydrophobicContact CB-CG 3.6Å; P49-E61 WeakPolarHBondContact CB-OE1 3.28Å; P49-E61 HydrophobicContact CG-CG 4.23Å; P49-E61 VanDerWaalsContact CG-OE1 3.24Å; P49-E61 WeakPolarHBondContact CG-OE1 3.41Å; P49-N62 WeakPolarHBondContact CA-OD1 3.25Å; P49-N62 VanDerWaalsContact CB-ND2 3.34Å; P49-N62 WeakPolarHBondContact CB-ND2 3.41Å
50	I	92.1	Very high	90.8	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	117.5	167.4	-60.8	-59.2	0	0	0	108.8	E61 N62 Y81 C98 A99 H100	I50-E61 CarbonylContact O-C 3.57Å; I50-E61 WeakPolarHBondContact O-CA 3.32Å; I50-N62 PolarHBondContact N-OD1 3.31Å; I50-N62 PolarHBondContact O-N 3.45Å; I50-Y81 HydrophobicContact CB-CD1 4.39Å; I50-Y81 HydrophobicContact CB-CD2 4.2Å; I50-Y81 HydrophobicContact CB-CE2 4.39Å; I50-Y81 HydrophobicContact CB-CG 4.19Å; I50-Y81 HydrophobicContact CG1-CD2 3.54Å; I50-Y81 HydrophobicContact CG1-CE2 3.55Å; I50-Y81 HydrophobicContact CG1-CG 4.05Å; I50-Y81 HydrophobicContact CG2-CG 4.45Å; I50-C98 HydrophobicContact CG2-CB 4.31Å; I50-A99 WeakPolarHBondContact CA-O 3.01Å; I50-H100 HydrophobicContact CD1-CB 3.75Å
51	I	94.1	Very high	90.7	Very high	39 Å²	39	54.3 Å²	54.3	20%	0.2	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.3	176.8	-57.4	173.3	0	0	0	108.3	E58 E61 C98 A99	I51-E58 HydrophobicContact CG2-CB 4.33Å; I51-E58 HydrophobicContact CG2-CG 4.01Å; I51-E61 HydrophobicContact CG1-CG 4.48Å; I51-C98 CarbonylContact O-C 3.41Å; I51-C98 VanDerWaalsContact O-CA 3.31Å; I51-C98 WeakPolarHBondContact O-CA 3.47Å; I51-A99 HydrophobicContact CB-CB 4.43Å; I51-A99 PolarHBondContact N-O 2.85Å; I51-A99 PolarHBondContact O-N 2.9Å
52	W	95	Very high	90.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.7	174.2	-68.2	92.1	0	0	0	110	F23 L39 C41 E58 I59 A60 Y81 I83 S97 C98	F23-W52 HydrophobicContact CD2-CH2 4.45Å; F23-W52 HydrophobicContact CD2-CZ3 4.35Å; F23-W52 AromaticContact CE2-CH2 3.93Å; F23-W52 HydrophobicContact CE2-CH2 3.93Å; F23-W52 AromaticContact CE2-CZ3 3.51Å; F23-W52 HydrophobicContact CE2-CZ3 3.51Å; F23-W52 HydrophobicContact CZ-CZ3 4.03Å; L39-W52 HydrophobicContact CB-CH2 4.02Å; L39-W52 HydrophobicContact CB-CZ3 3.81Å; L39-W52 HydrophobicContact CD1-CZ3 4.38Å; C41-W52 HydrophobicContact CB-CH2 3.51Å; C41-W52 HydrophobicContact CB-CZ2 3.56Å; C41-W52 HydrophobicContact CB-CZ3 4.38Å; W52-E58 WeakPolarHBondContact O-CA 3.33Å; W52-I59 HydrophobicContact CB-CD1 4.27Å; W52-I59 HydrophobicContact CB-CG1 3.84Å; W52-I59 WeakPolarHBondContact O-CG1 3.5Å; W52-I59 PolarHBondContact O-N 3.28Å; W52-A60 HydrophobicContact CB-CB 4.24Å; W52-A60 PolarHBondContact N-O 2.94Å; W52-A60 PolarHBondContact O-N 3.01Å; W52-Y81 WeakPolarHBondContact CZ2-O 3.49Å; W52-I83 HydrophobicContact CB-CD1 3.91Å; W52-I83 HydrophobicContact CD2-CD1 3.39Å; W52-I83 HydrophobicContact CD2-CG1 3.99Å; W52-I83 HydrophobicContact CE3-CD1 3.61Å; W52-I83 HydrophobicContact CE3-CG1 4.26Å; W52-I83 HydrophobicContact CG-CD1 3.53Å; W52-I83 HydrophobicContact CG-CG1 4.4Å; W52-I83 HydrophobicContact CH2-CG1 4.47Å; W52-I83 HydrophobicContact CZ2-CG1 4.24Å; W52-I83 HydrophobicContact CZ3-CD1 4.24Å; W52-I83 HydrophobicContact CZ3-CG1 4.48Å; W52-S97 WeakPolarHBondContact CA-O 3.27Å; W52-C98 HydrophobicContact CD2-CB 4.37Å; W52-C98 HydrophobicContact CE3-CB 4.11Å; W52-C98 HydrophobicContact CH2-CB 4.39Å; W52-C98 HydrophobicContact CZ3-CB 4.13Å
53	S	95.3	Very high	90.4	Very high	10 Å²	10	57 Å²	57	7%	0.07	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	145.6	175.8	-35.5	0	0	0	0	111.2	K57 W96 S97	S53-K57 CarbonylContact C-O 3.59Å; S53-K57 WeakPolarHBondContact CA-O 3.38Å; S53-K57 WeakPolarHBondContact CB-O 3.15Å; S53-W96 WeakPolarHBondContact O-CA 3.29Å; S53-S97 WeakPolarHBondContact CB-OG 3.47Å; S53-S97 PolarHBondContact N-O 2.77Å; S53-S97 PolarHBondContact O-N 3.28Å
54	H	95.3	Very high	90.5	Very high	28 Å²	28	66.4 Å²	66.4	13%	0.13	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.6	173.4	174.9	-122.6	0	0	0	108.7	G56 K57 I59 E91 D92 R93 N95 W96	H54-G56 PolarHBondContact O-N 2.9Å; H54-G56 VanDerWaalsContact O-N 3.15Å; H54-K57 PolarHBondContact N-O 3.29Å; H54-K57 PolarHBondContact O-N 3.46Å; H54-I59 HydrophobicContact CB-CD1 4.49Å; H54-I59 HydrophobicContact CB-CG2 4.26Å; H54-E91 PolarHBondContact CE1-O 2.96Å; H54-D92 PolarHBondContact NE2-O 3.43Å; H54-R93 PolarHBondContact NE2-O 2.85Å; H54-N95 CarbonylContact C-O 3.57Å; H54-N95 WeakPolarHBondContact CA-O 3.34Å; H54-W96 HydrophobicContact CB-CD2 4.29Å; H54-W96 HydrophobicContact CB-CE3 4.29Å; H54-W96 HydrophobicContact CB-CH2 4.4Å; H54-W96 HydrophobicContact CB-CZ2 4.36Å; H54-W96 HydrophobicContact CB-CZ3 4.39Å; H54-W96 AromaticContact CD2-CD1 3.71Å; H54-W96 AromaticContact CD2-CD2 3.87Å; H54-W96 AromaticContact CD2-CE2 3.36Å; H54-W96 AromaticContact CD2-CZ2 3.77Å; H54-W96 AromaticContact CD2-NE1 3.25Å; H54-W96 PolarHBondContact CD2-NE1 3.14Å; H54-W96 AromaticContact CG-CE2 3.95Å; H54-W96 AromaticContact NE2-CE2 3.97Å; H54-W96 AromaticContact NE2-NE1 3.63Å
55	N	94.9	Very high	90.8	Very high	94 Å²	94	62.3 Å²	62.3	50%	0.503	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	39	-175.5	-65.2	-37.2	0	0	0	113.4	K57 R93 G94 N95	N55-K57 PolarHBondContact O-N 2.9Å; N55-R93 PolarHBondContact ND2-O 3.12Å; N55-G94 WeakPolarHBondContact OD1-CA 3.44Å; N55-N95 PolarHBondContact N-O 3.47Å; N55-N95 PolarHBondContact OD1-N 3.38Å
56	G	93.1	Very high	91.3	Very high	72 Å²	72	64.5 Å²	64.5	74%	0.742	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	-6.1	180	0	0	0	0	0	115.2	H54	H54-G56 PolarHBondContact O-N 2.9Å; H54-G56 VanDerWaalsContact O-N 3.15Å
57	K	94.1	Very high	91.5	Very high	123 Å²	123	66.3 Å²	66.3	54%	0.535	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.4	173.4	-175.7	180	175.8	-173.6	0	109.8	S53 H54 N55	S53-K57 CarbonylContact C-O 3.59Å; S53-K57 WeakPolarHBondContact CA-O 3.38Å; S53-K57 WeakPolarHBondContact CB-O 3.15Å; H54-K57 PolarHBondContact N-O 3.29Å; H54-K57 PolarHBondContact O-N 3.46Å; N55-K57 PolarHBondContact O-N 2.9Å
58	E	93.3	Very high	90.9	Very high	97 Å²	97	69.3 Å²	69.3	45%	0.453	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	136.2	174.1	-50.7	-174.5	174.7	0	0	110.9	I51 W52 Y66	I51-E58 HydrophobicContact CG2-CB 4.33Å; I51-E58 HydrophobicContact CG2-CG 4.01Å; W52-E58 WeakPolarHBondContact O-CA 3.33Å; E58-Y66 HydrophobicContact CB-CD2 4.24Å; E58-Y66 HydrophobicContact CB-CE2 3.66Å; E58-Y66 PolarHBondContact OE2-OH 2.99Å
59	I	93	Very high	90.1	Very high	28 Å²	28	67.1 Å²	67.1	14%	0.144	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	-28.7	-175.3	58.4	167.2	0	0	0	112.7	W52 H54 F65 Y66 I83 W96	W52-I59 HydrophobicContact CB-CD1 4.27Å; W52-I59 HydrophobicContact CB-CG1 3.84Å; W52-I59 WeakPolarHBondContact O-CG1 3.5Å; W52-I59 PolarHBondContact O-N 3.28Å; H54-I59 HydrophobicContact CB-CD1 4.49Å; H54-I59 HydrophobicContact CB-CG2 4.26Å; I59-F65 WeakPolarHBondContact O-CA 3.46Å; I59-Y66 PolarHBondContact O-N 2.79Å; I59-I83 HydrophobicContact CD1-CD1 4.11Å; I59-W96 HydrophobicContact CD1-CE3 4.2Å; I59-W96 HydrophobicContact CD1-CH2 3.99Å; I59-W96 HydrophobicContact CD1-CZ3 3.38Å
60	A	93.6	Very high	89.4	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	154.1	-178.6	0	0	0	0	0	112.4	W52 R64 F65	W52-A60 HydrophobicContact CB-CB 4.24Å; W52-A60 PolarHBondContact N-O 2.94Å; W52-A60 PolarHBondContact O-N 3.01Å; A60-R64 CarbonylContact C-O 3.52Å; A60-R64 WeakPolarHBondContact CA-O 3.39Å; A60-R64 WeakPolarHBondContact CB-O 3.27Å; A60-F65 HydrophobicContact CB-CD1 3.65Å; A60-F65 HydrophobicContact CB-CE1 3.94Å; A60-F65 HydrophobicContact CB-CG 4.16Å
61	E	93.1	Very high	89.3	Confident	77 Å²	77	76.2 Å²	76.2	36%	0.36	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.2	172.1	-173.5	-167.1	163.5	0	0	109	P49 I50 I51 C63 R64 Y66	P49-E61 HydrophobicContact CB-CG 3.6Å; P49-E61 WeakPolarHBondContact CB-OE1 3.28Å; P49-E61 HydrophobicContact CG-CG 4.23Å; P49-E61 VanDerWaalsContact CG-OE1 3.24Å; P49-E61 WeakPolarHBondContact CG-OE1 3.41Å; I50-E61 CarbonylContact O-C 3.57Å; I50-E61 WeakPolarHBondContact O-CA 3.32Å; I51-E61 HydrophobicContact CG1-CG 4.48Å; E61-C63 PolarHBondContact O-N 2.98Å; E61-C63 VanDerWaalsContact O-N 3.1Å; E61-R64 PolarHBondContact N-O 3.01Å; E61-R64 WeakPolarHBondContact O-CB 3.45Å; E61-R64 PolarHBondContact O-N 2.89Å; E61-Y66 HydrophobicContact CB-CE1 4.23Å
62	N	90.9	Very high	89.1	Confident	56 Å²	56	75.3 Å²	75.3	30%	0.299	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	43.7	178.7	-76.6	-17.8	0	0	0	113.7	P49 I50 R64 Y81	P49-N62 WeakPolarHBondContact CA-OD1 3.25Å; P49-N62 VanDerWaalsContact CB-ND2 3.34Å; P49-N62 WeakPolarHBondContact CB-ND2 3.41Å; I50-N62 PolarHBondContact N-OD1 3.31Å; I50-N62 PolarHBondContact O-N 3.45Å; N62-R64 VanDerWaalsContact C-N 3.27Å; N62-R64 PolarHBondContact O-N 2.88Å; N62-Y81 HydrophobicContact CB-CE1 4.21Å
63	C	90.1	Very high	89	Confident	27 Å²	27	79 Å²	79	18%	0.182	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	21.2	-174.6	-73.5	0	0	0	0	116.6	E61 C74 N75	E61-C63 PolarHBondContact O-N 2.98Å; E61-C63 VanDerWaalsContact O-N 3.1Å; C63-C74 WeakPolarHBondContact CA-SG 3.31Å; C63-C74 HydrophobicContact CB-CB 3.46Å; C63-C74 VanDerWaalsContact CB-CB 3.46Å; C63-C74 WeakPolarHBondContact CB-SG 3.39Å; C63-C74 VanDerWaalsContact SG-C 3.52Å; C63-C74 WeakPolarHBondContact SG-CB 3.22Å; C63-C74 CovalentContact SG-SG 2.04Å; C63-C74 PolarHBondContact SG-SG 3.49Å; C63-N75 VanDerWaalsContact SG-C 3.58Å; C63-N75 PolarHBondContact SG-O 3.23Å
64	R	91.3	Very high	88.9	Confident	202 Å²	202	79.5 Å²	79.5	76%	0.762	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.1	167.6	-61.4	-179.6	177.2	-176.2	-1.5	108.8	A60 E61 N62	A60-R64 CarbonylContact C-O 3.52Å; A60-R64 WeakPolarHBondContact CA-O 3.39Å; A60-R64 WeakPolarHBondContact CB-O 3.27Å; E61-R64 PolarHBondContact N-O 3.01Å; E61-R64 WeakPolarHBondContact O-CB 3.45Å; E61-R64 PolarHBondContact O-N 2.89Å; N62-R64 VanDerWaalsContact C-N 3.27Å; N62-R64 PolarHBondContact O-N 2.88Å
65	F	91	Very high	88.8	Confident	54 Å²	54	82.2 Å²	82.2	24%	0.237	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138	178.4	-65.5	-83.5	0	0	0	110.7	I59 A60 M67 Y72 C74 I83	I59-F65 WeakPolarHBondContact O-CA 3.46Å; A60-F65 HydrophobicContact CB-CD1 3.65Å; A60-F65 HydrophobicContact CB-CE1 3.94Å; A60-F65 HydrophobicContact CB-CG 4.16Å; F65-M67 VanDerWaalsContact C-N 3.28Å; F65-M67 WeakPolarHBondContact CB-O 3.29Å; F65-M67 PolarHBondContact O-N 3.46Å; F65-Y72 AromaticContact CE1-CD2 3.94Å; F65-Y72 HydrophobicContact CE1-CD2 3.94Å; F65-Y72 HydrophobicContact CE1-CG 4.34Å; F65-C74 HydrophobicContact CE2-CB 3.65Å; F65-C74 HydrophobicContact CZ-CB 3.71Å; F65-I83 HydrophobicContact CE1-CD1 4.45Å
66	Y	88.7	Confident	88.6	Confident	112 Å²	112	83.6 Å²	83.6	44%	0.439	40%	0.401	S	S	.	.	S	Bend	trans	-74.3	-20.9	177.8	-60.1	-58	0	0	0	113.2	E58 I59 E61	E58-Y66 HydrophobicContact CB-CD2 4.24Å; E58-Y66 HydrophobicContact CB-CE2 3.66Å; E58-Y66 PolarHBondContact OE2-OH 2.99Å; I59-Y66 PolarHBondContact O-N 2.79Å; E61-Y66 HydrophobicContact CB-CE1 4.23Å
67	M	80.4	Confident	88.4	Confident	124 Å²	124	85.1 Å²	85.1	61%	0.611	39%	0.391	S	S	*	.	S	Bend	trans	-125.1	146.4	177	-65.8	-179.5	173.2	0	0	108.7	F65 N69	F65-M67 VanDerWaalsContact C-N 3.28Å; F65-M67 WeakPolarHBondContact CB-O 3.29Å; F65-M67 PolarHBondContact O-N 3.46Å; M67-N69 VanDerWaalsContact C-N 3.33Å; M67-N69 PolarHBondContact O-N 3.45Å
68	E	72.3	Confident	88	Confident	181 Å²	181	85.9 Å²	85.9	85%	0.846	40%	0.401	S	S	*	.			trans	-62.3	97.7	169.9	-74.6	-174.3	166	0	0	108.9
69	N	70	Confident	87.8	Confident	49 Å²	49	84.5 Å²	84.5	26%	0.262	40%	0.396	S	S	.	.			trans	-121.1	90.9	175.3	-166.1	-12	0	0	0	109.1	M67 R71 Y72	M67-N69 VanDerWaalsContact C-N 3.33Å; M67-N69 PolarHBondContact O-N 3.45Å; N69-R71 PolarHBondContact O-N 3.39Å; N69-R71 VanDerWaalsContact OD1-CB 3.32Å; N69-R71 WeakPolarHBondContact OD1-CB 3.49Å; N69-R71 PolarHBondContact OD1-N 2.84Å; N69-R71 VanDerWaalsContact OD1-N 3.16Å; N69-Y72 HydrophobicContact CB-CD2 4.4Å; N69-Y72 WeakPolarHBondContact ND2-CD2 3.39Å; N69-Y72 WeakPolarHBondContact ND2-CE2 3.38Å; N69-Y72 PolarHBondContact O-N 2.94Å
70	H	76.5	Confident	87.7	Confident	170 Å²	170	85 Å²	85	79%	0.787	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-6	178.5	-54.7	-57.6	0	0	0	113.6
71	R	88.9	Confident	87.8	Confident	57 Å²	57	85.4 Å²	85.4	22%	0.215	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-24.4	178.4	-57.6	-159.8	-62.9	112.8	-5.4	113.4	N69 P86 E91 D92	N69-R71 PolarHBondContact O-N 3.39Å; N69-R71 VanDerWaalsContact OD1-CB 3.32Å; N69-R71 WeakPolarHBondContact OD1-CB 3.49Å; N69-R71 PolarHBondContact OD1-N 2.84Å; N69-R71 VanDerWaalsContact OD1-N 3.16Å; R71-P86 VanDerWaalsContact O-CD 3.26Å; R71-P86 WeakPolarHBondContact O-CD 3.45Å; R71-E91 IonicContact CZ-OE1 3.02Å; R71-E91 IonicContact NE-OE1 3.13Å; R71-E91 IonicContact NH1-OE1 2.75Å; R71-E91 IonicContact NH2-OE1 2.74Å; R71-E91 PolarHBondContact NH2-OE1 3.12Å; R71-D92 IonicContact CZ-OD1 3.66Å; R71-D92 IonicContact CZ-OD2 3.59Å; R71-D92 IonicContact NH1-OD1 3.85Å; R71-D92 PolarHBondContact NH1-OD1 3.11Å; R71-D92 IonicContact NH1-OD2 2.87Å; R71-D92 PolarHBondContact NH1-OD2 3.45Å; R71-D92 IonicContact NH2-OD1 3.54Å; R71-D92 PolarHBondContact NH2-OD1 2.9Å
72	Y	90.9	Very high	87.9	Confident	20 Å²	20	83 Å²	83	8%	0.078	39%	0.392	C	S	.	.			trans	-109.5	135.5	-174.4	-54.2	-28.7	0	0	0	110.2	F65 N69 I85 D92 W96	F65-Y72 AromaticContact CE1-CD2 3.94Å; F65-Y72 HydrophobicContact CE1-CD2 3.94Å; F65-Y72 HydrophobicContact CE1-CG 4.34Å; N69-Y72 HydrophobicContact CB-CD2 4.4Å; N69-Y72 WeakPolarHBondContact ND2-CD2 3.39Å; N69-Y72 WeakPolarHBondContact ND2-CE2 3.38Å; N69-Y72 PolarHBondContact O-N 2.94Å; Y72-I85 HydrophobicContact CD1-CB 4.42Å; Y72-I85 HydrophobicContact CD1-CD1 4.1Å; Y72-I85 HydrophobicContact CD1-CG1 3.77Å; Y72-I85 HydrophobicContact CD1-CG2 4.15Å; Y72-I85 HydrophobicContact CE1-CD1 3.84Å; Y72-I85 HydrophobicContact CE1-CG1 4.02Å; Y72-I85 HydrophobicContact CE1-CG2 4.11Å; Y72-D92 PolarHBondContact OH-OD1 2.92Å; Y72-W96 HydrophobicContact CE2-CH2 4.16Å
73	I	92.3	Very high	88.1	Confident	79 Å²	79	80.4 Å²	80.4	41%	0.405	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.1	175	-60.8	170.7	0	0	0	106.5	I83 Y84	I73-I83 CarbonylContact O-C 3.59Å; I73-Y84 HydrophobicContact CD1-CD1 4.26Å; I73-Y84 PolarHBondContact N-O 3.09Å; I73-Y84 PolarHBondContact O-N 3.09Å
74	C	92.8	Very high	88.3	Confident	20 Å²	20	83.2 Å²	83.2	14%	0.135	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.1	174.5	-162.1	0	0	0	0	110.2	C63 F65 E82 I83	C63-C74 WeakPolarHBondContact CA-SG 3.31Å; C63-C74 HydrophobicContact CB-CB 3.46Å; C63-C74 VanDerWaalsContact CB-CB 3.46Å; C63-C74 WeakPolarHBondContact CB-SG 3.39Å; C63-C74 VanDerWaalsContact SG-C 3.52Å; C63-C74 WeakPolarHBondContact SG-CB 3.22Å; C63-C74 CovalentContact SG-SG 2.04Å; C63-C74 PolarHBondContact SG-SG 3.49Å; F65-C74 HydrophobicContact CE2-CB 3.65Å; F65-C74 HydrophobicContact CZ-CB 3.71Å; C74-E82 CarbonylContact C-O 3.56Å; C74-E82 VanDerWaalsContact CA-O 3.24Å; C74-E82 WeakPolarHBondContact CA-O 3.42Å; C74-I83 HydrophobicContact CB-CG1 4.4Å
75	N	92.7	Very high	88.4	Confident	84 Å²	84	73.6 Å²	73.6	45%	0.449	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.8	176	-69.3	-28.6	0	0	0	109.6	C63 E82	C63-N75 VanDerWaalsContact SG-C 3.58Å; C63-N75 PolarHBondContact SG-O 3.23Å; N75-E82 PolarHBondContact N-O 2.86Å; N75-E82 PolarHBondContact O-N 3.22Å
76	R	91.1	Very high	88.4	Confident	124 Å²	124	73.8 Å²	73.8	47%	0.468	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	118.8	171.8	-178.2	-174.2	169.6	-178	-3.3	108.7	N78 V80 Y81	R76-N78 PolarHBondContact NE-O 2.88Å; R76-V80 WeakPolarHBondContact CA-O 3.46Å; R76-Y81 HydrophobicContact CB-CD1 4.3Å; R76-Y81 HydrophobicContact CB-CE1 4.35Å; R76-Y81 HydrophobicContact CG-CD1 4.08Å; R76-Y81 HydrophobicContact CG-CE1 3.82Å; R76-Y81 VanDerWaalsContact CZ-OH 3.29Å; R76-Y81 PolarHBondContact NE-OH 2.88Å
77	L	88.9	Confident	88.5	Confident	104 Å²	104	72.6 Å²	72.6	55%	0.545	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	100.7	176	-64	173.4	0	0	0	107.6	D79 V80	L77-D79 PolarHBondContact O-N 2.94Å; L77-D79 VanDerWaalsContact O-N 3.15Å; L77-V80 PolarHBondContact N-O 2.75Å; L77-V80 WeakPolarHBondContact O-CB 3.39Å; L77-V80 PolarHBondContact O-N 3.34Å
78	N	87.1	Confident	89.2	Confident	139 Å²	139	66.7 Å²	66.7	74%	0.743	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-114.9	-173.8	-54.4	-32.8	0	0	0	111.6	Q46 R76	Q46-N78 PolarHBondContact NE2-O 3.24Å; R76-N78 PolarHBondContact NE-O 2.88Å
79	D	88.4	Confident	90.1	Very high	67 Å²	67	62.3 Å²	62.3	36%	0.358	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.1	-179.9	-59	-47.6	0	0	0	113.7	S42 S43 Q46 L77	S42-D79 WeakPolarHBondContact CA-O 3.3Å; S42-D79 PolarHBondContact OG-O 3.44Å; S43-D79 PolarHBondContact N-O 2.84Å; Q46-D79 PolarHBondContact NE2-OD1 3.28Å; L77-D79 PolarHBondContact O-N 2.94Å; L77-D79 VanDerWaalsContact O-N 3.15Å
80	V	91.8	Very high	91.2	Very high	40 Å²	40	61 Å²	61	24%	0.242	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.5	-177.1	-170.2	0	0	0	0	109.9	S40 R76 L77 E82	S40-V80 WeakPolarHBondContact OG-CG1 3.31Å; R76-V80 WeakPolarHBondContact CA-O 3.46Å; L77-V80 PolarHBondContact N-O 2.75Å; L77-V80 WeakPolarHBondContact O-CB 3.39Å; L77-V80 PolarHBondContact O-N 3.34Å; V80-E82 HydrophobicContact CG1-CG 3.75Å
81	Y	94.3	Very high	92	Very high	7 Å²	7	57.5 Å²	57.5	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.3	174.6	-64.5	-101.6	0	0	0	108.4	S40 C41 I50 W52 N62 R76	S40-Y81 WeakPolarHBondContact CA-O 3.29Å; C41-Y81 PolarHBondContact N-O 3.19Å; C41-Y81 PolarHBondContact O-N 3.07Å; I50-Y81 HydrophobicContact CB-CD1 4.39Å; I50-Y81 HydrophobicContact CB-CD2 4.2Å; I50-Y81 HydrophobicContact CB-CE2 4.39Å; I50-Y81 HydrophobicContact CB-CG 4.19Å; I50-Y81 HydrophobicContact CG1-CD2 3.54Å; I50-Y81 HydrophobicContact CG1-CE2 3.55Å; I50-Y81 HydrophobicContact CG1-CG 4.05Å; I50-Y81 HydrophobicContact CG2-CG 4.45Å; W52-Y81 WeakPolarHBondContact CZ2-O 3.49Å; N62-Y81 HydrophobicContact CB-CE1 4.21Å; R76-Y81 HydrophobicContact CB-CD1 4.3Å; R76-Y81 HydrophobicContact CB-CE1 4.35Å; R76-Y81 HydrophobicContact CG-CD1 4.08Å; R76-Y81 HydrophobicContact CG-CE1 3.82Å; R76-Y81 VanDerWaalsContact CZ-OH 3.29Å; R76-Y81 PolarHBondContact NE-OH 2.88Å
82	E	95.1	Very high	92.2	Very high	28 Å²	28	54.8 Å²	54.8	13%	0.131	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121.5	-172.6	-55.2	-170	135.5	0	0	110.8	K38 L39 C74 N75 V80	K38-E82 WeakPolarHBondContact CE-OE1 3.46Å; K38-E82 WeakPolarHBondContact CE-OE2 3.47Å; K38-E82 IonicContact NZ-OE1 2.67Å; K38-E82 PolarHBondContact NZ-OE1 3.31Å; K38-E82 IonicContact NZ-OE2 3.99Å; K38-E82 PolarHBondContact NZ-OE2 2.98Å; L39-E82 CarbonylContact O-C 3.6Å; L39-E82 WeakPolarHBondContact O-CA 3.44Å; C74-E82 CarbonylContact C-O 3.56Å; C74-E82 VanDerWaalsContact CA-O 3.24Å; C74-E82 WeakPolarHBondContact CA-O 3.42Å; N75-E82 PolarHBondContact N-O 2.86Å; N75-E82 PolarHBondContact O-N 3.22Å; V80-E82 HydrophobicContact CG1-CG 3.75Å
83	I	94.8	Very high	92.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.8	166.7	-66.5	-177.8	0	0	0	108.2	K38 L39 W52 I59 F65 I73 C74 I85 W96	K38-I83 CarbonylContact C-O 3.51Å; K38-I83 WeakPolarHBondContact CA-O 3.22Å; L39-I83 HydrophobicContact CB-CB 4.29Å; L39-I83 PolarHBondContact N-O 3.23Å; L39-I83 PolarHBondContact O-N 3.25Å; W52-I83 HydrophobicContact CB-CD1 3.91Å; W52-I83 HydrophobicContact CD2-CD1 3.39Å; W52-I83 HydrophobicContact CD2-CG1 3.99Å; W52-I83 HydrophobicContact CE3-CD1 3.61Å; W52-I83 HydrophobicContact CE3-CG1 4.26Å; W52-I83 HydrophobicContact CG-CD1 3.53Å; W52-I83 HydrophobicContact CG-CG1 4.4Å; W52-I83 HydrophobicContact CH2-CG1 4.47Å; W52-I83 HydrophobicContact CZ2-CG1 4.24Å; W52-I83 HydrophobicContact CZ3-CD1 4.24Å; W52-I83 HydrophobicContact CZ3-CG1 4.48Å; I59-I83 HydrophobicContact CD1-CD1 4.11Å; F65-I83 HydrophobicContact CE1-CD1 4.45Å; I73-I83 CarbonylContact O-C 3.59Å; C74-I83 HydrophobicContact CB-CG1 4.4Å; I83-I85 HydrophobicContact CG2-CG1 4.2Å; I83-W96 HydrophobicContact CD1-CZ3 4.34Å
84	Y	94.5	Very high	92.5	Very high	86 Å²	86	55.5 Å²	55.5	34%	0.337	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.4	174.6	-177.9	-106.5	0	0	0	110.2	Y36 K38 I73 P86	Y36-Y84 HydrophobicContact CD2-CD2 4.34Å; Y36-Y84 AromaticContact CD2-CE2 3.59Å; Y36-Y84 HydrophobicContact CD2-CE2 3.59Å; Y36-Y84 HydrophobicContact CE2-CE2 4.49Å; Y36-Y84 AromaticContact CG-CE2 3.92Å; Y36-Y84 HydrophobicContact CG-CE2 3.92Å; K38-Y84 HydrophobicContact CB-CD2 4.29Å; I73-Y84 HydrophobicContact CD1-CD1 4.26Å; I73-Y84 PolarHBondContact N-O 3.09Å; I73-Y84 PolarHBondContact O-N 3.09Å; Y84-P86 HydrophobicContact CD1-CB 4.39Å; Y84-P86 HydrophobicContact CE1-CB 3.71Å; Y84-P86 HydrophobicContact CE1-CG 4.44Å
85	I	94.1	Very high	92.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	104	175.1	-48.1	-177.1	0	0	0	106.2	Y36 L37 Y72 I83 N87 V88 D92 W96	Y36-I85 CarbonylContact C-O 3.55Å; Y36-I85 WeakPolarHBondContact CA-O 3.16Å; Y36-I85 WeakPolarHBondContact CB-O 3.22Å; L37-I85 HydrophobicContact CB-CB 4.29Å; L37-I85 HydrophobicContact CB-CD1 4.46Å; L37-I85 HydrophobicContact CD2-CD1 4.09Å; L37-I85 PolarHBondContact N-O 3.49Å; L37-I85 PolarHBondContact O-N 2.96Å; Y72-I85 HydrophobicContact CD1-CB 4.42Å; Y72-I85 HydrophobicContact CD1-CD1 4.1Å; Y72-I85 HydrophobicContact CD1-CG1 3.77Å; Y72-I85 HydrophobicContact CD1-CG2 4.15Å; Y72-I85 HydrophobicContact CE1-CD1 3.84Å; Y72-I85 HydrophobicContact CE1-CG1 4.02Å; Y72-I85 HydrophobicContact CE1-CG2 4.11Å; I83-I85 HydrophobicContact CG2-CG1 4.2Å; I85-N87 VanDerWaalsContact C-N 3.34Å; I85-N87 PolarHBondContact O-N 3.16Å; I85-V88 HydrophobicContact CB-CG2 4.2Å; I85-V88 HydrophobicContact CG2-CG2 4Å; I85-D92 HydrophobicContact CD1-CB 4.44Å; I85-W96 HydrophobicContact CD1-CH2 3.91Å; I85-W96 HydrophobicContact CD1-CZ2 3.88Å
86	P	90.7	Very high	93	Very high	59 Å²	59	54.1 Å²	54.1	38%	0.383	26%	0.263	S	S	.	.	S	Bend	trans	-69.2	-31.6	-176.2	24	-31	0	0	0	113.2	R71 Y84	R71-P86 VanDerWaalsContact O-CD 3.26Å; R71-P86 WeakPolarHBondContact O-CD 3.45Å; Y84-P86 HydrophobicContact CD1-CB 4.39Å; Y84-P86 HydrophobicContact CE1-CB 3.71Å; Y84-P86 HydrophobicContact CE1-CG 4.44Å
87	N	91.6	Very high	93.2	Very high	87 Å²	87	48.5 Å²	48.5	47%	0.465	24%	0.243	S	C	.	.	S	Bend	trans	-135.6	95.5	-179.1	-177.7	-5.4	0	0	0	109	G34 S35 I85	G34-N87 WeakPolarHBondContact CA-OD1 3.48Å; S35-N87 CarbonylContact O-C 3.54Å; S35-N87 WeakPolarHBondContact O-CA 3.31Å; I85-N87 VanDerWaalsContact C-N 3.34Å; I85-N87 PolarHBondContact O-N 3.16Å
88	V	93.9	Very high	93.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.217	C	C	.	.			trans	-70.3	130.2	-178.7	176.6	0	0	0	0	110.1	T31 S33 G34 S35 L37 I85 D92 V112	T31-V88 HydrophobicContact CG2-CB 4.33Å; T31-V88 HydrophobicContact CG2-CG1 3.74Å; T31-V88 HydrophobicContact CG2-CG2 4.22Å; S33-V88 CarbonylContact C-O 3.53Å; S33-V88 VanDerWaalsContact CA-O 3.24Å; S33-V88 WeakPolarHBondContact CA-O 3.26Å; S33-V88 PolarHBondContact OG-O 3.43Å; G34-V88 PolarHBondContact N-O 2.88Å; S35-V88 WeakPolarHBondContact O-CB 3.34Å; S35-V88 VanDerWaalsContact O-CG2 3.26Å; S35-V88 WeakPolarHBondContact O-CG2 3.44Å; S35-V88 PolarHBondContact O-N 2.85Å; L37-V88 HydrophobicContact CB-CG2 3.45Å; L37-V88 VanDerWaalsContact CB-CG2 3.45Å; I85-V88 HydrophobicContact CB-CG2 4.2Å; I85-V88 HydrophobicContact CG2-CG2 4Å; V88-D92 HydrophobicContact CG1-CB 4.22Å; V88-V112 HydrophobicContact CG1-CB 4.42Å; V88-V112 HydrophobicContact CG1-CG1 3.8Å; V88-V112 HydrophobicContact CG1-CG2 3.66Å
89	K	92.9	Very high	93.8	Very high	89 Å²	89	37.6 Å²	37.6	39%	0.387	19%	0.187	S	C	.	.			trans	-106.5	161.2	173.8	-63.9	-176.6	177.1	-174.4	0	110.5	E91 D92	K89-E91 HydrophobicContact CB-CG 3.71Å; K89-E91 HydrophobicContact CD-CG 4.33Å; K89-E91 WeakPolarHBondContact CD-OE1 2.97Å; K89-E91 PolarHBondContact O-N 3.09Å; K89-D92 PolarHBondContact N-OD2 2.85Å; K89-D92 WeakPolarHBondContact O-CB 3.31Å; K89-D92 PolarHBondContact O-N 3.47Å
90	F	92.5	Very high	93.9	Very high	20 Å²	20	34.4 Å²	34.4	9%	0.088	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-59.1	-33.7	177.4	-172.5	-110.9	0	0	0	112.6	D92 R93 V112 V114 E247 V248 L250	F90-D92 PolarHBondContact O-N 2.82Å; F90-R93 WeakPolarHBondContact O-CB 3.47Å; F90-R93 PolarHBondContact O-N 2.89Å; F90-V112 HydrophobicContact CD2-CB 4.4Å; F90-V112 WeakPolarHBondContact CD2-O 3.47Å; F90-V114 HydrophobicContact CB-CG2 3.97Å; F90-V114 HydrophobicContact CD2-CG2 3.72Å; F90-V114 HydrophobicContact CG-CG2 4.12Å; F90-E247 HydrophobicContact CD1-CB 4.22Å; F90-E247 WeakPolarHBondContact CD1-OE2 3.43Å; F90-E247 HydrophobicContact CE1-CB 4.33Å; F90-V248 WeakPolarHBondContact CE1-O 3.43Å; F90-L250 HydrophobicContact CB-CD1 4.45Å; F90-L250 HydrophobicContact CD1-CD1 3.86Å; F90-L250 HydrophobicContact CD1-CD2 4.28Å; F90-L250 HydrophobicContact CD1-CG 3.91Å; F90-L250 HydrophobicContact CD2-CD1 4.47Å; F90-L250 HydrophobicContact CD2-CD2 3.75Å; F90-L250 HydrophobicContact CD2-CG 4.29Å; F90-L250 HydrophobicContact CE1-CD1 4.16Å; F90-L250 HydrophobicContact CE1-CD2 4.06Å; F90-L250 HydrophobicContact CE1-CG 3.68Å; F90-L250 HydrophobicContact CE2-CD2 3.5Å; F90-L250 VanDerWaalsContact CE2-CD2 3.5Å; F90-L250 HydrophobicContact CE2-CG 4.09Å; F90-L250 HydrophobicContact CG-CD1 4.01Å; F90-L250 HydrophobicContact CG-CD2 4.12Å; F90-L250 HydrophobicContact CG-CG 4.18Å; F90-L250 HydrophobicContact CZ-CD2 3.65Å; F90-L250 HydrophobicContact CZ-CG 3.76Å
91	E	91.9	Very high	93.7	Very high	97 Å²	97	33.8 Å²	33.8	45%	0.453	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-61.4	-21.6	173.8	59.8	177.6	-171.9	0	0	114.3	H54 R71 K89 R93	H54-E91 PolarHBondContact CE1-O 2.96Å; R71-E91 IonicContact CZ-OE1 3.02Å; R71-E91 IonicContact NE-OE1 3.13Å; R71-E91 IonicContact NH1-OE1 2.75Å; R71-E91 IonicContact NH2-OE1 2.74Å; R71-E91 PolarHBondContact NH2-OE1 3.12Å; K89-E91 HydrophobicContact CB-CG 3.71Å; K89-E91 HydrophobicContact CD-CG 4.33Å; K89-E91 WeakPolarHBondContact CD-OE1 2.97Å; K89-E91 PolarHBondContact O-N 3.09Å; E91-R93 PolarHBondContact O-N 3.26Å
92	D	93.7	Very high	93	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-76.2	-5.1	176.8	-57.2	-45.4	0	0	0	111.9	H54 R71 Y72 I85 V88 K89 F90 W96	H54-D92 PolarHBondContact NE2-O 3.43Å; R71-D92 IonicContact CZ-OD1 3.66Å; R71-D92 IonicContact CZ-OD2 3.59Å; R71-D92 IonicContact NH1-OD1 3.85Å; R71-D92 PolarHBondContact NH1-OD1 3.11Å; R71-D92 IonicContact NH1-OD2 2.87Å; R71-D92 PolarHBondContact NH1-OD2 3.45Å; R71-D92 IonicContact NH2-OD1 3.54Å; R71-D92 PolarHBondContact NH2-OD1 2.9Å; Y72-D92 PolarHBondContact OH-OD1 2.92Å; I85-D92 HydrophobicContact CD1-CB 4.44Å; V88-D92 HydrophobicContact CG1-CB 4.22Å; K89-D92 PolarHBondContact N-OD2 2.85Å; K89-D92 WeakPolarHBondContact O-CB 3.31Å; K89-D92 PolarHBondContact O-N 3.47Å; F90-D92 PolarHBondContact O-N 2.82Å; D92-W96 HydrophobicContact CB-CZ2 4.42Å; D92-W96 PolarHBondContact O-NE1 3.07Å
93	R	95.2	Very high	92.3	Very high	103 Å²	103	47.3 Å²	47.3	39%	0.389	25%	0.252	S	S	.	.			trans	-61.7	151.3	172.7	-179.2	178.2	171.6	-137.4	-9.9	111.6	H54 N55 F90 E91 I110 D111 V112	H54-R93 PolarHBondContact NE2-O 2.85Å; N55-R93 PolarHBondContact ND2-O 3.12Å; F90-R93 WeakPolarHBondContact O-CB 3.47Å; F90-R93 PolarHBondContact O-N 2.89Å; E91-R93 PolarHBondContact O-N 3.26Å; R93-I110 WeakPolarHBondContact CA-O 3.09Å; R93-I110 WeakPolarHBondContact CG-O 3.02Å; R93-D111 IonicContact NE-OD1 3.02Å; R93-D111 PolarHBondContact NE-OD1 3.29Å; R93-D111 VanDerWaalsContact NE-OD1 3.13Å; R93-V112 HydrophobicContact CB-CB 4.25Å; R93-V112 HydrophobicContact CB-CG2 4Å
94	G	95.5	Very high	91.9	Very high	11 Å²	11	48.2 Å²	48.2	11%	0.113	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.9	-156.9	169.7	0	0	0	0	0	113.2	N55 W96 N109 I110	N55-G94 WeakPolarHBondContact OD1-CA 3.44Å; G94-W96 PolarHBondContact O-N 3.35Å; G94-N109 WeakPolarHBondContact O-CA 3.44Å; G94-I110 PolarHBondContact N-O 2.89Å; G94-I110 PolarHBondContact O-N 3.19Å
95	N	97.5	Very high	91.8	Very high	75 Å²	75	49.7 Å²	49.7	40%	0.401	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	110.4	-173	-69.8	-16.2	0	0	0	110.1	H54 N55 V107 N109	H54-N95 CarbonylContact C-O 3.57Å; H54-N95 WeakPolarHBondContact CA-O 3.34Å; N55-N95 PolarHBondContact N-O 3.47Å; N55-N95 PolarHBondContact OD1-N 3.38Å; N95-V107 HydrophobicContact CB-CG1 3.88Å; N95-N109 PolarHBondContact OD1-ND2 3.49Å
96	W	97.4	Very high	91.8	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	137.8	167.8	-72.2	78.5	0	0	0	108.8	F23 L39 S53 H54 I59 Y72 I83 I85 D92 G94 V107 I108 I110	F23-W96 HydrophobicContact CE1-CB 4.48Å; F23-W96 WeakPolarHBondContact CE1-O 3.49Å; F23-W96 HydrophobicContact CZ-CB 4.16Å; L39-W96 HydrophobicContact CD1-CB 4.17Å; L39-W96 HydrophobicContact CD1-CD2 3.4Å; L39-W96 VanDerWaalsContact CD1-CD2 3.4Å; L39-W96 HydrophobicContact CD1-CE3 3.15Å; L39-W96 HydrophobicContact CD1-CG 3.85Å; L39-W96 HydrophobicContact CD1-CH2 4.34Å; L39-W96 HydrophobicContact CD1-CZ3 3.64Å; S53-W96 WeakPolarHBondContact O-CA 3.29Å; H54-W96 HydrophobicContact CB-CD2 4.29Å; H54-W96 HydrophobicContact CB-CE3 4.29Å; H54-W96 HydrophobicContact CB-CH2 4.4Å; H54-W96 HydrophobicContact CB-CZ2 4.36Å; H54-W96 HydrophobicContact CB-CZ3 4.39Å; H54-W96 AromaticContact CD2-CD1 3.71Å; H54-W96 AromaticContact CD2-CD2 3.87Å; H54-W96 AromaticContact CD2-CE2 3.36Å; H54-W96 AromaticContact CD2-CZ2 3.77Å; H54-W96 AromaticContact CD2-NE1 3.25Å; H54-W96 PolarHBondContact CD2-NE1 3.14Å; H54-W96 AromaticContact CG-CE2 3.95Å; H54-W96 AromaticContact NE2-CE2 3.97Å; H54-W96 AromaticContact NE2-NE1 3.63Å; I59-W96 HydrophobicContact CD1-CE3 4.2Å; I59-W96 HydrophobicContact CD1-CH2 3.99Å; I59-W96 HydrophobicContact CD1-CZ3 3.38Å; Y72-W96 HydrophobicContact CE2-CH2 4.16Å; I83-W96 HydrophobicContact CD1-CZ3 4.34Å; I85-W96 HydrophobicContact CD1-CH2 3.91Å; I85-W96 HydrophobicContact CD1-CZ2 3.88Å; D92-W96 HydrophobicContact CB-CZ2 4.42Å; D92-W96 PolarHBondContact O-NE1 3.07Å; G94-W96 PolarHBondContact O-N 3.35Å; W96-V107 CarbonylContact O-C 3.52Å; W96-V107 VanDerWaalsContact O-CA 3.29Å; W96-V107 WeakPolarHBondContact O-CA 3.35Å; W96-V107 WeakPolarHBondContact O-CG1 3.25Å; W96-I108 PolarHBondContact N-O 2.87Å; W96-I108 PolarHBondContact O-N 3.46Å; W96-I110 HydrophobicContact CB-CG1 4.42Å; W96-I110 HydrophobicContact CG-CG1 4.06Å
97	S	96.1	Very high	92.1	Very high	6 Å²	6	55.9 Å²	55.9	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	144.7	175.6	68.1	0	0	0	0	112	W52 S53 Q105 K106	W52-S97 WeakPolarHBondContact CA-O 3.27Å; S53-S97 WeakPolarHBondContact CB-OG 3.47Å; S53-S97 PolarHBondContact N-O 2.77Å; S53-S97 PolarHBondContact O-N 3.28Å; S97-Q105 PolarHBondContact OG-NE2 3.18Å; S97-K106 CarbonylContact C-O 3.52Å; S97-K106 WeakPolarHBondContact CA-O 3.09Å; S97-K106 VanDerWaalsContact CB-O 3.26Å; S97-K106 WeakPolarHBondContact CB-O 3.32Å
98	C	94.9	Very high	92.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.5	162.8	74	0	0	0	0	110	I21 F23 C41 I50 I51 W52 Q105 K106	I21-C98 VanDerWaalsContact CD1-SG 3.58Å; F23-C98 HydrophobicContact CD2-CB 4.42Å; C41-C98 HydrophobicContact CB-CB 3.62Å; C41-C98 WeakPolarHBondContact CB-SG 3.48Å; C41-C98 WeakPolarHBondContact SG-CB 3.48Å; C41-C98 CovalentContact SG-SG 2.05Å; C41-C98 PolarHBondContact SG-SG 3.3Å; I50-C98 HydrophobicContact CG2-CB 4.31Å; I51-C98 CarbonylContact O-C 3.41Å; I51-C98 VanDerWaalsContact O-CA 3.31Å; I51-C98 WeakPolarHBondContact O-CA 3.47Å; W52-C98 HydrophobicContact CD2-CB 4.37Å; W52-C98 HydrophobicContact CE3-CB 4.11Å; W52-C98 HydrophobicContact CH2-CB 4.39Å; W52-C98 HydrophobicContact CZ3-CB 4.13Å; C98-Q105 WeakPolarHBondContact O-CA 3.45Å; C98-K106 PolarHBondContact N-O 3.37Å; C98-K106 PolarHBondContact O-N 2.94Å
99	A	93.8	Very high	92.5	Very high	14 Å²	14	57.5 Å²	57.5	12%	0.116	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.4	179.3	0	0	0	0	0	110.8	I50 I51 S104 Q105	I50-A99 WeakPolarHBondContact CA-O 3.01Å; I51-A99 HydrophobicContact CB-CB 4.43Å; I51-A99 PolarHBondContact N-O 2.85Å; I51-A99 PolarHBondContact O-N 2.9Å; A99-S104 CarbonylContact C-O 3.56Å; A99-S104 VanDerWaalsContact CA-O 3.3Å; A99-S104 WeakPolarHBondContact CA-O 3.32Å; A99-Q105 HydrophobicContact CB-CB 4.17Å; A99-Q105 HydrophobicContact CB-CG 4.11Å
100	H	90.8	Very high	92.7	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	101.5	174.8	178.7	-105.7	0	0	0	108.3	Q19 I21 S43 N45 F48 I50 S104	Q19-H100 PolarHBondContact OE1-CE1 3.34Å; Q19-H100 PolarHBondContact OE1-ND1 3.37Å; I21-H100 HydrophobicContact CD1-CB 3.86Å; S43-H100 PolarHBondContact OG-ND1 3.44Å; N45-H100 PolarHBondContact O-CE1 3.15Å; N45-H100 PolarHBondContact O-NE2 2.66Å; F48-H100 AromaticContact CD2-CE1 3.83Å; F48-H100 PolarHBondContact N-NE2 3.42Å; F48-H100 PolarHBondContact O-CD2 2.78Å; F48-H100 PolarHBondContact O-NE2 3.48Å; I50-H100 HydrophobicContact CD1-CB 3.75Å; H100-S104 PolarHBondContact N-O 3.4Å; H100-S104 WeakPolarHBondContact O-CB 3.14Å
101	G	86	Confident	92.8	Very high	26 Å²	26	54.5 Å²	54.5	27%	0.268	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-168.9	-172	0	0	0	0	0	113.4	K103	G101-K103 VanDerWaalsContact C-N 3.34Å; G101-K103 PolarHBondContact O-N 2.92Å
102	A	81	Confident	92.9	Very high	114 Å²	114	49.9 Å²	49.9	94%	0.942	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.2	-170.9	0	0	0	0	0	115.4
103	K	79	Confident	92.9	Very high	206 Å²	206	50.2 Å²	50.2	90%	0.896	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-15.2	-169.8	-67.3	-173	179.3	-179	0	115.1	G101	G101-K103 VanDerWaalsContact C-N 3.34Å; G101-K103 PolarHBondContact O-N 2.92Å
104	S	87.3	Confident	92.8	Very high	19 Å²	19	46.3 Å²	46.3	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	98.5	-175.5	-65.3	0	0	0	0	110.2	Q19 A99 H100	Q19-S104 PolarHBondContact O-OG 3.06Å; A99-S104 CarbonylContact C-O 3.56Å; A99-S104 VanDerWaalsContact CA-O 3.3Å; A99-S104 WeakPolarHBondContact CA-O 3.32Å; H100-S104 PolarHBondContact N-O 3.4Å; H100-S104 WeakPolarHBondContact O-CB 3.14Å
105	Q	92.3	Very high	92.5	Very high	116 Å²	116	49.9 Å²	49.9	54%	0.542	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.9	173.7	-175.4	-179.5	16.1	0	0	109.9	S97 C98 A99 V107	S97-Q105 PolarHBondContact OG-NE2 3.18Å; C98-Q105 WeakPolarHBondContact O-CA 3.45Å; A99-Q105 HydrophobicContact CB-CB 4.17Å; A99-Q105 HydrophobicContact CB-CG 4.11Å; Q105-V107 HydrophobicContact CG-CG2 4.4Å
106	K	94.8	Very high	92	Very high	111 Å²	111	46.3 Å²	46.3	48%	0.483	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143	169.9	-69.2	-71.3	-176.7	179.9	0	109.5	I21 F23 S97 C98	I21-K106 HydrophobicContact CG2-CG 3.58Å; F23-K106 HydrophobicContact CB-CB 3.63Å; F23-K106 HydrophobicContact CB-CG 4.34Å; F23-K106 HydrophobicContact CD1-CB 4.03Å; F23-K106 HydrophobicContact CG-CB 4.27Å; S97-K106 CarbonylContact C-O 3.52Å; S97-K106 WeakPolarHBondContact CA-O 3.09Å; S97-K106 VanDerWaalsContact CB-O 3.26Å; S97-K106 WeakPolarHBondContact CB-O 3.32Å; C98-K106 PolarHBondContact N-O 3.37Å; C98-K106 PolarHBondContact O-N 2.94Å
107	V	96	Very high	91.5	Very high	79 Å²	79	48.6 Å²	48.6	48%	0.479	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.3	-178.1	-170.6	0	0	0	0	108.3	N95 W96 Q105	N95-V107 HydrophobicContact CB-CG1 3.88Å; W96-V107 CarbonylContact O-C 3.52Å; W96-V107 VanDerWaalsContact O-CA 3.29Å; W96-V107 WeakPolarHBondContact O-CA 3.35Å; W96-V107 WeakPolarHBondContact O-CG1 3.25Å; Q105-V107 HydrophobicContact CG-CG2 4.4Å
108	I	96.8	Very high	90.9	Very high	33 Å²	33	48.3 Å²	48.3	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.9	170.1	-63.2	171.4	0	0	0	107.5	F23 T25 N29 W96 I110	F23-I108 HydrophobicContact CB-CD1 4.31Å; F23-I108 HydrophobicContact CD1-CB 4.15Å; F23-I108 HydrophobicContact CD1-CD1 3.45Å; F23-I108 VanDerWaalsContact CD1-CD1 3.45Å; F23-I108 HydrophobicContact CD1-CG1 3.47Å; F23-I108 VanDerWaalsContact CD1-CG1 3.47Å; F23-I108 HydrophobicContact CD2-CD1 4.27Å; F23-I108 HydrophobicContact CE1-CB 3.7Å; F23-I108 HydrophobicContact CE1-CD1 3.67Å; F23-I108 HydrophobicContact CE1-CG1 3.58Å; F23-I108 HydrophobicContact CE2-CD1 4.43Å; F23-I108 HydrophobicContact CG-CD1 3.75Å; F23-I108 HydrophobicContact CG-CG1 4.27Å; F23-I108 HydrophobicContact CZ-CB 4.4Å; F23-I108 HydrophobicContact CZ-CD1 4.16Å; F23-I108 HydrophobicContact CZ-CG1 4.44Å; T25-I108 HydrophobicContact CG2-CB 4.4Å; T25-I108 HydrophobicContact CG2-CD1 3.72Å; T25-I108 HydrophobicContact CG2-CG2 3.95Å; N29-I108 HydrophobicContact CB-CG2 4.17Å; W96-I108 PolarHBondContact N-O 2.87Å; W96-I108 PolarHBondContact O-N 3.46Å; I108-I110 HydrophobicContact CG2-CD1 3.74Å
109	N	97.3	Very high	90.4	Very high	87 Å²	87	51.7 Å²	51.7	47%	0.465	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	122.9	171	-174.2	-89.1	0	0	0	109.1	G94 N95	G94-N109 WeakPolarHBondContact O-CA 3.44Å; N95-N109 PolarHBondContact OD1-ND2 3.49Å
110	I	96.8	Very high	89.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.5	176.1	-54.5	-58.2	0	0	0	108.7	T25 N29 T31 L37 L39 R93 G94 W96 I108 V112	T25-I110 HydrophobicContact CG2-CD1 3.69Å; N29-I110 HydrophobicContact CB-CD1 4.43Å; N29-I110 WeakPolarHBondContact O-CA 3.45Å; T31-I110 HydrophobicContact CG2-CG2 4.49Å; L37-I110 HydrophobicContact CD2-CG1 4.27Å; L37-I110 HydrophobicContact CD2-CG2 3.8Å; L39-I110 HydrophobicContact CD2-CD1 4.15Å; L39-I110 HydrophobicContact CD2-CG1 4.45Å; R93-I110 WeakPolarHBondContact CA-O 3.09Å; R93-I110 WeakPolarHBondContact CG-O 3.02Å; G94-I110 PolarHBondContact N-O 2.89Å; G94-I110 PolarHBondContact O-N 3.19Å; W96-I110 HydrophobicContact CB-CG1 4.42Å; W96-I110 HydrophobicContact CG-CG1 4.06Å; I108-I110 HydrophobicContact CG2-CD1 3.74Å; I110-V112 HydrophobicContact CG2-CG2 4.33Å
111	D	95.1	Very high	89.4	Confident	47 Å²	47	51.7 Å²	51.7	25%	0.251	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	136.8	170.7	-158.8	26.3	0	0	0	110.6	N29 V30 T31 R93	N29-D111 PolarHBondContact O-N 2.78Å; V30-D111 WeakPolarHBondContact CA-O 3.28Å; V30-D111 HydrophobicContact CG1-CB 4.43Å; V30-D111 HydrophobicContact CG2-CB 4.28Å; T31-D111 PolarHBondContact N-O 2.04Å; R93-D111 IonicContact NE-OD1 3.02Å; R93-D111 PolarHBondContact NE-OD1 3.29Å; R93-D111 VanDerWaalsContact NE-OD1 3.13Å
112	V	94.6	Very high	89.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	113.7	-179.3	-177.4	0	0	0	0	108.3	T31 V88 F90 R93 I110	T31-V112 HydrophobicContact CG2-CG2 4.09Å; T31-V112 WeakPolarHBondContact O-CA 3.46Å; V88-V112 HydrophobicContact CG1-CB 4.42Å; V88-V112 HydrophobicContact CG1-CG1 3.8Å; V88-V112 HydrophobicContact CG1-CG2 3.66Å; F90-V112 HydrophobicContact CD2-CB 4.4Å; F90-V112 WeakPolarHBondContact CD2-O 3.47Å; R93-V112 HydrophobicContact CB-CB 4.25Å; R93-V112 HydrophobicContact CB-CG2 4Å; I110-V112 HydrophobicContact CG2-CG2 4.33Å
113	L	93.5	Very high	89.1	Confident	6 Å²	6	52 Å²	52	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131	177	-54.3	-171.8	0	0	0	109.5	V30 T31 L32 S33 T191 M293 K296 L297 L300	V30-L113 HydrophobicContact CG1-CD1 3.81Å; V30-L113 HydrophobicContact CG1-CD2 4.31Å; V30-L113 HydrophobicContact CG1-CG 3.8Å; T31-L113 PolarHBondContact O-N 3.4Å; L32-L113 CarbonylContact C-O 3.59Å; L32-L113 WeakPolarHBondContact CA-O 3.38Å; L32-L113 HydrophobicContact CD1-CB 4.33Å; L32-L113 WeakPolarHBondContact CD1-O 3.32Å; S33-L113 PolarHBondContact N-O 3.37Å; L113-T191 WeakPolarHBondContact CA-OG1 3.47Å; L113-T191 HydrophobicContact CD2-CG2 3.96Å; L113-M293 HydrophobicContact CB-CE 4.05Å; L113-M293 HydrophobicContact CD1-CE 3.9Å; L113-M293 HydrophobicContact CD1-SD 4.19Å; L113-M293 HydrophobicContact CD2-CE 4.09Å; L113-M293 HydrophobicContact CG-CE 4.23Å; L113-K296 HydrophobicContact CD1-CB 4.21Å; L113-L297 HydrophobicContact CB-CD2 4.36Å; L113-L300 HydrophobicContact CD1-CD1 3.78Å; L113-L300 HydrophobicContact CG-CD1 4.45Å
114	V	91.7	Very high	88.8	Confident	22 Å²	22	44.9 Å²	44.9	13%	0.133	22%	0.222	C	C	.	.			trans	-108.2	122.5	174.3	-175.9	0	0	0	0	107.6	F90 C189 A190 T191 L250	F90-V114 HydrophobicContact CB-CG2 3.97Å; F90-V114 HydrophobicContact CD2-CG2 3.72Å; F90-V114 HydrophobicContact CG-CG2 4.12Å; V114-C189 VanDerWaalsContact CG1-O 3.25Å; V114-C189 WeakPolarHBondContact CG1-O 3.46Å; V114-A190 WeakPolarHBondContact O-CB 3.47Å; V114-T191 PolarHBondContact N-OG1 2.93Å; V114-T191 PolarHBondContact O-N 2.95Å; V114-L250 HydrophobicContact CB-CD2 3.96Å; V114-L250 HydrophobicContact CG2-CD1 4.34Å; V114-L250 HydrophobicContact CG2-CD2 3.78Å
115	K	90.1	Very high	87.4	Confident	86 Å²	86	47 Å²	47	37%	0.374	24%	0.235	S	C	.	.			trans	-73.5	142.4	173.6	-170.8	-179.3	175.3	-173.4	0	108.7
116	A	86.6	Confident	85.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.			trans	-83.4	131.6	171.5	0	0	0	0	0	108.1	A190 V193 P287 Y289	A116-A190 HydrophobicContact CB-CB 3.4Å; A116-V193 HydrophobicContact CB-CB 4.27Å; A116-V193 HydrophobicContact CB-CG2 4.41Å; A116-P287 HydrophobicContact CB-CB 3.78Å; A116-P287 HydrophobicContact CB-CG 4.12Å; A116-P287 WeakPolarHBondContact O-CG 3.12Å; A116-Y289 VanDerWaalsContact CA-OH 3.3Å; A116-Y289 WeakPolarHBondContact CA-OH 3.31Å; A116-Y289 HydrophobicContact CB-CE1 4.37Å; A116-Y289 WeakPolarHBondContact CB-OH 3.48Å; A116-Y289 PolarHBondContact N-OH 3.08Å; A116-Y289 PolarHBondContact O-OH 2.82Å
117	D	86.6	Confident	83.1	Confident	47 Å²	47	44 Å²	44	25%	0.251	24%	0.236	S	C	.	.			trans	-105.5	172.1	162.2	-65.9	-41.5	0	0	0	107.9	T187 S188 S340 Q341	D117-T187 CarbonylContact O-C 3.55Å; D117-T187 WeakPolarHBondContact O-CA 3.41Å; D117-T187 WeakPolarHBondContact O-CB 2.93Å; D117-S188 PolarHBondContact N-OG 2.92Å; D117-S188 PolarHBondContact O-N 2.83Å; D117-S188 PolarHBondContact O-OG 2.9Å; D117-S340 VanDerWaalsContact CB-CB 3.41Å; D117-S340 WeakPolarHBondContact CB-OG 3.37Å; D117-Q341 CarbonylContact C-O 3.42Å; D117-Q341 WeakPolarHBondContact CA-O 3.24Å
118	V	85	Confident	80.3	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-123.6	125.9	-172.7	-179.6	0	0	0	0	107.7	C185 T187 C285 P287 S340 Q341 A344	V118-C185 WeakPolarHBondContact CG1-SG 3.42Å; V118-T187 HydrophobicContact CG2-CG2 4.45Å; V118-C285 VanDerWaalsContact CG1-SG 3.59Å; V118-P287 HydrophobicContact CG2-CB 4.46Å; V118-P287 HydrophobicContact CG2-CG 4.11Å; V118-S340 WeakPolarHBondContact O-CA 3.13Å; V118-Q341 PolarHBondContact N-O 2.88Å; V118-Q341 PolarHBondContact O-N 3.36Å; V118-A344 HydrophobicContact CB-CB 4.24Å; V118-A344 HydrophobicContact CG1-CB 3.64Å
119	Y	83	Confident	77.1	Confident	72 Å²	72	47.9 Å²	47.9	28%	0.282	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-71.2	150.8	172.7	-63.6	-70.4	0	0	0	110.1	T186 G338	Y119-T186 HydrophobicContact CD2-CG2 4.34Å; Y119-T186 WeakPolarHBondContact CD2-O 3.43Å; Y119-T186 PolarHBondContact N-O 3.21Å; Y119-G338 WeakPolarHBondContact CD1-O 3.49Å; Y119-G338 WeakPolarHBondContact CE1-O 3.19Å
120	P	79.5	Confident	74.1	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.084	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-47.4	138.4	172.6	-31.5	38.9	0	0	0	112.1	L332 I333 D334 H339	P120-L332 WeakPolarHBondContact CB-O 3.5Å; P120-I333 VanDerWaalsContact CB-C 3.49Å; P120-D334 HydrophobicContact CB-CB 3.83Å; P120-H339 WeakPolarHBondContact CD-O 3.24Å
121	P	84.1	Confident	70.7	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-67.7	144.2	-173	-16.5	32.2	0	0	0	111	I183 E184 A344	P121-I183 HydrophobicContact CB-CG2 3.69Å; P121-E184 CarbonylContact C-O 3.59Å; P121-E184 VanDerWaalsContact CA-O 3.28Å; P121-E184 WeakPolarHBondContact CA-O 3.07Å; P121-A344 HydrophobicContact CG-CB 4.08Å
122	K	81.8	Confident	67.5	Low	94 Å²	94	62.3 Å²	62.3	41%	0.409	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	136.1	176.5	-60	-171	-178.3	-154.8	0	110.3	E184 D334	K122-E184 HydrophobicContact CB-CB 4.33Å; K122-E184 PolarHBondContact N-O 2.7Å; K122-E184 PolarHBondContact O-N 2.91Å; K122-D334 WeakPolarHBondContact CE-OD2 3.46Å; K122-D334 IonicContact NZ-OD2 3.92Å; K122-D334 PolarHBondContact NZ-OD2 2.98Å
123	L	78.8	Confident	64.4	Low	53 Å²	53	68.1 Å²	68.1	28%	0.277	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.1	170.6	-72	157.9	0	0	0	108.8	I158 I168 I181 I183 I333 I346	L123-I158 HydrophobicContact CD1-CD1 4.5Å; L123-I168 HydrophobicContact CD1-CD1 3.7Å; L123-I168 HydrophobicContact CD1-CG1 4.5Å; L123-I168 HydrophobicContact CD2-CD1 3.69Å; L123-I168 HydrophobicContact CG-CD1 4.21Å; L123-I181 HydrophobicContact CD2-CD1 3.99Å; L123-I183 HydrophobicContact CD2-CG1 4.31Å; L123-I333 HydrophobicContact CD1-CD1 4.21Å; L123-I346 HydrophobicContact CD1-CD1 4.45Å; L123-I346 HydrophobicContact CD2-CD1 4.2Å; L123-I346 HydrophobicContact CG-CD1 4.26Å
124	L	72.9	Confident	61.3	Low	56 Å²	56	75.6 Å²	75.6	29%	0.293	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.8	177.1	-56.2	176.7	0	0	0	110.1	F182 E184 R256	L124-F182 HydrophobicContact CB-CB 3.85Å; L124-F182 HydrophobicContact CD1-CB 4.3Å; L124-F182 PolarHBondContact N-O 2.76Å; L124-E184 HydrophobicContact CD1-CB 3.91Å; L124-E184 WeakPolarHBondContact CD1-OE2 3.05Å; L124-E184 HydrophobicContact CD2-CB 4.29Å; L124-E184 HydrophobicContact CG-CB 3.97Å; L124-R256 HydrophobicContact CD1-CG 4.14Å
125	T	59.3	Low	58.2	Low	64 Å²	64	81.3 Å²	81.3	39%	0.393	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-73.1	139.9	173	53.3	0	0	0	0	110.8	S127 I155	T125-S127 PolarHBondContact O-N 3.24Å; T125-S127 VanDerWaalsContact O-N 3.09Å; T125-I155 HydrophobicContact CG2-CD1 4.13Å; T125-I155 HydrophobicContact CG2-CG1 3.44Å; T125-I155 VanDerWaalsContact CG2-CG1 3.44Å
126	L	56.8	Low	55.4	Low	57 Å²	57	86 Å²	86	30%	0.298	47%	0.465	S	S	.	.			trans	-64.4	111.8	163.7	-76.3	109.1	0	0	0	108.4	T128 N179 G180 F182	L126-T128 PolarHBondContact O-N 2.9Å; L126-N179 HydrophobicContact CD1-CB 4.1Å; L126-N179 HydrophobicContact CD2-CB 3.71Å; L126-G180 WeakPolarHBondContact CD1-O 3.34Å; L126-F182 HydrophobicContact CD1-CD2 4.5Å; L126-F182 HydrophobicContact CD2-CE2 4.03Å; L126-F182 HydrophobicContact CG-CD2 4.18Å; L126-F182 HydrophobicContact CG-CE2 4.01Å
127	S	39.4	Very low	52.6	Low	108 Å²	108	93 Å²	93	76%	0.755	50%	0.503	S	S	*	.			trans	-63.4	90.6	169.5	175.3	0	0	0	0	108.2	T125 S129	T125-S127 PolarHBondContact O-N 3.24Å; T125-S127 VanDerWaalsContact O-N 3.09Å; S127-S129 PolarHBondContact O-N 2.82Å
128	T	37.4	Very low	50.1	Low	78 Å²	78	96.8 Å²	96.8	48%	0.479	53%	0.53	S	S	.	.			trans	-68.4	104.8	168.1	12.4	0	0	0	0	106.3	L126 V130	L126-T128 PolarHBondContact O-N 2.9Å; T128-V130 HydrophobicContact CG2-CG2 4Å; T128-V130 PolarHBondContact O-N 2.81Å
129	S	29.6	Very low	47.4	Very low	115 Å²	115	102.7 Å²	102.7	80%	0.804	57%	0.566	S	S	*	*			trans	-67.1	55.5	163.1	41.6	0	0	0	0	109.9	S127 K131	S127-S129 PolarHBondContact O-N 2.82Å; S129-K131 VanDerWaalsContact C-N 3.33Å; S129-K131 PolarHBondContact O-N 2.81Å
130	V	33	Very low	44.8	Very low	94 Å²	94	106.8 Å²	106.8	57%	0.57	59%	0.591	S	S	*	*			trans	-76.7	94.4	168.7	174.6	0	0	0	0	105.3	T128 L132	T128-V130 HydrophobicContact CG2-CG2 4Å; T128-V130 PolarHBondContact O-N 2.81Å; V130-L132 VanDerWaalsContact C-N 3.31Å; V130-L132 PolarHBondContact O-N 2.87Å
131	K	27.1	Very low	42.5	Very low	199 Å²	199	113 Å²	113	87%	0.865	62%	0.622	S	S	*	*			trans	-55.9	100.6	161.3	-70.4	179.9	177.9	179.2	0	106.5	S129	S129-K131 VanDerWaalsContact C-N 3.33Å; S129-K131 PolarHBondContact O-N 2.81Å
132	L	27.5	Very low	39.9	Very low	143 Å²	143	119 Å²	119	75%	0.749	65%	0.654	S	S	*	*			trans	-56	131.3	172.5	-87.1	96.4	0	0	0	108.1	V130 I134	V130-L132 VanDerWaalsContact C-N 3.31Å; V130-L132 PolarHBondContact O-N 2.87Å; L132-I134 PolarHBondContact O-N 2.84Å
133	P	28.5	Very low	37.5	Very low	122 Å²	122	124.4 Å²	124.4	79%	0.792	68%	0.678	S	S	*	*			trans	-66.5	110.1	175.2	25.9	-29.5	0	0	0	108.3	N135	P133-N135 VanDerWaalsContact C-N 3.28Å; P133-N135 PolarHBondContact O-N 2.71Å
134	I	28	Very low	35.4	Very low	163 Å²	163	126.3 Å²	126.3	84%	0.836	69%	0.691	S	S	*	*			trans	-65.4	91	168	-58.7	166.5	0	0	0	106.3	L132	L132-I134 PolarHBondContact O-N 2.84Å
135	N	27.8	Very low	33.4	Very low	143 Å²	143	129 Å²	129	77%	0.765	71%	0.706	S	S	*	*			trans	-170.2	102.3	158.3	-104.1	-23.8	0	0	0	109.9	P133	P133-N135 VanDerWaalsContact C-N 3.28Å; P133-N135 PolarHBondContact O-N 2.71Å
136	Q	31.8	Very low	32.3	Very low	184 Å²	184	132.9 Å²	132.9	86%	0.86	72%	0.723	S	S	*	*	S	Bend		158.5	112.4	121.3	-83.3	169.9	14.6	0	0	110.3
137	N	27.6	Very low	31.2	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	74%	0.742	S	S	*	*			trans	41.5	120.8	157.7	-76	-7.6	0	0	0	121.1	T139	N137-T139 PolarHBondContact O-N 3.43Å; N137-T139 VanDerWaalsContact O-N 3.08Å
138	P	32.8	Very low	30.9	Very low	126 Å²	126	140.9 Å²	140.9	82%	0.818	75%	0.745	S	S	*	*			trans	-81.7	90.5	179	34.1	-31.1	0	0	0	110.2	I140	P138-I140 PolarHBondContact O-N 2.02Å
139	T	28.1	Very low	30.6	Very low	125 Å²	125	143.5 Å²	143.5	77%	0.767	76%	0.756	S	S	*	*			trans	-79.3	113.7	158.8	31.6	0	0	0	0	109.2	N137 I141	N137-T139 PolarHBondContact O-N 3.43Å; N137-T139 VanDerWaalsContact O-N 3.08Å; T139-I141 PolarHBondContact O-N 2.77Å; T139-I141 VanDerWaalsContact O-N 3.14Å
140	I	29.3	Very low	30.7	Very low	157 Å²	157	146.5 Å²	146.5	81%	0.805	76%	0.757	S	S	*	*			trans	-35.2	107.4	167.9	-60.6	158.6	0	0	0	110.2	P138	P138-I140 PolarHBondContact O-N 2.02Å
141	I	31.6	Very low	30.7	Very low	143 Å²	143	149 Å²	149	73%	0.733	76%	0.763	S	S	*	*			trans	-121.8	111.5	161.7	-63.7	179.2	0	0	0	106.6	T139	T139-I141 PolarHBondContact O-N 2.77Å; T139-I141 VanDerWaalsContact O-N 3.14Å
142	D	28.9	Very low	30.9	Very low	127 Å²	127	149 Å²	149	68%	0.679	76%	0.763	S	S	*	*			trans	-45.9	140.5	176.2	-74.7	-59	0	0	0	113.9	V144	D142-V144 PolarHBondContact O-N 2.94Å
143	K	32.1	Very low	31.2	Very low	209 Å²	209	145.6 Å²	145.6	91%	0.909	75%	0.751	S	S	*	*			trans	31.6	63.2	148	-68.5	180	176.2	175.6	0	115.3	D145	K143-D145 PolarHBondContact O-N 2.73Å
144	V	33.8	Very low	31.4	Very low	93 Å²	93	145.8 Å²	145.8	56%	0.564	74%	0.743	S	S	*	*			trans	-84.7	109.7	163.5	176.3	0	0	0	0	108.4	D142 I146	D142-V144 PolarHBondContact O-N 2.94Å; V144-I146 PolarHBondContact O-N 2.91Å
145	D	30.9	Very low	32.2	Very low	112 Å²	112	141.4 Å²	141.4	60%	0.599	72%	0.72	S	S	*	*			trans	-29.1	118.4	167.3	-151.4	-29.1	0	0	0	113.4	K143 T147 R148	K143-D145 PolarHBondContact O-N 2.73Å; D145-T147 PolarHBondContact O-N 2.65Å; D145-T147 PolarHBondContact OD1-OG1 3.08Å; D145-R148 PolarHBondContact O-N 3.44Å
146	I	35.4	Very low	32.7	Very low	146 Å²	146	137.3 Å²	137.3	75%	0.749	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-61.8	-14	-176.8	-57.8	171.5	0	0	0	111.1	V144 R148	V144-I146 PolarHBondContact O-N 2.91Å; I146-R148 PolarHBondContact O-N 3Å
147	T	34.7	Very low	33.5	Very low	115 Å²	115	134.1 Å²	134.1	71%	0.706	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-70.7	-9.8	175.9	50.5	0	0	0	0	115	D145	D145-T147 PolarHBondContact O-N 2.65Å; D145-T147 PolarHBondContact OD1-OG1 3.08Å
148	R	33.8	Very low	34.7	Very low	217 Å²	217	129.3 Å²	129.3	82%	0.819	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-107.9	-4.8	-179.6	-104.4	-176.5	171.7	-175	-0.5	116.5	D145 I146	D145-R148 PolarHBondContact O-N 3.44Å; I146-R148 PolarHBondContact O-N 3Å
149	L	30.8	Very low	35.9	Very low	133 Å²	133	129.5 Å²	129.5	70%	0.696	66%	0.656	S	S	*	*	S	Bend	trans	-105.8	2.7	-172.9	-94.5	158.8	0	0	0	115.6
150	Q	30.4	Very low	37.3	Very low	178 Å²	178	124.6 Å²	124.6	83%	0.832	63%	0.63	S	S	*	*	S	Bend	trans	-99.8	11.5	-176	-109.6	-171.8	-12.4	0	0	117.8
151	E	33.7	Very low	39	Very low	147 Å²	147	122.5 Å²	122.5	69%	0.687	62%	0.62	S	S	*	*	S	Bend	trans	-156.6	29.6	171	-128	173.2	-171.7	0	0	116.5	S153 I155	E151-S153 PolarHBondContact O-N 3.14Å; E151-I155 HydrophobicContact CG-CD1 3.87Å; E151-I155 WeakPolarHBondContact OE1-CD1 3.26Å
152	K	31.2	Very low	41	Very low	199 Å²	199	115.7 Å²	115.7	87%	0.865	59%	0.585	S	S	*	*			trans	-80.3	12.7	167.9	-108	-178.1	178.6	-177.6	0	113.9	M154	K152-M154 PolarHBondContact O-N 3.4Å
153	S	34.5	Very low	43.3	Very low	71 Å²	71	111 Å²	111	50%	0.497	56%	0.561	S	S	.	*	S	Bend	trans	-74.7	79.9	172.8	164.5	0	0	0	0	110.2	E151 I155	E151-S153 PolarHBondContact O-N 3.14Å; S153-I155 PolarHBondContact O-N 2.78Å
154	M	32.8	Very low	45.5	Very low	127 Å²	127	104.8 Å²	104.8	63%	0.626	54%	0.537	S	S	*	.	S	Bend	trans	38.3	26.2	166.1	-79.2	-163.6	173	0	0	118.6	K152 G156 Y176	K152-M154 PolarHBondContact O-N 3.4Å; M154-G156 PolarHBondContact O-N 3.01Å; M154-Y176 PolarHBondContact O-OH 3.41Å
155	I	43.9	Very low	47.5	Very low	70 Å²	70	107 Å²	107	36%	0.359	55%	0.545	S	S	.	.			trans	-74.7	-6.2	155.4	-55.1	177.3	0	0	0	109.1	T125 E151 S153 H157 I158	T125-I155 HydrophobicContact CG2-CD1 4.13Å; T125-I155 HydrophobicContact CG2-CG1 3.44Å; T125-I155 VanDerWaalsContact CG2-CG1 3.44Å; E151-I155 HydrophobicContact CG-CD1 3.87Å; E151-I155 WeakPolarHBondContact OE1-CD1 3.26Å; S153-I155 PolarHBondContact O-N 2.78Å; I155-H157 VanDerWaalsContact C-N 3.29Å; I155-H157 PolarHBondContact O-N 3.17Å; I155-I158 PolarHBondContact O-N 2.65Å
156	G	39.3	Very low	49.8	Very low	58 Å²	58	105.2 Å²	105.2	60%	0.598	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	90	175.1	0	0	0	0	0	112.1	M154	M154-G156 PolarHBondContact O-N 3.01Å
157	H	47.6	Very low	52.2	Low	117 Å²	117	99.2 Å²	99.2	54%	0.542	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	42.3	170.6	-52.9	-39.3	0	0	0	118.4	I155 Y159	I155-H157 VanDerWaalsContact C-N 3.29Å; I155-H157 PolarHBondContact O-N 3.17Å; H157-Y159 HydrophobicContact CB-CD2 4.04Å; H157-Y159 HydrophobicContact CB-CE2 3.45Å; H157-Y159 VanDerWaalsContact CB-CE2 3.45Å; H157-Y159 PolarHBondContact CE1-OH 3.28Å; H157-Y159 AromaticContact CG-CE2 3.9Å; H157-Y159 AromaticContact CG-CZ 3.64Å; H157-Y159 VanDerWaalsContact CG-OH 3.28Å; H157-Y159 AromaticContact ND1-CZ 3.59Å; H157-Y159 PolarHBondContact ND1-OH 3.04Å; H157-Y159 VanDerWaalsContact ND1-OH 3.16Å; H157-Y159 PolarHBondContact O-N 3.28Å; H157-Y159 VanDerWaalsContact O-N 3.15Å
158	I	53.9	Low	54.5	Low	45 Å²	45	93.8 Å²	93.8	23%	0.231	47%	0.473	C	S	.	.			trans	-68.9	104.2	145.6	-57.8	-179	0	0	0	106.5	L123 I155 I168 Y176	L123-I158 HydrophobicContact CD1-CD1 4.5Å; I155-I158 PolarHBondContact O-N 2.65Å; I158-I168 HydrophobicContact CG2-CG1 4.31Å; I158-I168 HydrophobicContact CG2-CG2 3.81Å; I158-Y176 HydrophobicContact CG1-CE2 4.01Å; I158-Y176 WeakPolarHBondContact CG1-OH 2.98Å
159	Y	57.7	Low	56.7	Low	131 Å²	131	85.2 Å²	85.2	51%	0.514	44%	0.444	S	S	.	.			trans	-86.9	120.8	172.8	-66.4	-74.1	0	0	0	108.3	H157 I168 D169	H157-Y159 HydrophobicContact CB-CD2 4.04Å; H157-Y159 HydrophobicContact CB-CE2 3.45Å; H157-Y159 VanDerWaalsContact CB-CE2 3.45Å; H157-Y159 PolarHBondContact CE1-OH 3.28Å; H157-Y159 AromaticContact CG-CE2 3.9Å; H157-Y159 AromaticContact CG-CZ 3.64Å; H157-Y159 VanDerWaalsContact CG-OH 3.28Å; H157-Y159 AromaticContact ND1-CZ 3.59Å; H157-Y159 PolarHBondContact ND1-OH 3.04Å; H157-Y159 VanDerWaalsContact ND1-OH 3.16Å; H157-Y159 PolarHBondContact O-N 3.28Å; H157-Y159 VanDerWaalsContact O-N 3.15Å; Y159-I168 WeakPolarHBondContact O-CA 3.2Å; Y159-D169 PolarHBondContact O-N 3.45Å
160	G	56.4	Low	59.1	Low	21 Å²	21	79 Å²	79	22%	0.216	41%	0.411	C	S	.	.			trans	129.3	136.4	178	0	0	0	0	0	113.4	G162 N166 P167	G160-G162 PolarHBondContact O-N 3.34Å; G160-N166 CarbonylContact C-O 3.59Å; G160-N166 WeakPolarHBondContact CA-O 3.06Å; G160-N166 WeakPolarHBondContact CA-OD1 3.41Å; G160-P167 VanDerWaalsContact CA-O 3.29Å; G160-P167 WeakPolarHBondContact CA-O 3.34Å
161	L	65.2	Low	61.3	Low	114 Å²	114	74 Å²	74	60%	0.597	39%	0.39	S	S	*	.			trans	-82.7	3.8	170.7	-65.4	172.3	0	0	0	111.9	T163 N166 I333	L161-T163 HydrophobicContact CB-CG2 3.99Å; L161-T163 PolarHBondContact O-N 2.85Å; L161-N166 CarbonylContact C-O 3.6Å; L161-N166 HydrophobicContact CB-CB 4.42Å; L161-N166 PolarHBondContact N-O 2.92Å; L161-I333 WeakPolarHBondContact O-CD1 3.47Å; L161-I333 VanDerWaalsContact O-CG1 3.31Å; L161-I333 WeakPolarHBondContact O-CG1 3.42Å
162	G	73.5	Confident	62.7	Low	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.39	C	S	.	.	S	Bend	trans	61.8	20.7	-173.2	0	0	0	0	0	113.9	G160 N166 Y347	G160-G162 PolarHBondContact O-N 3.34Å; G162-N166 PolarHBondContact N-O 3Å; G162-Y347 WeakPolarHBondContact O-CD2 3.36Å; G162-Y347 PolarHBondContact O-N 3.43Å
163	T	78.1	Confident	64.1	Low	29 Å²	29	65 Å²	65	18%	0.178	36%	0.357	C	S	.	.	S	Bend	trans	-88.6	167.4	171.8	65.3	0	0	0	0	110	L161 N165 N166 P167 Y347	L161-T163 HydrophobicContact CB-CG2 3.99Å; L161-T163 PolarHBondContact O-N 2.85Å; T163-N165 VanDerWaalsContact C-N 3.26Å; T163-N165 PolarHBondContact O-N 3.09Å; T163-N166 PolarHBondContact N-O 2.92Å; T163-N166 CarbonylContact O-C 3.57Å; T163-N166 PolarHBondContact O-N 3.12Å; T163-N166 PolarHBondContact OG1-N 3.06Å; T163-N166 VanDerWaalsContact OG1-N 3.12Å; T163-P167 VanDerWaalsContact O-CA 3.22Å; T163-P167 WeakPolarHBondContact O-CA 3.44Å; T163-Y347 VanDerWaalsContact C-CD2 3.41Å
164	L	78.5	Confident	65.2	Low	77 Å²	77	69.8 Å²	69.8	40%	0.403	37%	0.369	S	S	.	.	S	Bend	trans	-60.6	-39.6	179.4	-179.4	64.5	0	0	0	111.8	L280 Y347	L164-L280 HydrophobicContact CD1-CD2 3.89Å; L164-Y347 HydrophobicContact CB-CD2 4.1Å; L164-Y347 HydrophobicContact CB-CE1 4.28Å; L164-Y347 HydrophobicContact CB-CE2 3.71Å; L164-Y347 HydrophobicContact CB-CG 4.49Å; L164-Y347 HydrophobicContact CD1-CD1 3.87Å; L164-Y347 HydrophobicContact CD1-CE1 3.5Å; L164-Y347 VanDerWaalsContact CD1-CE1 3.5Å; L164-Y347 HydrophobicContact CD1-CE2 4.48Å; L164-Y347 HydrophobicContact CG-CE1 4.45Å
165	N	76.4	Confident	66.2	Low	139 Å²	139	66.7 Å²	66.7	74%	0.743	36%	0.363	S	S	*	.	S	Bend	trans	-82.3	-19.9	-178.4	-62	-35.6	0	0	0	113.2	T163	T163-N165 VanDerWaalsContact C-N 3.26Å; T163-N165 PolarHBondContact O-N 3.09Å
166	N	78.4	Confident	66.8	Low	75 Å²	75	64.8 Å²	64.8	40%	0.401	35%	0.352	S	S	.	.	S	Bend	trans	-139	66.6	178.6	-166.6	14	0	0	0	110	G160 L161 G162 T163	G160-N166 CarbonylContact C-O 3.59Å; G160-N166 WeakPolarHBondContact CA-O 3.06Å; G160-N166 WeakPolarHBondContact CA-OD1 3.41Å; L161-N166 CarbonylContact C-O 3.6Å; L161-N166 HydrophobicContact CB-CB 4.42Å; L161-N166 PolarHBondContact N-O 2.92Å; G162-N166 PolarHBondContact N-O 3Å; T163-N166 PolarHBondContact N-O 2.92Å; T163-N166 CarbonylContact O-C 3.57Å; T163-N166 PolarHBondContact O-N 3.12Å; T163-N166 PolarHBondContact OG1-N 3.06Å; T163-N166 VanDerWaalsContact OG1-N 3.12Å
167	P	84.6	Confident	67.5	Low	21 Å²	21	64 Å²	64	14%	0.136	34%	0.336	C	S	.	.			trans	-68.9	160	-175.9	31.4	-37	0	0	0	110.7	G160 T163 D169 L280 L349	G160-P167 VanDerWaalsContact CA-O 3.29Å; G160-P167 WeakPolarHBondContact CA-O 3.34Å; T163-P167 VanDerWaalsContact O-CA 3.22Å; T163-P167 WeakPolarHBondContact O-CA 3.44Å; P167-D169 PolarHBondContact O-N 2.81Å; P167-D169 VanDerWaalsContact O-N 3.09Å; P167-L280 HydrophobicContact CB-CD1 3.68Å; P167-L280 HydrophobicContact CG-CD1 3.94Å; P167-L349 HydrophobicContact CB-CB 4.14Å; P167-L349 HydrophobicContact CG-CB 3.95Å; P167-L349 HydrophobicContact CG-CD2 4.39Å
168	I	83	Confident	68.1	Low	0 Å²	0	65 Å²	65	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	110.9	171.8	-66.3	166.5	0	0	0	108.6	L123 I158 Y159 L170 I181 I346 Y347 V348 L349	L123-I168 HydrophobicContact CD1-CD1 3.7Å; L123-I168 HydrophobicContact CD1-CG1 4.5Å; L123-I168 HydrophobicContact CD2-CD1 3.69Å; L123-I168 HydrophobicContact CG-CD1 4.21Å; I158-I168 HydrophobicContact CG2-CG1 4.31Å; I158-I168 HydrophobicContact CG2-CG2 3.81Å; Y159-I168 WeakPolarHBondContact O-CA 3.2Å; I168-L170 HydrophobicContact CG2-CD2 3.71Å; I168-L170 HydrophobicContact CG2-CG 4.11Å; I168-L170 PolarHBondContact O-N 3Å; I168-I181 HydrophobicContact CD1-CD1 4.4Å; I168-I181 HydrophobicContact CG2-CD1 4.25Å; I168-I346 HydrophobicContact CD1-CD1 3.35Å; I168-I346 HydrophobicContact CD1-CG1 3.74Å; I168-Y347 PolarHBondContact N-O 3.33Å; I168-V348 HydrophobicContact CB-CG2 4.42Å; I168-V348 HydrophobicContact CD1-CG2 4.45Å; I168-L349 PolarHBondContact O-N 2.74Å
169	D	81.8	Confident	68.5	Low	37 Å²	37	66.7 Å²	66.7	20%	0.198	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110.4	-179.5	-174.6	7.6	0	0	0	110.8	Y159 P167 I171	Y159-D169 PolarHBondContact O-N 3.45Å; P167-D169 PolarHBondContact O-N 2.81Å; P167-D169 VanDerWaalsContact O-N 3.09Å; D169-I171 WeakPolarHBondContact OD1-CB 3.34Å; D169-I171 VanDerWaalsContact OD1-CG1 3.22Å; D169-I171 WeakPolarHBondContact OD1-CG1 3.41Å; D169-I171 PolarHBondContact OD1-N 2.77Å
170	L	80.6	Confident	69.3	Low	2 Å²	2	60.4 Å²	60.4	1%	0.01	33%	0.325	C	S	.	.			trans	-103.8	9.7	175	-56.9	-175.2	0	0	0	112.4	I168 Y176 T177 I181 C261 V348 L349	I168-L170 HydrophobicContact CG2-CD2 3.71Å; I168-L170 HydrophobicContact CG2-CG 4.11Å; I168-L170 PolarHBondContact O-N 3Å; L170-Y176 HydrophobicContact CD2-CD2 4.14Å; L170-Y176 HydrophobicContact CD2-CG 4.14Å; L170-T177 WeakPolarHBondContact O-CG2 3.28Å; L170-I181 HydrophobicContact CD1-CD1 4.17Å; L170-I181 HydrophobicContact CD1-CG1 4.3Å; L170-I181 HydrophobicContact CD2-CG2 3.83Å; L170-C261 WeakPolarHBondContact CB-SG 3.44Å; L170-C261 VanDerWaalsContact CD1-SG 3.58Å; L170-V348 HydrophobicContact CD1-CG1 3.34Å; L170-V348 HydrophobicContact CG-CG1 3.83Å; L170-L349 WeakPolarHBondContact CB-O 3.37Å; L170-L349 PolarHBondContact N-O 2.83Å
171	I	75.9	Confident	70.3	Confident	75 Å²	75	59.6 Å²	59.6	39%	0.385	32%	0.316	S	S	.	.	S	Bend	trans	-71.6	-47.5	-178	-61.2	170.1	0	0	0	111.2	D169 L349	D169-I171 WeakPolarHBondContact OD1-CB 3.34Å; D169-I171 VanDerWaalsContact OD1-CG1 3.22Å; D169-I171 WeakPolarHBondContact OD1-CG1 3.41Å; D169-I171 PolarHBondContact OD1-N 2.77Å; I171-L349 HydrophobicContact CD1-CD2 3.63Å; I171-L349 HydrophobicContact CD1-CG 3.77Å; I171-L349 HydrophobicContact CG1-CG 4.29Å
172	N	63.4	Low	71.1	Confident	131 Å²	131	56.4 Å²	56.4	70%	0.701	30%	0.297	S	S	*	.	S	Bend	trans	-91.4	-6.2	-167.1	-70.5	-43.6	0	0	0	114.5
173	T	60.5	Low	71.7	Confident	26 Å²	26	56.4 Å²	56.4	16%	0.16	30%	0.297	C	S	.	.			trans	-106	92.4	-170.2	45.3	0	0	0	0	110.6	A175 Y176 T177	T173-A175 PolarHBondContact O-N 2.84Å; T173-Y176 HydrophobicContact CG2-CD2 3.75Å; T173-Y176 HydrophobicContact CG2-CE2 4Å; T173-Y176 PolarHBondContact O-N 2.86Å; T173-Y176 VanDerWaalsContact OG1-CD2 3.26Å; T173-Y176 WeakPolarHBondContact OG1-CD2 3.38Å; T173-T177 PolarHBondContact O-N 2.81Å
174	K	57.6	Low	72.1	Confident	171 Å²	171	55.7 Å²	55.7	74%	0.743	29%	0.292	S	S	*	.	H	α-helix	trans	-48.5	-35.4	173.1	-73.3	-172	176.8	-175.1	0	112.7	Y176 T177	K174-Y176 VanDerWaalsContact C-N 3.33Å; K174-Y176 PolarHBondContact O-N 3.48Å; K174-T177 WeakPolarHBondContact CA-OG1 3.38Å; K174-T177 PolarHBondContact O-OG1 2.79Å
175	A	53.5	Low	72.5	Confident	62 Å²	62	52.1 Å²	52.1	51%	0.512	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-35.6	178.3	0	0	0	0	0	113.4	T173 N179	T173-A175 PolarHBondContact O-N 2.84Å; A175-N179 VanDerWaalsContact O-CB 3.32Å; A175-N179 WeakPolarHBondContact O-CB 3.44Å; A175-N179 PolarHBondContact O-N 2.86Å
176	Y	55.9	Low	72.9	Confident	29 Å²	29	46.6 Å²	46.6	11%	0.114	25%	0.245	C	C	.	.	H	α-helix	trans	-91.7	-23.6	-178.6	-61	-55.8	0	0	0	113.3	M154 I158 L170 T173 K174 E178 G180 I181	M154-Y176 PolarHBondContact O-OH 3.41Å; I158-Y176 HydrophobicContact CG1-CE2 4.01Å; I158-Y176 WeakPolarHBondContact CG1-OH 2.98Å; L170-Y176 HydrophobicContact CD2-CD2 4.14Å; L170-Y176 HydrophobicContact CD2-CG 4.14Å; T173-Y176 HydrophobicContact CG2-CD2 3.75Å; T173-Y176 HydrophobicContact CG2-CE2 4Å; T173-Y176 PolarHBondContact O-N 2.86Å; T173-Y176 VanDerWaalsContact OG1-CD2 3.26Å; T173-Y176 WeakPolarHBondContact OG1-CD2 3.38Å; K174-Y176 VanDerWaalsContact C-N 3.33Å; K174-Y176 PolarHBondContact O-N 3.48Å; Y176-E178 VanDerWaalsContact C-N 3.27Å; Y176-E178 PolarHBondContact O-N 3.07Å; Y176-G180 WeakPolarHBondContact O-CA 3.3Å; Y176-G180 PolarHBondContact O-N 2.93Å; Y176-I181 HydrophobicContact CD1-CG2 3.66Å; Y176-I181 HydrophobicContact CE1-CG2 4.17Å; Y176-I181 HydrophobicContact CG-CG2 4.02Å
177	T	54.4	Low	73.4	Confident	43 Å²	43	43 Å²	43	26%	0.264	23%	0.226	S	C	.	.	H	α-helix	trans	-64.8	-34.6	174.3	49.2	0	0	0	0	111.8	L170 T173 K174	L170-T177 WeakPolarHBondContact O-CG2 3.28Å; T173-T177 PolarHBondContact O-N 2.81Å; K174-T177 WeakPolarHBondContact CA-OG1 3.38Å; K174-T177 PolarHBondContact O-OG1 2.79Å
178	E	60.5	Low	73.5	Confident	137 Å²	137	42.8 Å²	42.8	64%	0.64	22%	0.224	S	C	*	.	H	α-helix	trans	-88.2	-47.8	-179.8	-65.9	176.9	-172.6	0	0	112.3	Y176 K260	Y176-E178 VanDerWaalsContact C-N 3.27Å; Y176-E178 PolarHBondContact O-N 3.07Å; E178-K260 PolarHBondContact O-NZ 3.34Å; E178-K260 VanDerWaalsContact O-NZ 3.09Å
179	N	62.9	Low	73.8	Confident	80 Å²	80	44.1 Å²	44.1	43%	0.428	23%	0.233	S	C	.	.	H	α-helix	trans	-89.6	-14.4	-174.3	-65.4	-27.5	0	0	0	113.8	L126 A175 Q258	L126-N179 HydrophobicContact CD1-CB 4.1Å; L126-N179 HydrophobicContact CD2-CB 3.71Å; A175-N179 VanDerWaalsContact O-CB 3.32Å; A175-N179 WeakPolarHBondContact O-CB 3.44Å; A175-N179 PolarHBondContact O-N 2.86Å; N179-Q258 PolarHBondContact O-NE2 2.86Å
180	G	73.2	Confident	74.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.224	C	C	.	.			trans	67.8	-177.9	-173.2	0	0	0	0	0	113.8	L126 Y176 I259	L126-G180 WeakPolarHBondContact CD1-O 3.34Å; Y176-G180 WeakPolarHBondContact O-CA 3.3Å; Y176-G180 PolarHBondContact O-N 2.93Å; G180-I259 CarbonylContact C-O 3.55Å; G180-I259 WeakPolarHBondContact CA-O 3.39Å
181	I	78	Confident	74.6	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	149	168	60.3	172.3	0	0	0	109.5	L123 I168 L170 Y176 I183 Q258 I259 V348	L123-I181 HydrophobicContact CD2-CD1 3.99Å; I168-I181 HydrophobicContact CD1-CD1 4.4Å; I168-I181 HydrophobicContact CG2-CD1 4.25Å; L170-I181 HydrophobicContact CD1-CD1 4.17Å; L170-I181 HydrophobicContact CD1-CG1 4.3Å; L170-I181 HydrophobicContact CD2-CG2 3.83Å; Y176-I181 HydrophobicContact CD1-CG2 3.66Å; Y176-I181 HydrophobicContact CE1-CG2 4.17Å; Y176-I181 HydrophobicContact CG-CG2 4.02Å; I181-I183 HydrophobicContact CD1-CD1 4.15Å; I181-I183 HydrophobicContact CD1-CG1 4.19Å; I181-I183 HydrophobicContact CG1-CG1 4.33Å; I181-Q258 WeakPolarHBondContact O-CA 3.45Å; I181-I259 HydrophobicContact CG1-CB 3.98Å; I181-I259 HydrophobicContact CG1-CG2 4.47Å; I181-I259 PolarHBondContact N-O 3.02Å; I181-I259 PolarHBondContact O-N 2.91Å; I181-V348 HydrophobicContact CD1-CG2 4.17Å
182	F	83.3	Confident	74.9	Confident	47 Å²	47	41.6 Å²	41.6	21%	0.206	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.9	173.4	-73	-91.3	0	0	0	109.3	L124 L126 Q212 I257 Q258	L124-F182 HydrophobicContact CB-CB 3.85Å; L124-F182 HydrophobicContact CD1-CB 4.3Å; L124-F182 PolarHBondContact N-O 2.76Å; L126-F182 HydrophobicContact CD1-CD2 4.5Å; L126-F182 HydrophobicContact CD2-CE2 4.03Å; L126-F182 HydrophobicContact CG-CD2 4.18Å; L126-F182 HydrophobicContact CG-CE2 4.01Å; F182-Q212 VanDerWaalsContact CE1-OE1 3.24Å; F182-I257 WeakPolarHBondContact CA-O 3.4Å; F182-Q258 HydrophobicContact CD1-CB 4.1Å; F182-Q258 HydrophobicContact CD1-CG 4.45Å; F182-Q258 HydrophobicContact CE1-CB 3.84Å; F182-Q258 HydrophobicContact CE1-CG 4.07Å; F182-Q258 HydrophobicContact CE2-CG 4.27Å; F182-Q258 HydrophobicContact CZ-CB 4.24Å; F182-Q258 HydrophobicContact CZ-CG 3.96Å
183	I	85.4	Confident	75.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.7	177.1	-50.3	171.3	0	0	0	107.3	P121 L123 I181 W198 R256 I257 I259 I283 I346	P121-I183 HydrophobicContact CB-CG2 3.69Å; L123-I183 HydrophobicContact CD2-CG1 4.31Å; I181-I183 HydrophobicContact CD1-CD1 4.15Å; I181-I183 HydrophobicContact CD1-CG1 4.19Å; I181-I183 HydrophobicContact CG1-CG1 4.33Å; I183-W198 HydrophobicContact CB-CH2 4.27Å; I183-W198 HydrophobicContact CB-CZ3 4.43Å; I183-W198 HydrophobicContact CG2-CH2 3.85Å; I183-W198 HydrophobicContact CG2-CZ3 3.96Å; I183-R256 CarbonylContact O-C 3.58Å; I183-R256 VanDerWaalsContact O-CA 3.3Å; I183-R256 WeakPolarHBondContact O-CA 3.43Å; I183-I257 HydrophobicContact CB-CG1 4.03Å; I183-I257 PolarHBondContact N-O 2.8Å; I183-I257 PolarHBondContact O-N 3.09Å; I183-I259 HydrophobicContact CD1-CG1 3.74Å; I183-I259 HydrophobicContact CG1-CG1 4.47Å; I183-I283 HydrophobicContact CD1-CD1 3.91Å; I183-I346 HydrophobicContact CD1-CG2 3.93Å; I183-I346 HydrophobicContact CG2-CG2 4.44Å
184	E	86.3	Confident	76.9	Confident	14 Å²	14	37.7 Å²	37.7	7%	0.065	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.5	-178.6	179.3	173.9	108.7	0	0	109.9	P121 K122 L124 K254 S255 R256	P121-E184 CarbonylContact C-O 3.59Å; P121-E184 VanDerWaalsContact CA-O 3.28Å; P121-E184 WeakPolarHBondContact CA-O 3.07Å; K122-E184 HydrophobicContact CB-CB 4.33Å; K122-E184 PolarHBondContact N-O 2.7Å; K122-E184 PolarHBondContact O-N 2.91Å; L124-E184 HydrophobicContact CD1-CB 3.91Å; L124-E184 WeakPolarHBondContact CD1-OE2 3.05Å; L124-E184 HydrophobicContact CD2-CB 4.29Å; L124-E184 HydrophobicContact CG-CB 3.97Å; E184-K254 HydrophobicContact CG-CD 4.47Å; E184-K254 VanDerWaalsContact CG-CE 3.41Å; E184-K254 HydrophobicContact CG-CG 4.15Å; E184-K254 WeakPolarHBondContact OE1-CE 3.37Å; E184-K254 IonicContact OE1-NZ 2.93Å; E184-K254 PolarHBondContact OE1-NZ 3.04Å; E184-K254 WeakPolarHBondContact OE2-CE 3.36Å; E184-K254 IonicContact OE2-NZ 2.78Å; E184-K254 PolarHBondContact OE2-NZ 3.48Å; E184-S255 WeakPolarHBondContact CA-O 3.08Å; E184-R256 HydrophobicContact CB-CG 4.09Å; E184-R256 HydrophobicContact CG-CG 4.02Å; E184-R256 IonicContact OE2-CZ 3.52Å; E184-R256 IonicContact OE2-NE 2.89Å; E184-R256 PolarHBondContact OE2-NE 3.22Å; E184-R256 IonicContact OE2-NH2 3.94Å
185	C	86.5	Confident	78.2	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.007	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138	178.1	-174.8	0	0	0	0	108.4	V118 I196 W198 K254 S255 C285	V118-C185 WeakPolarHBondContact CG1-SG 3.42Å; C185-I196 HydrophobicContact CB-CD1 4.14Å; C185-I196 HydrophobicContact CB-CG2 4.38Å; C185-I196 WeakPolarHBondContact O-CD1 3.13Å; C185-W198 HydrophobicContact CB-CH2 3.27Å; C185-W198 HydrophobicContact CB-CZ2 3.29Å; C185-W198 HydrophobicContact CB-CZ3 4.2Å; C185-K254 WeakPolarHBondContact O-CA 3.42Å; C185-S255 PolarHBondContact N-O 2.97Å; C185-S255 PolarHBondContact O-N 2.93Å; C185-C285 HydrophobicContact CB-CB 3.76Å; C185-C285 WeakPolarHBondContact CB-SG 3.37Å; C185-C285 WeakPolarHBondContact SG-CB 3.31Å; C185-C285 CovalentContact SG-SG 2.06Å; C185-C285 PolarHBondContact SG-SG 2.82Å
186	T	86.1	Confident	79.7	Confident	24 Å²	24	27 Å²	27	15%	0.147	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.5	-176	-54.3	0	0	0	0	109	Y119 V253 K254	Y119-T186 HydrophobicContact CD2-CG2 4.34Å; Y119-T186 WeakPolarHBondContact CD2-O 3.43Å; Y119-T186 PolarHBondContact N-O 3.21Å; T186-V253 WeakPolarHBondContact CA-O 3.4Å; T186-K254 HydrophobicContact CG2-CB 4.42Å
187	T	87.3	Confident	81.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-91.4	156.8	176.6	74.3	0	0	0	0	111.9	D117 V118 V193 I196 S252 V253 P287	D117-T187 CarbonylContact O-C 3.55Å; D117-T187 WeakPolarHBondContact O-CA 3.41Å; D117-T187 WeakPolarHBondContact O-CB 2.93Å; V118-T187 HydrophobicContact CG2-CG2 4.45Å; T187-V193 HydrophobicContact CG2-CG2 4.24Å; T187-I196 HydrophobicContact CG2-CD1 3.89Å; T187-I196 HydrophobicContact CG2-CG1 3.73Å; T187-S252 WeakPolarHBondContact O-CB 3.45Å; T187-S252 PolarHBondContact O-OG 3.32Å; T187-V253 HydrophobicContact CG2-CB 4.36Å; T187-V253 PolarHBondContact N-O 2.81Å; T187-V253 PolarHBondContact OG1-N 3.33Å; T187-P287 HydrophobicContact CG2-CB 4.21Å
188	S	86.9	Confident	82.7	Confident	15 Å²	15	26.5 Å²	26.5	11%	0.105	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-65.4	167.3	160.6	67.3	0	0	0	0	110.7	D117 A190	D117-S188 PolarHBondContact N-OG 2.92Å; D117-S188 PolarHBondContact O-N 2.83Å; D117-S188 PolarHBondContact O-OG 2.9Å; S188-A190 PolarHBondContact O-N 3.28Å
189	C	89.3	Confident	83.9	Confident	28 Å²	28	24 Å²	24	19%	0.189	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-67.6	125.6	176.9	-62.3	0	0	0	0	110.4	V114 C246 L250	V114-C189 VanDerWaalsContact CG1-O 3.25Å; V114-C189 WeakPolarHBondContact CG1-O 3.46Å; C189-C246 HydrophobicContact CB-CB 3.84Å; C189-C246 WeakPolarHBondContact CB-SG 3.19Å; C189-C246 WeakPolarHBondContact SG-CA 3.27Å; C189-C246 WeakPolarHBondContact SG-CB 3.44Å; C189-C246 CovalentContact SG-SG 2.04Å; C189-C246 PolarHBondContact SG-SG 2.86Å; C189-L250 HydrophobicContact CB-CB 3.96Å; C189-L250 HydrophobicContact CB-CD1 4.09Å
190	A	90.2	Very high	85	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-141.6	160.9	-176.2	0	0	0	0	0	112.6	V114 A116 S188 V193 L250 R251	V114-A190 WeakPolarHBondContact O-CB 3.47Å; A116-A190 HydrophobicContact CB-CB 3.4Å; S188-A190 PolarHBondContact O-N 3.28Å; A190-V193 HydrophobicContact CB-CB 4.44Å; A190-V193 HydrophobicContact CB-CG1 4.24Å; A190-L250 CarbonylContact O-C 3.49Å; A190-L250 WeakPolarHBondContact O-CA 3.18Å; A190-R251 PolarHBondContact N-O 3.02Å; A190-R251 PolarHBondContact O-N 2.85Å
191	T	88.6	Confident	85.5	Confident	31 Å²	31	25.8 Å²	25.8	19%	0.19	13%	0.127	C	C	.	.	S	Bend	trans	-68.1	-38.7	-172.1	-51.8	0	0	0	0	113.7	L113 V114	L113-T191 WeakPolarHBondContact CA-OG1 3.47Å; L113-T191 HydrophobicContact CD2-CG2 3.96Å; V114-T191 PolarHBondContact N-OG1 2.93Å; V114-T191 PolarHBondContact O-N 2.95Å
192	S	83.2	Confident	85.7	Confident	30 Å²	30	26.4 Å²	26.4	21%	0.21	13%	0.13	C	C	.	.	S	Bend	trans	-152.9	60.5	-177.2	-168.4	0	0	0	0	112.5	Y289	S192-Y289 VanDerWaalsContact O-CD1 3.31Å; S192-Y289 WeakPolarHBondContact O-CD1 3.3Å
193	V	82.5	Confident	85.1	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.018	15%	0.149	C	C	.	.			trans	-83.3	127.8	169.9	57.6	0	0	0	0	109.7	A116 T187 A190 G195 R251 V253 P287 Y289	A116-V193 HydrophobicContact CB-CB 4.27Å; A116-V193 HydrophobicContact CB-CG2 4.41Å; T187-V193 HydrophobicContact CG2-CG2 4.24Å; A190-V193 HydrophobicContact CB-CB 4.44Å; A190-V193 HydrophobicContact CB-CG1 4.24Å; V193-G195 WeakPolarHBondContact CG2-O 2.88Å; V193-R251 HydrophobicContact CG1-CB 4.49Å; V193-R251 WeakPolarHBondContact CG1-O 2.73Å; V193-V253 HydrophobicContact CB-CG2 4.34Å; V193-V253 HydrophobicContact CG1-CB 4.23Å; V193-V253 HydrophobicContact CG1-CG2 3.62Å; V193-V253 HydrophobicContact CG2-CB 4.16Å; V193-V253 HydrophobicContact CG2-CG2 4.04Å; V193-P287 HydrophobicContact CG2-CB 4.12Å; V193-Y289 HydrophobicContact CB-CE1 4.36Å
194	K	82.9	Confident	84.3	Confident	72 Å²	72	34 Å²	34	31%	0.313	18%	0.184	S	C	.	.			trans	-97	-26	-177	-66.8	-64.9	-175.5	-178.3	0	113.2	Y288 D290	K194-Y288 HydrophobicContact CB-CD1 3.77Å; K194-Y288 HydrophobicContact CB-CE1 4.07Å; K194-Y288 PolarHBondContact N-O 2.81Å; K194-D290 WeakPolarHBondContact CE-OD2 3.46Å; K194-D290 IonicContact NZ-OD2 3.18Å
195	G	85.3	Confident	83.7	Confident	6 Å²	6	36.6 Å²	36.6	6%	0.062	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-175.8	-173	0	0	0	0	0	111.7	V193 Y288	V193-G195 WeakPolarHBondContact CG2-O 2.88Å; G195-Y288 PolarHBondContact N-O 2.06Å; G195-Y288 PolarHBondContact O-N 3.24Å
196	I	85.1	Confident	83.1	Confident	3 Å²	3	40 Å²	40	2%	0.015	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.4	168.7	-68.7	169.8	0	0	0	106.7	C185 T187 W198 V253 C285 F286	C185-I196 HydrophobicContact CB-CD1 4.14Å; C185-I196 HydrophobicContact CB-CG2 4.38Å; C185-I196 WeakPolarHBondContact O-CD1 3.13Å; T187-I196 HydrophobicContact CG2-CD1 3.89Å; T187-I196 HydrophobicContact CG2-CG1 3.73Å; I196-W198 HydrophobicContact CG2-CD2 4.47Å; I196-W198 HydrophobicContact CG2-CZ2 4.45Å; I196-V253 HydrophobicContact CD1-CG1 4.31Å; I196-V253 HydrophobicContact CG1-CG1 3.97Å; I196-C285 HydrophobicContact CG2-CB 3.6Å; I196-F286 WeakPolarHBondContact CA-O 3.32Å
197	Y	85.2	Confident	82.8	Confident	59 Å²	59	42.5 Å²	42.5	23%	0.231	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	137.8	173	-178.4	-80.1	0	0	0	109.6	K199 S208 C285 F286	Y197-K199 HydrophobicContact CD1-CB 4.46Å; Y197-K199 HydrophobicContact CE1-CB 3.99Å; Y197-K199 HydrophobicContact CE1-CG 4.48Å; Y197-S208 WeakPolarHBondContact OH-CB 3.38Å; Y197-S208 PolarHBondContact OH-OG 3.18Å; Y197-C285 VanDerWaalsContact O-CA 3.31Å; Y197-C285 WeakPolarHBondContact O-CA 3.49Å; Y197-F286 VanDerWaalsContact CB-CE2 3.46Å; Y197-F286 HydrophobicContact CD1-CD1 4.04Å; Y197-F286 HydrophobicContact CD1-CD2 4.31Å; Y197-F286 AromaticContact CD1-CE1 3.16Å; Y197-F286 HydrophobicContact CD1-CE1 3.16Å; Y197-F286 AromaticContact CD1-CE2 3.48Å; Y197-F286 HydrophobicContact CD1-CE2 3.48Å; Y197-F286 VanDerWaalsContact CD1-CE2 3.48Å; Y197-F286 AromaticContact CD1-CZ 2.85Å; Y197-F286 HydrophobicContact CD1-CZ 2.85Å; Y197-F286 HydrophobicContact CD2-CZ 4.44Å; Y197-F286 AromaticContact CE1-CE1 3.6Å; Y197-F286 HydrophobicContact CE1-CE1 3.6Å; Y197-F286 HydrophobicContact CE1-CE2 4.21Å; Y197-F286 AromaticContact CE1-CZ 3.26Å; Y197-F286 HydrophobicContact CE1-CZ 3.26Å; Y197-F286 HydrophobicContact CG-CD2 4.38Å; Y197-F286 HydrophobicContact CG-CE1 4.12Å; Y197-F286 AromaticContact CG-CE2 3.6Å; Y197-F286 HydrophobicContact CG-CE2 3.6Å; Y197-F286 AromaticContact CG-CZ 3.48Å; Y197-F286 HydrophobicContact CG-CZ 3.48Å; Y197-F286 VanDerWaalsContact CG-CZ 3.48Å; Y197-F286 PolarHBondContact N-O 2.9Å; Y197-F286 PolarHBondContact O-N 3Å
198	W	87.9	Confident	82.4	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.8	-179.2	-66.4	89.6	0	0	0	111.2	I183 C185 I196 S208 L209 V211 S255 I257 I283 T284 C285	I183-W198 HydrophobicContact CB-CH2 4.27Å; I183-W198 HydrophobicContact CB-CZ3 4.43Å; I183-W198 HydrophobicContact CG2-CH2 3.85Å; I183-W198 HydrophobicContact CG2-CZ3 3.96Å; C185-W198 HydrophobicContact CB-CH2 3.27Å; C185-W198 HydrophobicContact CB-CZ2 3.29Å; C185-W198 HydrophobicContact CB-CZ3 4.2Å; I196-W198 HydrophobicContact CG2-CD2 4.47Å; I196-W198 HydrophobicContact CG2-CZ2 4.45Å; W198-S208 WeakPolarHBondContact O-CA 3.07Å; W198-L209 HydrophobicContact CB-CB 3.76Å; W198-L209 HydrophobicContact CB-CD1 4.29Å; W198-L209 HydrophobicContact CB-CG 4.5Å; W198-L209 PolarHBondContact O-N 2.65Å; W198-V211 VanDerWaalsContact CD1-CG2 3.5Å; W198-S255 PolarHBondContact NE1-OG 3.34Å; W198-I257 HydrophobicContact CB-CD1 4.5Å; W198-I257 HydrophobicContact CB-CG2 4.34Å; W198-I257 HydrophobicContact CD2-CB 4.49Å; W198-I257 HydrophobicContact CD2-CD1 3.62Å; W198-I257 HydrophobicContact CD2-CG1 3.9Å; W198-I257 HydrophobicContact CD2-CG2 3.77Å; W198-I257 HydrophobicContact CE3-CD1 3.24Å; W198-I257 HydrophobicContact CE3-CG1 3.82Å; W198-I257 HydrophobicContact CG-CD1 4.21Å; W198-I257 HydrophobicContact CG-CG2 3.69Å; W198-I257 HydrophobicContact CH2-CD1 4.14Å; W198-I257 HydrophobicContact CH2-CG1 3.86Å; W198-I257 HydrophobicContact CZ2-CD1 4.48Å; W198-I257 HydrophobicContact CZ2-CG1 3.97Å; W198-I257 HydrophobicContact CZ2-CG2 4.33Å; W198-I257 HydrophobicContact CZ3-CD1 3.54Å; W198-I257 HydrophobicContact CZ3-CG1 3.8Å; W198-I283 HydrophobicContact CE3-CG2 4.01Å; W198-I283 HydrophobicContact CZ3-CG2 4.25Å; W198-T284 CarbonylContact C-O 3.4Å; W198-T284 WeakPolarHBondContact CA-O 3.04Å; W198-C285 HydrophobicContact CD2-CB 3.89Å; W198-C285 HydrophobicContact CE3-CB 3.64Å; W198-C285 HydrophobicContact CH2-CB 4.06Å; W198-C285 HydrophobicContact CZ2-CB 4.24Å; W198-C285 HydrophobicContact CZ3-CB 3.73Å
199	K	86.7	Confident	82.1	Confident	84 Å²	84	43.5 Å²	43.5	37%	0.365	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.6	-178.7	-166.4	171.4	179.4	171.9	0	110.2	Y197 T206 H207 I283 T284 F286	Y197-K199 HydrophobicContact CD1-CB 4.46Å; Y197-K199 HydrophobicContact CE1-CB 3.99Å; Y197-K199 HydrophobicContact CE1-CG 4.48Å; K199-T206 HydrophobicContact CD-CG2 4.15Å; K199-T206 HydrophobicContact CG-CG2 4.1Å; K199-H207 CarbonylContact C-O 3.48Å; K199-H207 WeakPolarHBondContact CA-O 3.44Å; K199-I283 CarbonylContact O-C 3.56Å; K199-I283 WeakPolarHBondContact O-CA 3.4Å; K199-T284 PolarHBondContact N-O 3.05Å; K199-T284 PolarHBondContact O-N 3.16Å; K199-F286 HydrophobicContact CB-CE1 4.35Å
200	A	85.7	Confident	81.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	137.7	166.4	0	0	0	0	0	109.6	W205 T206 H207 L209 L277 K282	A200-W205 HydrophobicContact CB-CH2 4.32Å; A200-T206 CarbonylContact O-C 3.18Å; A200-T206 WeakPolarHBondContact O-CA 3.41Å; A200-H207 PolarHBondContact N-O 3.32Å; A200-H207 PolarHBondContact O-N 2.71Å; A200-L209 HydrophobicContact CB-CD1 4.01Å; A200-L209 HydrophobicContact CB-CD2 3.92Å; A200-L209 HydrophobicContact CB-CG 3.99Å; A200-L277 HydrophobicContact CB-CD2 4.04Å; A200-K282 CarbonylContact C-O 3.59Å; A200-K282 WeakPolarHBondContact CA-O 3.25Å
201	K	83.4	Confident	80.2	Confident	119 Å²	119	48.8 Å²	48.8	52%	0.517	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.9	174.1	177.2	174.3	-178.8	-173.3	0	110.1	T206 N281 K282	K201-T206 WeakPolarHBondContact CG-OG1 3.24Å; K201-N281 CarbonylContact O-C 3.59Å; K201-N281 WeakPolarHBondContact O-CA 3.21Å; K201-K282 PolarHBondContact N-O 3.25Å; K201-K282 PolarHBondContact O-N 3.5Å
202	N	81.5	Confident	78.6	Confident	16 Å²	16	51.9 Å²	51.9	9%	0.086	26%	0.26	C	S	.	.			trans	-118.3	179.1	165	-167.1	-24.4	0	0	0	108.1	T204 W205 V278 L280	N202-T204 PolarHBondContact O-N 2.93Å; N202-W205 PolarHBondContact N-O 3.07Å; N202-W205 VanDerWaalsContact O-O 3.12Å; N202-V278 PolarHBondContact ND2-O 3.03Å; N202-L280 PolarHBondContact ND2-O 3.44Å; N202-L280 PolarHBondContact OD1-O 2.87Å; N202-L280 VanDerWaalsContact OD1-O 3.07Å
203	S	70.9	Confident	76.8	Confident	87 Å²	87	53.6 Å²	53.6	61%	0.608	27%	0.272	S	S	*	.	S	Bend	trans	-49.2	-37.1	169.9	57.8	0	0	0	0	114.4	V355	S203-V355 VanDerWaalsContact OG-CG1 3.31Å; S203-V355 WeakPolarHBondContact OG-CG1 3.39Å
204	T	69.8	Low	74.6	Confident	119 Å²	119	55.6 Å²	55.6	73%	0.73	29%	0.293	S	S	*	.	S	Bend	trans	-104.8	-17	-172.8	50.9	0	0	0	0	114.9	N202	N202-T204 PolarHBondContact O-N 2.93Å
205	W	73	Confident	72	Confident	70 Å²	70	59.4 Å²	59.4	27%	0.265	32%	0.316	S	S	.	.			trans	-154.5	163.3	-171.8	68	-75.1	0	0	0	112.6	A200 N202 H207 L277	A200-W205 HydrophobicContact CB-CH2 4.32Å; N202-W205 PolarHBondContact N-O 3.07Å; N202-W205 VanDerWaalsContact O-O 3.12Å; W205-H207 HydrophobicContact CE3-CB 3.51Å; W205-H207 HydrophobicContact CH2-CB 4.33Å; W205-H207 HydrophobicContact CZ3-CB 3.18Å; W205-H207 AromaticContact CZ3-CG 3.94Å; W205-L277 HydrophobicContact CH2-CD2 3.56Å; W205-L277 HydrophobicContact CZ2-CD2 3.66Å
206	T	74.3	Confident	69.2	Low	71 Å²	71	65.6 Å²	65.6	44%	0.436	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	131	177.7	-66.4	0	0	0	0	108.4	K199 A200 K201	K199-T206 HydrophobicContact CD-CG2 4.15Å; K199-T206 HydrophobicContact CG-CG2 4.1Å; A200-T206 CarbonylContact O-C 3.18Å; A200-T206 WeakPolarHBondContact O-CA 3.41Å; K201-T206 WeakPolarHBondContact CG-OG1 3.24Å
207	H	78.4	Confident	66.5	Low	77 Å²	77	72.3 Å²	72.3	36%	0.356	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	153.6	-174.5	-167.7	-99.8	0	0	0	112.5	K199 A200 W205	K199-H207 CarbonylContact C-O 3.48Å; K199-H207 WeakPolarHBondContact CA-O 3.44Å; A200-H207 PolarHBondContact N-O 3.32Å; A200-H207 PolarHBondContact O-N 2.71Å; W205-H207 HydrophobicContact CE3-CB 3.51Å; W205-H207 HydrophobicContact CH2-CB 4.33Å; W205-H207 HydrophobicContact CZ3-CB 3.18Å; W205-H207 AromaticContact CZ3-CG 3.94Å
208	S	80.6	Confident	63.8	Low	28 Å²	28	76.5 Å²	76.5	20%	0.196	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	127.1	175	-41.6	0	0	0	0	109.3	Y197 W198	Y197-S208 WeakPolarHBondContact OH-CB 3.38Å; Y197-S208 PolarHBondContact OH-OG 3.18Å; W198-S208 WeakPolarHBondContact O-CA 3.07Å
209	L	79.6	Confident	61.1	Low	9 Å²	9	83 Å²	83	5%	0.047	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.6	176.1	-58	169.4	0	0	0	109.3	W198 A200 I257 I259 I283	W198-L209 HydrophobicContact CB-CB 3.76Å; W198-L209 HydrophobicContact CB-CD1 4.29Å; W198-L209 HydrophobicContact CB-CG 4.5Å; W198-L209 PolarHBondContact O-N 2.65Å; A200-L209 HydrophobicContact CB-CD1 4.01Å; A200-L209 HydrophobicContact CB-CD2 3.92Å; A200-L209 HydrophobicContact CB-CG 3.99Å; L209-I257 HydrophobicContact CD1-CD1 3.68Å; L209-I259 HydrophobicContact CD1-CD1 3.73Å; L209-I259 HydrophobicContact CD2-CD1 4.4Å; L209-I283 HydrophobicContact CD1-CG2 3.87Å
210	R	70.6	Confident	58.5	Low	126 Å²	126	85.6 Å²	85.6	48%	0.475	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-70.4	139.2	169.3	-55.5	-178.8	177.7	-178.6	-0.4	111.2	H275	R210-H275 PolarHBondContact N-CE1 3.31Å; R210-H275 PolarHBondContact O-CE1 3.12Å; R210-H275 VanDerWaalsContact O-CE1 3.24Å
211	V	68.3	Low	55.9	Low	12 Å²	12	93.4 Å²	93.4	7%	0.073	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-78.8	137.4	173.7	177.4	0	0	0	0	109.1	W198 S213 S236 S255 R256 I257	W198-V211 VanDerWaalsContact CD1-CG2 3.5Å; V211-S213 PolarHBondContact O-N 2.99Å; V211-S213 VanDerWaalsContact O-N 3.12Å; V211-S236 WeakPolarHBondContact CG2-OG 3.25Å; V211-S255 VanDerWaalsContact CG1-OG 3.24Å; V211-S255 WeakPolarHBondContact CG1-OG 3.47Å; V211-S255 VanDerWaalsContact CG2-OG 3.25Å; V211-S255 WeakPolarHBondContact CG2-OG 2.88Å; V211-R256 WeakPolarHBondContact CG1-O 3.28Å; V211-I257 HydrophobicContact CG2-CG2 4.28Å
212	Q	55.6	Low	53.3	Low	96 Å²	96	95 Å²	95	45%	0.449	52%	0.519	S	S	.	.			trans	-72.1	107.1	170.1	-102.5	175.3	-10.8	0	0	108.8	F182 G214 R256	F182-Q212 VanDerWaalsContact CE1-OE1 3.24Å; Q212-G214 PolarHBondContact O-N 3.03Å; Q212-R256 PolarHBondContact N-O 3Å
213	S	45.6	Very low	50.7	Low	66 Å²	66	104.7 Å²	104.7	46%	0.462	56%	0.555	S	S	.	*			trans	-67.7	117.4	167.7	51.4	0	0	0	0	108.4	V211 I215	V211-S213 PolarHBondContact O-N 2.99Å; V211-S213 VanDerWaalsContact O-N 3.12Å; S213-I215 PolarHBondContact O-N 2.85Å; S213-I215 VanDerWaalsContact O-N 3.13Å
214	G	36.6	Very low	48.7	Very low	45 Å²	45	106.5 Å²	106.5	46%	0.464	56%	0.563	S	S	.	*			trans	-45.1	122.4	174.9	0	0	0	0	0	111.6	Q212 N216 K238	Q212-G214 PolarHBondContact O-N 3.03Å; G214-N216 PolarHBondContact O-N 2.87Å; G214-K238 PolarHBondContact O-NZ 2.91Å
215	I	27.7	Very low	46.8	Very low	153 Å²	153	106.7 Å²	106.7	79%	0.785	56%	0.559	S	S	*	*	S	Bend	trans	16.6	92.6	155.5	-51.8	167.2	0	0	0	112	S213	S213-I215 PolarHBondContact O-N 2.85Å; S213-I215 VanDerWaalsContact O-N 3.13Å
216	N	27.7	Very low	45.1	Very low	136 Å²	136	110.7 Å²	110.7	73%	0.727	59%	0.586	S	S	*	*			trans	-142.9	112.7	132.1	-84.7	-18.1	0	0	0	103.9	G214 D218	G214-N216 PolarHBondContact O-N 2.87Å; N216-D218 PolarHBondContact O-N 2.68Å
217	N	26.5	Very low	43.3	Very low	143 Å²	143	111.3 Å²	111.3	77%	0.765	59%	0.593	S	S	*	*			trans	-52.8	128	160.9	-58.2	-37.1	0	0	0	106.4
218	D	29.2	Very low	41.2	Very low	148 Å²	148	110.4 Å²	110.4	79%	0.791	59%	0.591	S	S	*	*			trans	179	91.5	150.9	-82.5	-21.9	0	0	0	105.7	N216	N216-D218 PolarHBondContact O-N 2.68Å
219	D	31.8	Very low	38.9	Very low	137 Å²	137	118 Å²	118	73%	0.733	62%	0.616	S	S	*	*			trans	43	133.9	133.7	-56.1	-25.2	0	0	0	121.5
220	D	32	Very low	36.6	Very low	139 Å²	139	124 Å²	124	74%	0.743	65%	0.648	S	S	*	*			trans	66.5	112	147.6	-59.5	-25.3	0	0	0	119.6
221	D	30.9	Very low	34.8	Very low	165 Å²	165	126.4 Å²	126.4	88%	0.882	66%	0.657	S	S	*	*				169.5	152.6	97.1	-98.1	-32.2	0	0	0	115
222	D	27.8	Very low	33.2	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	67%	0.665	S	S	*	*			trans	-70.9	168.1	-166.2	-110.9	-33.6	0	0	0	118
223	Y	26.9	Very low	32	Very low	218 Å²	218	126.6 Å²	126.6	86%	0.855	66%	0.658	S	S	*	*			trans	78.7	133.5	151.5	-134.4	-100.3	0	0	0	121.3
224	V	30.7	Very low	31.4	Very low	126 Å²	126	133 Å²	133	76%	0.764	67%	0.672	S	S	*	*			trans	-94.2	124.6	-172.4	173.6	0	0	0	0	110.1
225	D	29.2	Very low	31.3	Very low	123 Å²	123	136.3 Å²	136.3	66%	0.658	68%	0.679	S	S	*	*			trans	-156.4	145	159.1	-164.2	8.9	0	0	0	110.9	S227 L228	D225-S227 PolarHBondContact O-N 3.16Å; D225-L228 PolarHBondContact O-N 3.26Å
226	D	37.1	Very low	31.6	Very low	154 Å²	154	130.7 Å²	130.7	82%	0.824	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	10.5	-162.4	-112.1	-15.1	0	0	0	115.7	L228	D226-L228 PolarHBondContact O-N 3.11Å; D226-L228 VanDerWaalsContact O-N 3.14Å
227	S	35.5	Very low	32.2	Very low	84 Å²	84	131.2 Å²	131.2	59%	0.587	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	2.4	161.7	70.8	0	0	0	0	113.1	D225 Y229 N230	D225-S227 PolarHBondContact O-N 3.16Å; S227-Y229 PolarHBondContact O-N 3.3Å; S227-N230 PolarHBondContact O-N 2.98Å
228	L	35.8	Very low	33.1	Very low	58 Å²	58	129.4 Å²	129.4	30%	0.304	63%	0.631	S	S	.	*	H	α-helix	trans	-51.8	-26.2	-177.5	-131.3	89.9	0	0	0	114	D225 D226 N230 R231 I232	D225-L228 PolarHBondContact O-N 3.26Å; D226-L228 PolarHBondContact O-N 3.11Å; D226-L228 VanDerWaalsContact O-N 3.14Å; L228-N230 VanDerWaalsContact C-N 3.25Å; L228-N230 PolarHBondContact O-N 3.26Å; L228-R231 PolarHBondContact O-N 3.36Å; L228-I232 HydrophobicContact CB-CD1 4.1Å; L228-I232 HydrophobicContact CB-CG1 4.41Å; L228-I232 HydrophobicContact CD2-CD1 3.38Å; L228-I232 HydrophobicContact CD2-CG1 3.74Å; L228-I232 HydrophobicContact CG-CD1 3.83Å; L228-I232 HydrophobicContact CG-CG1 3.84Å; L228-I232 WeakPolarHBondContact O-CB 3.18Å; L228-I232 WeakPolarHBondContact O-CD1 3.35Å; L228-I232 WeakPolarHBondContact O-CG1 3.36Å; L228-I232 PolarHBondContact O-N 3.06Å
229	Y	31.9	Very low	34	Very low	187 Å²	187	123.1 Å²	123.1	73%	0.733	60%	0.599	S	S	*	*	H	α-helix	trans	-58	-40.1	177.3	-149.4	-87.8	0	0	0	111.5	S227 H233	S227-Y229 PolarHBondContact O-N 3.3Å; Y229-H233 PolarHBondContact O-CD2 2.7Å; Y229-H233 PolarHBondContact O-NE2 2.9Å
230	N	31.1	Very low	34.8	Very low	135 Å²	135	122 Å²	122	72%	0.722	59%	0.589	S	S	*	*	H	α-helix	trans	-85.1	-24.3	-179.4	-76.3	-26.7	0	0	0	113.8	S227 L228	S227-N230 PolarHBondContact O-N 2.98Å; L228-N230 VanDerWaalsContact C-N 3.25Å; L228-N230 PolarHBondContact O-N 3.26Å
231	R	33.9	Very low	35.5	Very low	176 Å²	176	121.2 Å²	121.2	66%	0.664	58%	0.577	S	S	*	*	H	α-helix	trans	-93.9	-28.8	-177.4	-125	-178.3	-165.1	-164.8	2.7	114.1	L228 H233 R234	L228-R231 PolarHBondContact O-N 3.36Å; R231-H233 PolarHBondContact O-N 2.89Å; R231-H233 VanDerWaalsContact O-N 3.17Å; R231-R234 PolarHBondContact O-N 3.05Å
232	I	33.5	Very low	36.3	Very low	44 Å²	44	115.1 Å²	115.1	23%	0.226	55%	0.546	C	S	.	.	H	α-helix	trans	-55.8	-33.5	171	-69.1	164.1	0	0	0	110.3	L228 R234 L235	L228-I232 HydrophobicContact CB-CD1 4.1Å; L228-I232 HydrophobicContact CB-CG1 4.41Å; L228-I232 HydrophobicContact CD2-CD1 3.38Å; L228-I232 HydrophobicContact CD2-CG1 3.74Å; L228-I232 HydrophobicContact CG-CD1 3.83Å; L228-I232 HydrophobicContact CG-CG1 3.84Å; L228-I232 WeakPolarHBondContact O-CB 3.18Å; L228-I232 WeakPolarHBondContact O-CD1 3.35Å; L228-I232 WeakPolarHBondContact O-CG1 3.36Å; L228-I232 PolarHBondContact O-N 3.06Å; I232-R234 PolarHBondContact O-N 2.78Å; I232-L235 PolarHBondContact O-N 3.43Å
233	H	31.4	Very low	37.2	Very low	68 Å²	68	115.3 Å²	115.3	32%	0.315	55%	0.547	S	S	.	.	H	α-helix	trans	-60.8	-23.3	176.4	-72.5	-56.6	0	0	0	114.5	Y229 R231 Y288	Y229-H233 PolarHBondContact O-CD2 2.7Å; Y229-H233 PolarHBondContact O-NE2 2.9Å; R231-H233 PolarHBondContact O-N 2.89Å; R231-H233 VanDerWaalsContact O-N 3.17Å; H233-Y288 AromaticContact CE1-CE2 3.49Å; H233-Y288 VanDerWaalsContact CE1-CE2 3.49Å; H233-Y288 WeakPolarHBondContact CE1-CE2 3.24Å; H233-Y288 AromaticContact CE1-CZ 3.63Å; H233-Y288 PolarHBondContact CE1-OH 2.86Å; H233-Y288 AromaticContact ND1-CE2 3.69Å; H233-Y288 AromaticContact ND1-CZ 3.38Å; H233-Y288 PolarHBondContact ND1-OH 3.21Å; H233-Y288 VanDerWaalsContact ND1-OH 3.08Å
234	R	32.7	Very low	38.6	Very low	202 Å²	202	106.9 Å²	106.9	76%	0.762	52%	0.519	S	S	*	.	H	α-helix	trans	-85.4	-27.7	178	-77.5	-172.4	179	164.9	1.5	113.9	R231 I232	R231-R234 PolarHBondContact O-N 3.05Å; I232-R234 PolarHBondContact O-N 2.78Å
235	L	33.7	Very low	40.4	Very low	114 Å²	114	109.1 Å²	109.1	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-92.6	-14.9	-169.6	-74.1	162.1	0	0	0	114.2	I232 Y237	I232-L235 PolarHBondContact O-N 3.43Å; L235-Y237 PolarHBondContact O-N 2.89Å
236	S	35.3	Very low	42.9	Very low	35 Å²	35	104.9 Å²	104.9	25%	0.245	50%	0.504	C	S	.	.	S	Bend	trans	-83.7	18.7	179.3	-165.7	0	0	0	0	114.3	V211	V211-S236 WeakPolarHBondContact CG2-OG 3.25Å
237	Y	40.2	Very low	45.1	Very low	146 Å²	146	102.7 Å²	102.7	57%	0.573	49%	0.489	S	S	*	.			trans	-91.3	-0.4	-156.5	-144.1	-94.1	0	0	0	117.1	L235 S239	L235-Y237 PolarHBondContact O-N 2.89Å; Y237-S239 PolarHBondContact O-N 2.93Å
238	K	45	Very low	47.5	Very low	106 Å²	106	105.3 Å²	105.3	46%	0.461	50%	0.501	S	S	.	.			trans	-97.3	62	174	-70.4	-163.8	-169.4	177.3	0	111.4	G214 E240	G214-K238 PolarHBondContact O-NZ 2.91Å; K238-E240 PolarHBondContact O-N 3.5Å
239	S	47.2	Very low	49.8	Very low	16 Å²	16	104.5 Å²	104.5	11%	0.112	51%	0.506	C	S	.	.			trans	-68.5	126.5	159.5	55.2	0	0	0	0	109.1	Y237 Y241 K254	Y237-S239 PolarHBondContact O-N 2.93Å; S239-Y241 PolarHBondContact O-N 3.26Å; S239-K254 CarbonylContact C-O 3.54Å; S239-K254 WeakPolarHBondContact CA-O 3.33Å; S239-K254 VanDerWaalsContact CB-O 3.31Å; S239-K254 WeakPolarHBondContact CB-O 3.42Å
240	E	48.9	Very low	52.5	Low	113 Å²	113	96.6 Å²	96.6	53%	0.528	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-73.9	119.1	171	-163.7	171	-156.9	0	0	106.8	K238 T242 K254 R256	K238-E240 PolarHBondContact O-N 3.5Å; E240-T242 PolarHBondContact O-N 2.78Å; E240-K254 PolarHBondContact N-O 2.89Å; E240-K254 VanDerWaalsContact N-O 3.14Å; E240-K254 VanDerWaalsContact O-CB 3.28Å; E240-K254 WeakPolarHBondContact O-CB 3.38Å; E240-K254 PolarHBondContact O-N 2.88Å; E240-R256 IonicContact OE2-CZ 2.7Å; E240-R256 IonicContact OE2-NH2 3.4Å; E240-R256 PolarHBondContact OE2-NH2 3.41Å
241	Y	46	Very low	55.1	Low	122 Å²	122	96.7 Å²	96.7	48%	0.478	47%	0.467	S	S	.	.			trans	-69.8	107	170.6	-68.6	-84.2	0	0	0	106.5	S239 S252 V253	S239-Y241 PolarHBondContact O-N 3.26Å; Y241-S252 WeakPolarHBondContact CD1-O 3.16Å; Y241-V253 HydrophobicContact CE1-CG2 4.22Å
242	T	47.8	Very low	57.6	Low	38 Å²	38	88.4 Å²	88.4	23%	0.233	44%	0.436	C	S	.	.			trans	-89.4	150.6	167.6	46.1	0	0	0	0	108.9	E240 P244 K254	E240-T242 PolarHBondContact O-N 2.78Å; T242-P244 WeakPolarHBondContact O-CD 3.46Å; T242-K254 HydrophobicContact CG2-CB 4.21Å; T242-K254 HydrophobicContact CG2-CD 3.2Å; T242-K254 HydrophobicContact CG2-CG 4.39Å
243	N	47.9	Very low	60	Low	157 Å²	157	86.3 Å²	86.3	84%	0.84	43%	0.425	S	S	*	.			trans	-91	87.6	170.6	-80.7	-22.7	0	0	0	108.9
244	P	56.1	Low	62.6	Low	41 Å²	41	84.5 Å²	84.5	27%	0.266	42%	0.416	S	S	.	.	S	Bend		-59.9	138.9	123.5	23.5	-11.3	0	0	0	105.8	T242 C246 S252	T242-P244 WeakPolarHBondContact O-CD 3.46Å; P244-C246 PolarHBondContact O-N 3.02Å; P244-S252 WeakPolarHBondContact CG-OG 3.3Å
245	I	68.1	Low	65.1	Low	173 Å²	173	75.1 Å²	75.1	89%	0.887	38%	0.382	S	S	*	.			trans	-63.3	86	178.1	-58.2	166.3	0	0	0	106.8
246	C	82.2	Confident	67.5	Low	33 Å²	33	74.4 Å²	74.4	22%	0.223	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-81	139.2	177.9	-66.7	0	0	0	0	108.3	C189 P244 L250	C189-C246 HydrophobicContact CB-CB 3.84Å; C189-C246 WeakPolarHBondContact CB-SG 3.19Å; C189-C246 WeakPolarHBondContact SG-CA 3.27Å; C189-C246 WeakPolarHBondContact SG-CB 3.44Å; C189-C246 CovalentContact SG-SG 2.04Å; C189-C246 PolarHBondContact SG-SG 2.86Å; P244-C246 PolarHBondContact O-N 3.02Å; C246-L250 HydrophobicContact CB-CB 4.12Å
247	E	83.7	Confident	69.9	Low	108 Å²	108	72.7 Å²	72.7	51%	0.505	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-58.7	151.5	170.3	-65.8	177.4	-156.6	0	0	110.7	F90 G249 L250	F90-E247 HydrophobicContact CD1-CB 4.22Å; F90-E247 WeakPolarHBondContact CD1-OE2 3.43Å; F90-E247 HydrophobicContact CE1-CB 4.33Å; E247-G249 PolarHBondContact O-N 3.14Å; E247-G249 VanDerWaalsContact O-N 3.15Å; E247-L250 HydrophobicContact CB-CD1 4.3Å; E247-L250 WeakPolarHBondContact O-CB 3.38Å; E247-L250 PolarHBondContact O-N 3.39Å
248	V	84.4	Confident	71.9	Confident	140 Å²	140	67.5 Å²	67.5	85%	0.848	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	121.7	-176.7	178.4	0	0	0	0	110.4	F90	F90-V248 WeakPolarHBondContact CE1-O 3.43Å
249	G	84	Confident	73.7	Confident	40 Å²	40	62.5 Å²	62.5	41%	0.412	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-11.1	-178.3	0	0	0	0	0	114.4	E247	E247-G249 PolarHBondContact O-N 3.14Å; E247-G249 VanDerWaalsContact O-N 3.15Å
250	L	89	Confident	75.3	Confident	21 Å²	21	65.4 Å²	65.4	11%	0.11	33%	0.329	C	S	.	.			trans	-95	155.4	166.9	-57.8	-179.4	0	0	0	110.8	F90 V114 C189 A190 C246 E247	F90-L250 HydrophobicContact CB-CD1 4.45Å; F90-L250 HydrophobicContact CD1-CD1 3.86Å; F90-L250 HydrophobicContact CD1-CD2 4.28Å; F90-L250 HydrophobicContact CD1-CG 3.91Å; F90-L250 HydrophobicContact CD2-CD1 4.47Å; F90-L250 HydrophobicContact CD2-CD2 3.75Å; F90-L250 HydrophobicContact CD2-CG 4.29Å; F90-L250 HydrophobicContact CE1-CD1 4.16Å; F90-L250 HydrophobicContact CE1-CD2 4.06Å; F90-L250 HydrophobicContact CE1-CG 3.68Å; F90-L250 HydrophobicContact CE2-CD2 3.5Å; F90-L250 VanDerWaalsContact CE2-CD2 3.5Å; F90-L250 HydrophobicContact CE2-CG 4.09Å; F90-L250 HydrophobicContact CG-CD1 4.01Å; F90-L250 HydrophobicContact CG-CD2 4.12Å; F90-L250 HydrophobicContact CG-CG 4.18Å; F90-L250 HydrophobicContact CZ-CD2 3.65Å; F90-L250 HydrophobicContact CZ-CG 3.76Å; V114-L250 HydrophobicContact CB-CD2 3.96Å; V114-L250 HydrophobicContact CG2-CD1 4.34Å; V114-L250 HydrophobicContact CG2-CD2 3.78Å; C189-L250 HydrophobicContact CB-CB 3.96Å; C189-L250 HydrophobicContact CB-CD1 4.09Å; A190-L250 CarbonylContact O-C 3.49Å; A190-L250 WeakPolarHBondContact O-CA 3.18Å; C246-L250 HydrophobicContact CB-CB 4.12Å; E247-L250 HydrophobicContact CB-CD1 4.3Å; E247-L250 WeakPolarHBondContact O-CB 3.38Å; E247-L250 PolarHBondContact O-N 3.39Å
251	R	85.7	Confident	76.8	Confident	137 Å²	137	60.3 Å²	60.3	52%	0.517	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-137.8	142.9	178.4	-59.5	-176	-176.3	-168.9	-0.9	110.5	A190 V193	A190-R251 PolarHBondContact N-O 3.02Å; A190-R251 PolarHBondContact O-N 2.85Å; V193-R251 HydrophobicContact CG1-CB 4.49Å; V193-R251 WeakPolarHBondContact CG1-O 2.73Å
252	S	86	Confident	78.2	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.021	29%	0.289	C	S	.	.			trans	-112	144.4	166.4	170.7	0	0	0	0	108.9	T187 Y241 P244	T187-S252 WeakPolarHBondContact O-CB 3.45Å; T187-S252 PolarHBondContact O-OG 3.32Å; Y241-S252 WeakPolarHBondContact CD1-O 3.16Å; P244-S252 WeakPolarHBondContact CG-OG 3.3Å
253	V	85.3	Confident	79	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.307	C	S	.	.			trans	-121.6	137.6	-176.9	165.4	0	0	0	0	107.8	T186 T187 V193 I196 Y241	T186-V253 WeakPolarHBondContact CA-O 3.4Å; T187-V253 HydrophobicContact CG2-CB 4.36Å; T187-V253 PolarHBondContact N-O 2.81Å; T187-V253 PolarHBondContact OG1-N 3.33Å; V193-V253 HydrophobicContact CB-CG2 4.34Å; V193-V253 HydrophobicContact CG1-CB 4.23Å; V193-V253 HydrophobicContact CG1-CG2 3.62Å; V193-V253 HydrophobicContact CG2-CB 4.16Å; V193-V253 HydrophobicContact CG2-CG2 4.04Å; I196-V253 HydrophobicContact CD1-CG1 4.31Å; I196-V253 HydrophobicContact CG1-CG1 3.97Å; Y241-V253 HydrophobicContact CE1-CG2 4.22Å
254	K	85	Confident	79.5	Confident	29 Å²	29	53 Å²	53	13%	0.126	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.5	176	-178.1	179.3	-175.8	173.9	0	110.3	E184 C185 T186 S239 E240 T242	E184-K254 HydrophobicContact CG-CD 4.47Å; E184-K254 VanDerWaalsContact CG-CE 3.41Å; E184-K254 HydrophobicContact CG-CG 4.15Å; E184-K254 WeakPolarHBondContact OE1-CE 3.37Å; E184-K254 IonicContact OE1-NZ 2.93Å; E184-K254 PolarHBondContact OE1-NZ 3.04Å; E184-K254 WeakPolarHBondContact OE2-CE 3.36Å; E184-K254 IonicContact OE2-NZ 2.78Å; E184-K254 PolarHBondContact OE2-NZ 3.48Å; C185-K254 WeakPolarHBondContact O-CA 3.42Å; T186-K254 HydrophobicContact CG2-CB 4.42Å; S239-K254 CarbonylContact C-O 3.54Å; S239-K254 WeakPolarHBondContact CA-O 3.33Å; S239-K254 VanDerWaalsContact CB-O 3.31Å; S239-K254 WeakPolarHBondContact CB-O 3.42Å; E240-K254 PolarHBondContact N-O 2.89Å; E240-K254 VanDerWaalsContact N-O 3.14Å; E240-K254 VanDerWaalsContact O-CB 3.28Å; E240-K254 WeakPolarHBondContact O-CB 3.38Å; E240-K254 PolarHBondContact O-N 2.88Å; T242-K254 HydrophobicContact CG2-CB 4.21Å; T242-K254 HydrophobicContact CG2-CD 3.2Å; T242-K254 HydrophobicContact CG2-CG 4.39Å
255	S	84.8	Confident	79.2	Confident	5 Å²	5	60 Å²	60	4%	0.035	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	144.4	-177.8	-177.6	0	0	0	0	110.3	E184 C185 W198 V211	E184-S255 WeakPolarHBondContact CA-O 3.08Å; C185-S255 PolarHBondContact N-O 2.97Å; C185-S255 PolarHBondContact O-N 2.93Å; W198-S255 PolarHBondContact NE1-OG 3.34Å; V211-S255 VanDerWaalsContact CG1-OG 3.24Å; V211-S255 WeakPolarHBondContact CG1-OG 3.47Å; V211-S255 VanDerWaalsContact CG2-OG 3.25Å; V211-S255 WeakPolarHBondContact CG2-OG 2.88Å
256	R	85.7	Confident	78.1	Confident	99 Å²	99	54.8 Å²	54.8	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.4	177.5	-61.3	179.1	-168	157.8	21.9	110.1	L124 I183 E184 V211 Q212 E240	L124-R256 HydrophobicContact CD1-CG 4.14Å; I183-R256 CarbonylContact O-C 3.58Å; I183-R256 VanDerWaalsContact O-CA 3.3Å; I183-R256 WeakPolarHBondContact O-CA 3.43Å; E184-R256 HydrophobicContact CB-CG 4.09Å; E184-R256 HydrophobicContact CG-CG 4.02Å; E184-R256 IonicContact OE2-CZ 3.52Å; E184-R256 IonicContact OE2-NE 2.89Å; E184-R256 PolarHBondContact OE2-NE 3.22Å; E184-R256 IonicContact OE2-NH2 3.94Å; V211-R256 WeakPolarHBondContact CG1-O 3.28Å; Q212-R256 PolarHBondContact N-O 3Å; E240-R256 IonicContact OE2-CZ 2.7Å; E240-R256 IonicContact OE2-NH2 3.4Å; E240-R256 PolarHBondContact OE2-NH2 3.41Å
257	I	84.4	Confident	76.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.3	172	55.4	162.9	0	0	0	109.8	F182 I183 W198 L209 V211 I259 I283	F182-I257 WeakPolarHBondContact CA-O 3.4Å; I183-I257 HydrophobicContact CB-CG1 4.03Å; I183-I257 PolarHBondContact N-O 2.8Å; I183-I257 PolarHBondContact O-N 3.09Å; W198-I257 HydrophobicContact CB-CD1 4.5Å; W198-I257 HydrophobicContact CB-CG2 4.34Å; W198-I257 HydrophobicContact CD2-CB 4.49Å; W198-I257 HydrophobicContact CD2-CD1 3.62Å; W198-I257 HydrophobicContact CD2-CG1 3.9Å; W198-I257 HydrophobicContact CD2-CG2 3.77Å; W198-I257 HydrophobicContact CE3-CD1 3.24Å; W198-I257 HydrophobicContact CE3-CG1 3.82Å; W198-I257 HydrophobicContact CG-CD1 4.21Å; W198-I257 HydrophobicContact CG-CG2 3.69Å; W198-I257 HydrophobicContact CH2-CD1 4.14Å; W198-I257 HydrophobicContact CH2-CG1 3.86Å; W198-I257 HydrophobicContact CZ2-CD1 4.48Å; W198-I257 HydrophobicContact CZ2-CG1 3.97Å; W198-I257 HydrophobicContact CZ2-CG2 4.33Å; W198-I257 HydrophobicContact CZ3-CD1 3.54Å; W198-I257 HydrophobicContact CZ3-CG1 3.8Å; L209-I257 HydrophobicContact CD1-CD1 3.68Å; V211-I257 HydrophobicContact CG2-CG2 4.28Å; I257-I259 HydrophobicContact CD1-CD1 3.76Å; I257-I259 HydrophobicContact CD1-CG1 3.99Å; I257-I259 HydrophobicContact CG1-CG1 4.5Å; I257-I283 HydrophobicContact CD1-CG2 3.92Å
258	Q	83.4	Confident	74.1	Confident	37 Å²	37	59.6 Å²	59.6	17%	0.173	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	128	168.5	-171.7	-179.6	24.4	0	0	108.6	N179 I181 F182 K260	N179-Q258 PolarHBondContact O-NE2 2.86Å; I181-Q258 WeakPolarHBondContact O-CA 3.45Å; F182-Q258 HydrophobicContact CD1-CB 4.1Å; F182-Q258 HydrophobicContact CD1-CG 4.45Å; F182-Q258 HydrophobicContact CE1-CB 3.84Å; F182-Q258 HydrophobicContact CE1-CG 4.07Å; F182-Q258 HydrophobicContact CE2-CG 4.27Å; F182-Q258 HydrophobicContact CZ-CB 4.24Å; F182-Q258 HydrophobicContact CZ-CG 3.96Å; Q258-K260 HydrophobicContact CG-CG 4.46Å; Q258-K260 VanDerWaalsContact NE2-CE 3.29Å
259	I	82.6	Confident	72.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.2	178	-65.3	-60.5	0	0	0	109.2	G180 I181 I183 L209 I257 L277 I283 V348	G180-I259 CarbonylContact C-O 3.55Å; G180-I259 WeakPolarHBondContact CA-O 3.39Å; I181-I259 HydrophobicContact CG1-CB 3.98Å; I181-I259 HydrophobicContact CG1-CG2 4.47Å; I181-I259 PolarHBondContact N-O 3.02Å; I181-I259 PolarHBondContact O-N 2.91Å; I183-I259 HydrophobicContact CD1-CG1 3.74Å; I183-I259 HydrophobicContact CG1-CG1 4.47Å; L209-I259 HydrophobicContact CD1-CD1 3.73Å; L209-I259 HydrophobicContact CD2-CD1 4.4Å; I257-I259 HydrophobicContact CD1-CD1 3.76Å; I257-I259 HydrophobicContact CD1-CG1 3.99Å; I257-I259 HydrophobicContact CG1-CG1 4.5Å; I259-L277 HydrophobicContact CD1-CD1 4.29Å; I259-L277 HydrophobicContact CG2-CD1 3.39Å; I259-L277 HydrophobicContact CG2-CG 4.1Å; I259-I283 HydrophobicContact CB-CD1 4.5Å; I259-I283 HydrophobicContact CD1-CD1 3.78Å; I259-I283 HydrophobicContact CG1-CD1 3.68Å; I259-I283 HydrophobicContact CG2-CD1 4.14Å; I259-V348 HydrophobicContact CG2-CG1 4.48Å
260	K	79.9	Confident	70.2	Confident	77 Å²	77	61.9 Å²	61.9	34%	0.335	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.7	176.5	-60.9	-168.5	178.9	-157.4	0	110	E178 Q258 H275 T276 L277	E178-K260 PolarHBondContact O-NZ 3.34Å; E178-K260 VanDerWaalsContact O-NZ 3.09Å; Q258-K260 HydrophobicContact CG-CG 4.46Å; Q258-K260 VanDerWaalsContact NE2-CE 3.29Å; K260-H275 VanDerWaalsContact O-O 3.14Å; K260-T276 WeakPolarHBondContact O-CA 3.08Å; K260-L277 PolarHBondContact O-N 3.48Å
261	C	81.5	Confident	67.7	Low	7 Å²	7	69.3 Å²	69.3	5%	0.047	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	154.2	172	-59.6	0	0	0	0	110.8	L170 S263 L277 C350 P351	L170-C261 WeakPolarHBondContact CB-SG 3.44Å; L170-C261 VanDerWaalsContact CD1-SG 3.58Å; C261-S263 PolarHBondContact O-N 3.32Å; C261-L277 WeakPolarHBondContact CA-O 3.39Å; C261-C350 VanDerWaalsContact CA-SG 3.55Å; C261-C350 HydrophobicContact CB-CB 3.6Å; C261-C350 WeakPolarHBondContact CB-SG 3.17Å; C261-C350 WeakPolarHBondContact SG-CA 3.48Å; C261-C350 WeakPolarHBondContact SG-CB 3.36Å; C261-C350 CovalentContact SG-SG 2.04Å; C261-C350 PolarHBondContact SG-SG 2.97Å; C261-P351 HydrophobicContact CB-CG 4.1Å
262	A	74.5	Confident	65.7	Low	14 Å²	14	66.3 Å²	66.3	12%	0.116	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-71.3	126.4	175.9	0	0	0	0	0	109.9	T276 L277 V278	A262-T276 HydrophobicContact CB-CG2 3.49Å; A262-T276 VanDerWaalsContact CB-CG2 3.49Å; A262-L277 PolarHBondContact N-O 3Å; A262-V278 HydrophobicContact CB-CG1 3.63Å
263	S	65.1	Low	64	Low	89 Å²	89	72.9 Å²	72.9	62%	0.622	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-67.9	131.6	164.7	-174.7	0	0	0	0	108	C261 E265 S266	C261-S263 PolarHBondContact O-N 3.32Å; S263-E265 PolarHBondContact O-N 3.13Å; S263-S266 PolarHBondContact O-N 2.69Å
264	G	57.5	Low	62.6	Low	61 Å²	61	74.9 Å²	74.9	63%	0.629	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-7.4	-166.2	0	0	0	0	0	116.9
265	E	50.5	Low	61.4	Low	187 Å²	187	75.6 Å²	75.6	87%	0.874	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-20.5	180	-70.9	-179.7	161.2	0	0	114.1	S263 Q267	S263-E265 PolarHBondContact O-N 3.13Å; E265-Q267 PolarHBondContact O-N 3.46Å
266	S	44.9	Very low	60.6	Low	63 Å²	63	76.6 Å²	76.6	44%	0.441	43%	0.426	S	S	.	.			trans	-95.3	67.5	-176.2	170.5	0	0	0	0	112.1	S263 T268	S263-S266 PolarHBondContact O-N 2.69Å; S266-T268 VanDerWaalsContact C-N 3.3Å; S266-T268 PolarHBondContact O-N 3.1Å
267	Q	42.1	Very low	60.4	Low	159 Å²	159	71.9 Å²	71.9	74%	0.743	41%	0.408	S	S	*	.			trans	-87	19.9	176.7	-67.4	-173.9	27.2	0	0	114.5	E265 P269	E265-Q267 PolarHBondContact O-N 3.46Å; Q267-P269 WeakPolarHBondContact O-CD 3.49Å
268	T	40.6	Very low	60.2	Low	84 Å²	84	74.2 Å²	74.2	52%	0.515	42%	0.423	S	S	.	.			trans	-91.4	110.1	170.2	43.9	0	0	0	0	109.9	S266 S270	S266-T268 VanDerWaalsContact C-N 3.3Å; S266-T268 PolarHBondContact O-N 3.1Å; T268-S270 PolarHBondContact O-N 3.02Å
269	P	44.9	Very low	60.2	Low	119 Å²	119	72.9 Å²	72.9	77%	0.773	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-62.7	-19.1	-175.5	-20.1	32	0	0	0	113.8	Q267 K271	Q267-P269 WeakPolarHBondContact O-CD 3.49Å; P269-K271 PolarHBondContact O-N 2.87Å
270	S	40.2	Very low	60.4	Low	109 Å²	109	75.1 Å²	75.1	76%	0.762	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-79.6	-13.7	-169.8	53.2	0	0	0	0	115	T268	T268-S270 PolarHBondContact O-N 3.02Å
271	K	37.9	Very low	60.8	Low	177 Å²	177	71.5 Å²	71.5	77%	0.77	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-130.7	26.4	179	-81	-170.3	176.4	-175.7	0	113.2	P269 L273	P269-K271 PolarHBondContact O-N 2.87Å; K271-L273 PolarHBondContact O-N 3.05Å
272	L	43.6	Very low	61.1	Low	73 Å²	73	74.1 Å²	74.1	38%	0.382	43%	0.426	S	S	.	.			trans	-60.4	103.5	171.7	-128.4	92	0	0	0	107.9	S274 T276	L272-S274 PolarHBondContact O-N 3.23Å; L272-T276 VanDerWaalsContact CD2-O 3.26Å; L272-T276 WeakPolarHBondContact CD2-O 3.31Å
273	L	49.1	Very low	61.8	Low	142 Å²	142	73.5 Å²	73.5	74%	0.743	42%	0.42	S	S	*	.			trans	-43.7	134.2	169.5	-75.2	144.6	0	0	0	107.5	K271 H275 T276	K271-L273 PolarHBondContact O-N 3.05Å; L273-H275 PolarHBondContact O-N 3.14Å; L273-T276 PolarHBondContact O-N 2.04Å; L273-T276 PolarHBondContact O-OG1 2.64Å
274	S	55.8	Low	62.9	Low	42 Å²	42	70.6 Å²	70.6	29%	0.294	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	6.3	-162.1	51.5	0	0	0	0	117.6	L272	L272-S274 PolarHBondContact O-N 3.23Å
275	H	60.7	Low	64.4	Low	44 Å²	44	67.7 Å²	67.7	20%	0.204	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.5	3.5	-173.6	-57.5	-79	0	0	0	114.2	R210 K260 L273 L277	R210-H275 PolarHBondContact N-CE1 3.31Å; R210-H275 PolarHBondContact O-CE1 3.12Å; R210-H275 VanDerWaalsContact O-CE1 3.24Å; K260-H275 VanDerWaalsContact O-O 3.14Å; L273-H275 PolarHBondContact O-N 3.14Å; H275-L277 PolarHBondContact O-N 3.48Å
276	T	68.9	Low	66.1	Low	25 Å²	25	62 Å²	62	15%	0.153	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	110.6	-171.4	-32.4	0	0	0	0	109.9	K260 A262 L272 L273	K260-T276 WeakPolarHBondContact O-CA 3.08Å; A262-T276 HydrophobicContact CB-CG2 3.49Å; A262-T276 VanDerWaalsContact CB-CG2 3.49Å; L272-T276 VanDerWaalsContact CD2-O 3.26Å; L272-T276 WeakPolarHBondContact CD2-O 3.31Å; L273-T276 PolarHBondContact O-N 2.04Å; L273-T276 PolarHBondContact O-OG1 2.64Å
277	L	80.5	Confident	68.1	Low	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	148	-175.3	-59.2	-172.2	0	0	0	111.8	A200 W205 I259 K260 C261 A262 H275 N281 I283 C350	A200-L277 HydrophobicContact CB-CD2 4.04Å; W205-L277 HydrophobicContact CH2-CD2 3.56Å; W205-L277 HydrophobicContact CZ2-CD2 3.66Å; I259-L277 HydrophobicContact CD1-CD1 4.29Å; I259-L277 HydrophobicContact CG2-CD1 3.39Å; I259-L277 HydrophobicContact CG2-CG 4.1Å; K260-L277 PolarHBondContact O-N 3.48Å; C261-L277 WeakPolarHBondContact CA-O 3.39Å; A262-L277 PolarHBondContact N-O 3Å; H275-L277 PolarHBondContact O-N 3.48Å; L277-N281 HydrophobicContact CD1-CB 3.95Å; L277-I283 HydrophobicContact CD1-CD1 3.81Å; L277-I283 HydrophobicContact CD1-CG1 4.34Å; L277-C350 HydrophobicContact CB-CB 4.41Å; L277-C350 VanDerWaalsContact CB-SG 3.58Å; L277-C350 WeakPolarHBondContact O-CB 3.34Å
278	V	80.3	Confident	70.1	Confident	49 Å²	49	55.4 Å²	55.4	30%	0.297	30%	0.302	S	S	.	.			trans	-133.5	144.7	174	-69.5	0	0	0	0	109.4	N202 A262 N281	N202-V278 PolarHBondContact ND2-O 3.03Å; A262-V278 HydrophobicContact CB-CG1 3.63Å; V278-N281 PolarHBondContact O-ND2 2.85Å
279	G	84.1	Confident	72.1	Confident	10 Å²	10	52.4 Å²	52.4	10%	0.103	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	63.1	-152.9	179.4	0	0	0	0	0	114.3	N281 C350	G279-N281 PolarHBondContact O-ND2 3.22Å; G279-C350 VanDerWaalsContact CA-O 3.31Å; G279-C350 WeakPolarHBondContact CA-O 3.43Å; G279-C350 PolarHBondContact N-O 2.81Å; G279-C350 VanDerWaalsContact N-O 3.12Å; G279-C350 PolarHBondContact O-N 2.83Å
280	L	86.2	Confident	73.8	Confident	47 Å²	47	48.8 Å²	48.8	25%	0.246	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	121.8	179.5	-178	64	0	0	0	111.5	L164 P167 N202 Y347 L349	L164-L280 HydrophobicContact CD1-CD2 3.89Å; P167-L280 HydrophobicContact CB-CD1 3.68Å; P167-L280 HydrophobicContact CG-CD1 3.94Å; N202-L280 PolarHBondContact ND2-O 3.44Å; N202-L280 PolarHBondContact OD1-O 2.87Å; N202-L280 VanDerWaalsContact OD1-O 3.07Å; L280-Y347 HydrophobicContact CD1-CD1 4.41Å; L280-L349 HydrophobicContact CB-CD1 4.11Å; L280-L349 HydrophobicContact CD1-CB 4.46Å; L280-L349 HydrophobicContact CD1-CD1 4.45Å
281	N	87.3	Confident	75.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.5	-175.6	-63.8	-90.5	0	0	0	110.6	K201 L277 V278 G279 Y347 V348	K201-N281 CarbonylContact O-C 3.59Å; K201-N281 WeakPolarHBondContact O-CA 3.21Å; L277-N281 HydrophobicContact CD1-CB 3.95Å; V278-N281 PolarHBondContact O-ND2 2.85Å; G279-N281 PolarHBondContact O-ND2 3.22Å; N281-Y347 CarbonylContact O-C 3.49Å; N281-Y347 WeakPolarHBondContact O-CA 3.45Å; N281-V348 PolarHBondContact N-O 3.05Å; N281-V348 PolarHBondContact O-N 2.68Å
282	K	89.2	Confident	78	Confident	63 Å²	63	48.6 Å²	48.6	27%	0.274	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	115.2	165.9	-173.6	177.5	-177.3	164.9	0	108.7	A200 K201 C345 Y347	A200-K282 CarbonylContact C-O 3.59Å; A200-K282 WeakPolarHBondContact CA-O 3.25Å; K201-K282 PolarHBondContact N-O 3.25Å; K201-K282 PolarHBondContact O-N 3.5Å; K282-C345 VanDerWaalsContact CE-SG 3.5Å; K282-C345 HydrophobicContact CG-CB 4.37Å; K282-Y347 HydrophobicContact CB-CD1 3.91Å; K282-Y347 HydrophobicContact CB-CE1 3.55Å; K282-Y347 HydrophobicContact CD-CE1 4Å; K282-Y347 HydrophobicContact CG-CD1 4.29Å; K282-Y347 HydrophobicContact CG-CE1 3.75Å
283	I	89	Confident	80	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.1	175.1	-55.6	177.1	0	0	0	107.2	I183 W198 K199 L209 I257 I259 L277 C345 I346 V348	I183-I283 HydrophobicContact CD1-CD1 3.91Å; W198-I283 HydrophobicContact CE3-CG2 4.01Å; W198-I283 HydrophobicContact CZ3-CG2 4.25Å; K199-I283 CarbonylContact O-C 3.56Å; K199-I283 WeakPolarHBondContact O-CA 3.4Å; L209-I283 HydrophobicContact CD1-CG2 3.87Å; I257-I283 HydrophobicContact CD1-CG2 3.92Å; I259-I283 HydrophobicContact CB-CD1 4.5Å; I259-I283 HydrophobicContact CD1-CD1 3.78Å; I259-I283 HydrophobicContact CG1-CD1 3.68Å; I259-I283 HydrophobicContact CG2-CD1 4.14Å; L277-I283 HydrophobicContact CD1-CD1 3.81Å; L277-I283 HydrophobicContact CD1-CG1 4.34Å; I283-C345 CarbonylContact O-C 3.59Å; I283-C345 WeakPolarHBondContact O-CA 3.35Å; I283-C345 WeakPolarHBondContact O-CB 3.48Å; I283-I346 HydrophobicContact CB-CG2 3.84Å; I283-I346 HydrophobicContact CG2-CG2 4.37Å; I283-I346 PolarHBondContact N-O 3.41Å; I283-I346 PolarHBondContact O-N 2.83Å; I283-V348 HydrophobicContact CD1-CB 4.19Å; I283-V348 HydrophobicContact CD1-CG2 3.63Å; I283-V348 HydrophobicContact CG1-CG2 4.46Å
284	T	88.5	Confident	81.4	Confident	27 Å²	27	44.1 Å²	44.1	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	137.1	-176.3	-51.1	0	0	0	0	109.3	W198 K199 A343 A344 C345	W198-T284 CarbonylContact C-O 3.4Å; W198-T284 WeakPolarHBondContact CA-O 3.04Å; K199-T284 PolarHBondContact N-O 3.05Å; K199-T284 PolarHBondContact O-N 3.16Å; T284-A343 HydrophobicContact CG2-CB 4.08Å; T284-A344 CarbonylContact C-O 3.51Å; T284-A344 WeakPolarHBondContact CA-O 3.2Å; T284-A344 WeakPolarHBondContact CG2-O 2.95Å; T284-C345 HydrophobicContact CG2-CB 4.2Å
285	C	88.1	Confident	82.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.7	167.1	58.8	0	0	0	0	110.9	V118 C185 I196 Y197 W198 A343 A344	V118-C285 VanDerWaalsContact CG1-SG 3.59Å; C185-C285 HydrophobicContact CB-CB 3.76Å; C185-C285 WeakPolarHBondContact CB-SG 3.37Å; C185-C285 WeakPolarHBondContact SG-CB 3.31Å; C185-C285 CovalentContact SG-SG 2.06Å; C185-C285 PolarHBondContact SG-SG 2.82Å; I196-C285 HydrophobicContact CG2-CB 3.6Å; Y197-C285 VanDerWaalsContact O-CA 3.31Å; Y197-C285 WeakPolarHBondContact O-CA 3.49Å; W198-C285 HydrophobicContact CD2-CB 3.89Å; W198-C285 HydrophobicContact CE3-CB 3.64Å; W198-C285 HydrophobicContact CH2-CB 4.06Å; W198-C285 HydrophobicContact CZ2-CB 4.24Å; W198-C285 HydrophobicContact CZ3-CB 3.73Å; C285-A343 WeakPolarHBondContact O-CA 3.48Å; C285-A344 PolarHBondContact N-O 2.86Å; C285-A344 PolarHBondContact O-N 2.81Å
286	F	87.3	Confident	84	Confident	66 Å²	66	49 Å²	49	29%	0.289	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	154	175.5	54.3	-97.6	0	0	0	110.7	I196 Y197 K199 A343	I196-F286 WeakPolarHBondContact CA-O 3.32Å; Y197-F286 VanDerWaalsContact CB-CE2 3.46Å; Y197-F286 HydrophobicContact CD1-CD1 4.04Å; Y197-F286 HydrophobicContact CD1-CD2 4.31Å; Y197-F286 AromaticContact CD1-CE1 3.16Å; Y197-F286 HydrophobicContact CD1-CE1 3.16Å; Y197-F286 AromaticContact CD1-CE2 3.48Å; Y197-F286 HydrophobicContact CD1-CE2 3.48Å; Y197-F286 VanDerWaalsContact CD1-CE2 3.48Å; Y197-F286 AromaticContact CD1-CZ 2.85Å; Y197-F286 HydrophobicContact CD1-CZ 2.85Å; Y197-F286 HydrophobicContact CD2-CZ 4.44Å; Y197-F286 AromaticContact CE1-CE1 3.6Å; Y197-F286 HydrophobicContact CE1-CE1 3.6Å; Y197-F286 HydrophobicContact CE1-CE2 4.21Å; Y197-F286 AromaticContact CE1-CZ 3.26Å; Y197-F286 HydrophobicContact CE1-CZ 3.26Å; Y197-F286 HydrophobicContact CG-CD2 4.38Å; Y197-F286 HydrophobicContact CG-CE1 4.12Å; Y197-F286 AromaticContact CG-CE2 3.6Å; Y197-F286 HydrophobicContact CG-CE2 3.6Å; Y197-F286 AromaticContact CG-CZ 3.48Å; Y197-F286 HydrophobicContact CG-CZ 3.48Å; Y197-F286 VanDerWaalsContact CG-CZ 3.48Å; Y197-F286 PolarHBondContact N-O 2.9Å; Y197-F286 PolarHBondContact O-N 3Å; K199-F286 HydrophobicContact CB-CE1 4.35Å; F286-A343 HydrophobicContact CB-CB 4.11Å
287	P	86.4	Confident	84.8	Confident	13 Å²	13	48.3 Å²	48.3	8%	0.084	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	139.5	-179.1	27.6	-23.7	0	0	0	109.5	A116 V118 T187 V193 Y289 A342	A116-P287 HydrophobicContact CB-CB 3.78Å; A116-P287 HydrophobicContact CB-CG 4.12Å; A116-P287 WeakPolarHBondContact O-CG 3.12Å; V118-P287 HydrophobicContact CG2-CB 4.46Å; V118-P287 HydrophobicContact CG2-CG 4.11Å; T187-P287 HydrophobicContact CG2-CB 4.21Å; V193-P287 HydrophobicContact CG2-CB 4.12Å; P287-Y289 HydrophobicContact CB-CE2 4.15Å; P287-Y289 HydrophobicContact CG-CE2 4Å; P287-A342 VanDerWaalsContact CD-O 3.27Å; P287-A342 WeakPolarHBondContact CD-O 3.45Å
288	Y	83.8	Confident	84.8	Confident	71 Å²	71	51.3 Å²	51.3	28%	0.278	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.5	177.3	175.2	-110.7	0	0	0	110.4	K194 G195 H233	K194-Y288 HydrophobicContact CB-CD1 3.77Å; K194-Y288 HydrophobicContact CB-CE1 4.07Å; K194-Y288 PolarHBondContact N-O 2.81Å; G195-Y288 PolarHBondContact N-O 2.06Å; G195-Y288 PolarHBondContact O-N 3.24Å; H233-Y288 AromaticContact CE1-CE2 3.49Å; H233-Y288 VanDerWaalsContact CE1-CE2 3.49Å; H233-Y288 WeakPolarHBondContact CE1-CE2 3.24Å; H233-Y288 AromaticContact CE1-CZ 3.63Å; H233-Y288 PolarHBondContact CE1-OH 2.86Å; H233-Y288 AromaticContact ND1-CE2 3.69Å; H233-Y288 AromaticContact ND1-CZ 3.38Å; H233-Y288 PolarHBondContact ND1-OH 3.21Å; H233-Y288 VanDerWaalsContact ND1-OH 3.08Å
289	Y	81.6	Confident	85.1	Confident	21 Å²	21	56.9 Å²	56.9	8%	0.082	27%	0.273	C	S	.	.			trans	-113.2	156.8	175.9	-57.2	-76.9	0	0	0	109.8	A116 S192 V193 P287 M293 L297	A116-Y289 VanDerWaalsContact CA-OH 3.3Å; A116-Y289 WeakPolarHBondContact CA-OH 3.31Å; A116-Y289 HydrophobicContact CB-CE1 4.37Å; A116-Y289 WeakPolarHBondContact CB-OH 3.48Å; A116-Y289 PolarHBondContact N-OH 3.08Å; A116-Y289 PolarHBondContact O-OH 2.82Å; S192-Y289 VanDerWaalsContact O-CD1 3.31Å; S192-Y289 WeakPolarHBondContact O-CD1 3.3Å; V193-Y289 HydrophobicContact CB-CE1 4.36Å; P287-Y289 HydrophobicContact CB-CE2 4.15Å; P287-Y289 HydrophobicContact CG-CE2 4Å; Y289-M293 HydrophobicContact CD1-CG 4Å; Y289-M293 HydrophobicContact CG-CG 4.48Å; Y289-L297 HydrophobicContact CD1-CD1 4Å; Y289-L297 HydrophobicContact CD2-CD1 4.24Å; Y289-L297 HydrophobicContact CE1-CD1 3.9Å; Y289-L297 HydrophobicContact CE2-CD1 4.11Å; Y289-L297 HydrophobicContact CG-CD1 4.19Å
290	D	81.9	Confident	85.1	Confident	44 Å²	44	57.4 Å²	57.4	24%	0.235	27%	0.274	C	S	.	.			trans	-68.2	158	161.6	59.1	56.1	0	0	0	110.6	K194 E292 M293 E294	K194-D290 WeakPolarHBondContact CE-OD2 3.46Å; K194-D290 IonicContact NZ-OD2 3.18Å; D290-E292 PolarHBondContact O-N 3.35Å; D290-E292 PolarHBondContact OD1-N 3.18Å; D290-M293 PolarHBondContact O-N 3.17Å; D290-M293 WeakPolarHBondContact OD1-CB 3.49Å; D290-M293 PolarHBondContact OD1-N 2.9Å; D290-E294 WeakPolarHBondContact O-CB 3.26Å; D290-E294 PolarHBondContact O-N 2.92Å
291	K	81.2	Confident	85	Confident	160 Å²	160	57.2 Å²	57.2	70%	0.696	27%	0.274	S	S	*	.	H	α-helix	trans	-59.2	-32	-175.8	-172.5	176.3	-178.4	178.2	0	112.7	N295	K291-N295 WeakPolarHBondContact O-CB 3.26Å; K291-N295 PolarHBondContact O-N 2.78Å; K291-N295 VanDerWaalsContact O-N 3.1Å; K291-N295 PolarHBondContact O-ND2 3.1Å
292	E	85.3	Confident	84.7	Confident	121 Å²	121	65.1 Å²	65.1	57%	0.565	30%	0.304	S	S	*	.	H	α-helix	trans	-67.7	-48.4	178.4	-172.6	-171.8	155.9	0	0	110.8	D290 N295 K296	D290-E292 PolarHBondContact O-N 3.35Å; D290-E292 PolarHBondContact OD1-N 3.18Å; E292-N295 PolarHBondContact O-N 3.49Å; E292-K296 WeakPolarHBondContact O-CG 3.44Å; E292-K296 PolarHBondContact O-N 3.48Å; E292-K296 VanDerWaalsContact OE1-CE 3.24Å; E292-K296 WeakPolarHBondContact OE1-CE 3.29Å; E292-K296 IonicContact OE1-NZ 2.72Å; E292-K296 PolarHBondContact OE1-NZ 2.83Å
293	M	84	Confident	84.2	Confident	11 Å²	11	65.8 Å²	65.8	5%	0.054	31%	0.305	C	S	.	.	H	α-helix	trans	-66.8	-39.8	178.8	-172.8	66.3	-178.1	0	0	111.8	L113 Y289 D290 N295 K296 L297	L113-M293 HydrophobicContact CB-CE 4.05Å; L113-M293 HydrophobicContact CD1-CE 3.9Å; L113-M293 HydrophobicContact CD1-SD 4.19Å; L113-M293 HydrophobicContact CD2-CE 4.09Å; L113-M293 HydrophobicContact CG-CE 4.23Å; Y289-M293 HydrophobicContact CD1-CG 4Å; Y289-M293 HydrophobicContact CG-CG 4.48Å; D290-M293 PolarHBondContact O-N 3.17Å; D290-M293 WeakPolarHBondContact OD1-CB 3.49Å; D290-M293 PolarHBondContact OD1-N 2.9Å; M293-N295 VanDerWaalsContact C-N 3.32Å; M293-N295 PolarHBondContact O-N 2.96Å; M293-K296 PolarHBondContact O-N 3.28Å; M293-L297 HydrophobicContact CE-CD1 3.99Å; M293-L297 HydrophobicContact CE-CD2 3.94Å; M293-L297 HydrophobicContact CE-CG 3.88Å; M293-L297 HydrophobicContact CG-CD1 4.02Å; M293-L297 HydrophobicContact CG-CG 4.34Å; M293-L297 WeakPolarHBondContact O-CB 3.47Å; M293-L297 WeakPolarHBondContact O-CG 3.45Å; M293-L297 PolarHBondContact O-N 3.29Å
294	E	79.6	Confident	83.6	Confident	111 Å²	111	66.5 Å²	66.5	52%	0.519	31%	0.309	S	S	.	.	H	α-helix	trans	-59.9	-42.7	174.9	-169.3	175.8	-170.9	0	0	111.6	D290 S298	D290-E294 WeakPolarHBondContact O-CB 3.26Å; D290-E294 PolarHBondContact O-N 2.92Å; E294-S298 WeakPolarHBondContact O-CB 3.35Å; E294-S298 PolarHBondContact O-N 2.56Å; E294-S298 PolarHBondContact O-OG 3.41Å
295	N	84.9	Confident	83.1	Confident	94 Å²	94	70.8 Å²	70.8	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-65.1	-40.5	174.4	-73.7	-16.2	0	0	0	112.5	K291 E292 M293 S298 K299	K291-N295 WeakPolarHBondContact O-CB 3.26Å; K291-N295 PolarHBondContact O-N 2.78Å; K291-N295 VanDerWaalsContact O-N 3.1Å; K291-N295 PolarHBondContact O-ND2 3.1Å; E292-N295 PolarHBondContact O-N 3.49Å; M293-N295 VanDerWaalsContact C-N 3.32Å; M293-N295 PolarHBondContact O-N 2.96Å; N295-S298 WeakPolarHBondContact CA-OG 3.49Å; N295-S298 PolarHBondContact O-OG 2.92Å; N295-K299 WeakPolarHBondContact O-CB 3.45Å; N295-K299 PolarHBondContact O-N 3.21Å; N295-K299 VanDerWaalsContact O-N 3.12Å
296	K	86.4	Confident	82.6	Confident	93 Å²	93	75.4 Å²	75.4	40%	0.404	35%	0.349	S	S	.	.	H	α-helix	trans	-64.5	-48.3	176.1	-74.4	177.8	-174.4	170.2	0	111.5	L113 E292 M293 K299 L300	L113-K296 HydrophobicContact CD1-CB 4.21Å; E292-K296 WeakPolarHBondContact O-CG 3.44Å; E292-K296 PolarHBondContact O-N 3.48Å; E292-K296 VanDerWaalsContact OE1-CE 3.24Å; E292-K296 WeakPolarHBondContact OE1-CE 3.29Å; E292-K296 IonicContact OE1-NZ 2.72Å; E292-K296 PolarHBondContact OE1-NZ 2.83Å; M293-K296 PolarHBondContact O-N 3.28Å; K296-K299 PolarHBondContact O-N 3.44Å; K296-L300 WeakPolarHBondContact O-CG 3.44Å; K296-L300 PolarHBondContact O-N 3.2Å
297	L	84.6	Confident	81.6	Confident	11 Å²	11	76.2 Å²	76.2	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-45.6	179.8	-74.4	172.3	0	0	0	111.7	L32 L113 Y289 M293 K299 L300 T301	L32-L297 HydrophobicContact CD1-CD2 3.57Å; L113-L297 HydrophobicContact CB-CD2 4.36Å; Y289-L297 HydrophobicContact CD1-CD1 4Å; Y289-L297 HydrophobicContact CD2-CD1 4.24Å; Y289-L297 HydrophobicContact CE1-CD1 3.9Å; Y289-L297 HydrophobicContact CE2-CD1 4.11Å; Y289-L297 HydrophobicContact CG-CD1 4.19Å; M293-L297 HydrophobicContact CE-CD1 3.99Å; M293-L297 HydrophobicContact CE-CD2 3.94Å; M293-L297 HydrophobicContact CE-CG 3.88Å; M293-L297 HydrophobicContact CG-CD1 4.02Å; M293-L297 HydrophobicContact CG-CG 4.34Å; M293-L297 WeakPolarHBondContact O-CB 3.47Å; M293-L297 WeakPolarHBondContact O-CG 3.45Å; M293-L297 PolarHBondContact O-N 3.29Å; L297-K299 PolarHBondContact O-N 2.84Å; L297-L300 PolarHBondContact O-N 3.19Å; L297-T301 VanDerWaalsContact O-CB 3.3Å; L297-T301 WeakPolarHBondContact O-CB 3.47Å; L297-T301 PolarHBondContact O-N 3.06Å; L297-T301 PolarHBondContact O-OG1 3.4Å
298	S	82.1	Confident	80.4	Confident	64 Å²	64	80.5 Å²	80.5	45%	0.448	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-42.9	178.7	54.3	0	0	0	0	112.2	E294 N295 T301 R302	E294-S298 WeakPolarHBondContact O-CB 3.35Å; E294-S298 PolarHBondContact O-N 2.56Å; E294-S298 PolarHBondContact O-OG 3.41Å; N295-S298 WeakPolarHBondContact CA-OG 3.49Å; N295-S298 PolarHBondContact O-OG 2.92Å; S298-T301 PolarHBondContact O-N 2.81Å; S298-R302 WeakPolarHBondContact O-CB 3.4Å; S298-R302 PolarHBondContact O-N 3.04Å
299	K	85.7	Confident	79.1	Confident	166 Å²	166	83.8 Å²	83.8	72%	0.722	39%	0.388	S	S	*	.	H	α-helix	trans	-62.1	-46	176.4	-172.6	178.7	179.6	-177.3	0	112.3	N295 K296 L297 Y303	N295-K299 WeakPolarHBondContact O-CB 3.45Å; N295-K299 PolarHBondContact O-N 3.21Å; N295-K299 VanDerWaalsContact O-N 3.12Å; K296-K299 PolarHBondContact O-N 3.44Å; L297-K299 PolarHBondContact O-N 2.84Å; K299-Y303 PolarHBondContact O-N 3.5Å; K299-Y303 VanDerWaalsContact O-N 3.1Å
300	L	84.9	Confident	77.3	Confident	21 Å²	21	85.6 Å²	85.6	11%	0.11	41%	0.413	C	S	.	.	H	α-helix	trans	-68.6	-40.2	179.2	-71	170.2	0	0	0	112.3	V30 L113 K296 L297 Y303 N304	V30-L300 HydrophobicContact CG1-CD1 4.13Å; V30-L300 WeakPolarHBondContact O-CD2 3.13Å; L113-L300 HydrophobicContact CD1-CD1 3.78Å; L113-L300 HydrophobicContact CG-CD1 4.45Å; K296-L300 WeakPolarHBondContact O-CG 3.44Å; K296-L300 PolarHBondContact O-N 3.2Å; L297-L300 PolarHBondContact O-N 3.19Å; L300-Y303 PolarHBondContact O-N 3.37Å; L300-N304 VanDerWaalsContact O-CG 3.31Å; L300-N304 PolarHBondContact O-N 2.87Å; L300-N304 PolarHBondContact O-ND2 2.82Å
301	T	82.5	Confident	75.4	Confident	42 Å²	42	89.8 Å²	89.8	26%	0.258	44%	0.44	S	S	.	.	H	α-helix	trans	-61.2	-47.8	177.1	-55.5	0	0	0	0	110.5	L297 S298 Y303 N304 E305	L297-T301 VanDerWaalsContact O-CB 3.3Å; L297-T301 WeakPolarHBondContact O-CB 3.47Å; L297-T301 PolarHBondContact O-N 3.06Å; L297-T301 PolarHBondContact O-OG1 3.4Å; S298-T301 PolarHBondContact O-N 2.81Å; T301-Y303 VanDerWaalsContact C-N 3.33Å; T301-Y303 PolarHBondContact O-N 2.9Å; T301-N304 PolarHBondContact O-N 2.85Å; T301-E305 WeakPolarHBondContact O-CG 3.08Å; T301-E305 PolarHBondContact O-N 2.98Å
302	R	81.8	Confident	73.2	Confident	166 Å²	166	84 Å²	84	63%	0.626	42%	0.419	S	S	*	.	H	α-helix	trans	-59.1	-44.4	177	-179	177.3	174.6	168.3	1.9	112.1	S298 N304 E305 E306	S298-R302 WeakPolarHBondContact O-CB 3.4Å; S298-R302 PolarHBondContact O-N 3.04Å; R302-N304 VanDerWaalsContact C-N 3.34Å; R302-N304 PolarHBondContact O-N 3.43Å; R302-E305 PolarHBondContact O-N 3.35Å; R302-E306 HydrophobicContact CG-CG 4.5Å; R302-E306 WeakPolarHBondContact CG-OE1 3.38Å; R302-E306 IonicContact CZ-OE1 3.4Å; R302-E306 IonicContact NE-OE1 2.91Å; R302-E306 PolarHBondContact NE-OE1 3.28Å; R302-E306 IonicContact NH2-OE1 2.86Å; R302-E306 WeakPolarHBondContact O-CG 3.39Å; R302-E306 PolarHBondContact O-N 3.1Å
303	Y	79.1	Confident	70.7	Confident	77 Å²	77	81.9 Å²	81.9	30%	0.302	42%	0.418	S	S	.	.	H	α-helix	trans	-60.3	-44.2	177.8	-174.5	-85.3	0	0	0	111.8	P27 K299 L300 T301 E306 Q307	P27-Y303 HydrophobicContact CB-CD1 3.79Å; P27-Y303 HydrophobicContact CB-CE1 3.13Å; P27-Y303 HydrophobicContact CB-CE2 4.21Å; P27-Y303 WeakPolarHBondContact CB-OH 3.36Å; P27-Y303 HydrophobicContact CG-CD1 4.02Å; P27-Y303 HydrophobicContact CG-CE1 3.71Å; K299-Y303 PolarHBondContact O-N 3.5Å; K299-Y303 VanDerWaalsContact O-N 3.1Å; L300-Y303 PolarHBondContact O-N 3.37Å; T301-Y303 VanDerWaalsContact C-N 3.33Å; T301-Y303 PolarHBondContact O-N 2.9Å; Y303-E306 PolarHBondContact O-N 3.26Å; Y303-Q307 HydrophobicContact CD1-CG 4.12Å; Y303-Q307 HydrophobicContact CE1-CG 3.6Å; Y303-Q307 WeakPolarHBondContact O-CG 3.5Å; Y303-Q307 PolarHBondContact O-N 3.13Å; Y303-Q307 VanDerWaalsContact O-N 3.13Å
304	N	76	Confident	68.3	Low	17 Å²	17	89.9 Å²	89.9	9%	0.091	46%	0.456	C	S	.	.	H	α-helix	trans	-63.3	-43.5	177.8	-71	-24	0	0	0	112	S35 L300 T301 R302 E306 Q307 H308	S35-N304 WeakPolarHBondContact CB-ND2 3.37Å; S35-N304 WeakPolarHBondContact CB-OD1 3.46Å; L300-N304 VanDerWaalsContact O-CG 3.31Å; L300-N304 PolarHBondContact O-N 2.87Å; L300-N304 PolarHBondContact O-ND2 2.82Å; T301-N304 PolarHBondContact O-N 2.85Å; R302-N304 VanDerWaalsContact C-N 3.34Å; R302-N304 PolarHBondContact O-N 3.43Å; N304-E306 PolarHBondContact O-N 3.12Å; N304-Q307 PolarHBondContact O-N 2.93Å; N304-H308 PolarHBondContact O-CD2 3.38Å; N304-H308 PolarHBondContact O-N 2.98Å
305	E	77.8	Confident	66.2	Low	116 Å²	116	92.3 Å²	92.3	54%	0.542	47%	0.471	S	S	.	.	H	α-helix	trans	-62.8	-40	176.7	-73.1	178.9	-172.7	0	0	112.7	T301 R302 K309	T301-E305 WeakPolarHBondContact O-CG 3.08Å; T301-E305 PolarHBondContact O-N 2.98Å; R302-E305 PolarHBondContact O-N 3.35Å; E305-K309 WeakPolarHBondContact O-CG 3.37Å; E305-K309 PolarHBondContact O-N 2.95Å
306	E	78.4	Confident	63.6	Low	99 Å²	99	92.9 Å²	92.9	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-38.2	177.4	-74.7	174.9	-174.1	0	0	111.8	R302 Y303 N304	R302-E306 HydrophobicContact CG-CG 4.5Å; R302-E306 WeakPolarHBondContact CG-OE1 3.38Å; R302-E306 IonicContact CZ-OE1 3.4Å; R302-E306 IonicContact NE-OE1 2.91Å; R302-E306 PolarHBondContact NE-OE1 3.28Å; R302-E306 IonicContact NH2-OE1 2.86Å; R302-E306 WeakPolarHBondContact O-CG 3.39Å; R302-E306 PolarHBondContact O-N 3.1Å; Y303-E306 PolarHBondContact O-N 3.26Å; N304-E306 PolarHBondContact O-N 3.12Å
307	Q	66.3	Low	60.8	Low	83 Å²	83	95.1 Å²	95.1	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-73.3	-41	178.2	-68.9	-65.5	-28.2	0	0	113.1	Y36 Y303 N304 K309 G310	Y36-Q307 HydrophobicContact CE1-CB 4.27Å; Y36-Q307 HydrophobicContact CE1-CG 4.24Å; Y303-Q307 HydrophobicContact CD1-CG 4.12Å; Y303-Q307 HydrophobicContact CE1-CG 3.6Å; Y303-Q307 WeakPolarHBondContact O-CG 3.5Å; Y303-Q307 PolarHBondContact O-N 3.13Å; Y303-Q307 VanDerWaalsContact O-N 3.13Å; N304-Q307 PolarHBondContact O-N 2.93Å; Q307-K309 PolarHBondContact O-N 2.66Å; Q307-G310 PolarHBondContact O-N 3.38Å; Q307-G310 VanDerWaalsContact O-N 3.11Å
308	H	60.9	Low	58.2	Low	102 Å²	102	102.9 Å²	102.9	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-68.8	-18.9	178.8	-77.4	-65.9	0	0	0	113.5	N304 G310 S312	N304-H308 PolarHBondContact O-CD2 3.38Å; N304-H308 PolarHBondContact O-N 2.98Å; H308-G310 PolarHBondContact O-N 3.33Å; H308-S312 PolarHBondContact O-N 2.72Å
309	K	55.4	Low	55.8	Low	141 Å²	141	107.2 Å²	107.2	61%	0.613	54%	0.542	S	S	*	.	H	α-helix	trans	-63.1	-21	171	-78.8	174.8	-177.3	175.2	0	113.2	E305 Q307	E305-K309 WeakPolarHBondContact O-CG 3.37Å; E305-K309 PolarHBondContact O-N 2.95Å; Q307-K309 PolarHBondContact O-N 2.66Å
310	G	44.7	Very low	53.2	Low	59 Å²	59	106.3 Å²	106.3	61%	0.608	54%	0.538	S	S	*	.	H	α-helix	trans	-92.6	-28.3	179.7	0	0	0	0	0	115.8	Q307 H308	Q307-G310 PolarHBondContact O-N 3.38Å; Q307-G310 VanDerWaalsContact O-N 3.11Å; H308-G310 PolarHBondContact O-N 3.33Å
311	V	42.3	Very low	50.6	Low	131 Å²	131	112.8 Å²	112.8	79%	0.794	57%	0.572	S	S	*	*	H	α-helix	trans	-103.4	-17.5	-171.5	-176.3	0	0	0	0	113
312	S	34.9	Very low	47.9	Very low	38 Å²	38	117.2 Å²	117.2	27%	0.266	60%	0.595	S	S	.	*			trans	-105.4	45.9	-178.2	-156.1	0	0	0	0	113.4	H308	H308-S312 PolarHBondContact O-N 2.72Å
313	S	33.3	Very low	45.4	Very low	78 Å²	78	114.4 Å²	114.4	55%	0.545	60%	0.598	S	S	.	*	S	Bend	trans	-89.8	-5.6	172.8	-56.2	0	0	0	0	113.5
314	Q	33.4	Very low	43.3	Very low	179 Å²	179	116.3 Å²	116.3	84%	0.836	62%	0.62	S	S	*	*	S	Bend	trans	-123	-10.1	-179.7	-73.7	-170.2	-6.9	0	0	116.5
315	L	34.1	Very low	41	Very low	162 Å²	162	121 Å²	121	85%	0.848	65%	0.645	S	S	*	*	S	Bend	trans	-114.1	0.2	-180	-143.3	75.8	0	0	0	116
316	I	30.5	Very low	39.1	Very low	105 Å²	105	122.2 Å²	122.2	54%	0.538	65%	0.653	S	S	.	*			trans	-140.1	63.3	171.7	-46.9	178.1	0	0	0	109.1	H318	I316-H318 VanDerWaalsContact C-N 3.25Å; I316-H318 VanDerWaalsContact CG2-O 3.28Å; I316-H318 WeakPolarHBondContact CG2-O 3.41Å
317	I	29.2	Very low	37.1	Very low	141 Å²	141	122.3 Å²	122.3	72%	0.723	66%	0.661	S	S	*	*			trans	-83.9	-5.4	163.2	-64	179.1	0	0	0	110.8	N319	I317-N319 PolarHBondContact O-N 2.83Å
318	H	28.5	Very low	35.9	Very low	174 Å²	174	126.5 Å²	126.5	81%	0.806	68%	0.681	S	S	*	*	S	Bend	trans	-84.6	108.1	160.5	-92	-72.5	0	0	0	109.9	I316	I316-H318 VanDerWaalsContact C-N 3.25Å; I316-H318 VanDerWaalsContact CG2-O 3.28Å; I316-H318 WeakPolarHBondContact CG2-O 3.41Å
319	N	31.3	Very low	35.3	Very low	155 Å²	155	125.3 Å²	125.3	83%	0.829	68%	0.684	S	S	*	*	S	Bend	trans	97.1	48.8	157	-135.5	25.5	0	0	0	118.2	I317	I317-N319 PolarHBondContact O-N 2.83Å
320	K	32	Very low	35.3	Very low	147 Å²	147	121.5 Å²	121.5	64%	0.639	67%	0.67	S	S	*	*			trans	-113	26.7	174.7	-135.1	178.3	-169.6	174.4	0	115.3
321	N	30.2	Very low	36.3	Very low	156 Å²	156	118.9 Å²	118.9	83%	0.834	64%	0.642	S	S	*	*	S	Bend	trans	-111.1	10.5	179.2	-84	2	0	0	0	115.9
322	N	25.8	Very low	37.1	Very low	136 Å²	136	117.2 Å²	117.2	73%	0.727	63%	0.628	S	S	*	*	S	Bend	trans	-139	134.8	161	-79.2	-38.2	0	0	0	108.8
323	P	28.8	Very low	38	Very low	106 Å²	106	117.4 Å²	117.4	69%	0.688	63%	0.626	S	S	*	*			trans	-53.5	147.2	163.7	27.8	-31.8	0	0	0	107	D325	P323-D325 VanDerWaalsContact C-N 3.26Å; P323-D325 PolarHBondContact O-N 2.84Å
324	P	35.3	Very low	39	Very low	117 Å²	117	115.6 Å²	115.6	76%	0.76	61%	0.61	S	S	*	*			trans	-58.2	99.8	-178.6	24.7	-31.8	0	0	0	107.2	I326	P324-I326 WeakPolarHBondContact O-CG1 3.5Å; P324-I326 PolarHBondContact O-N 3.34Å
325	D	27.7	Very low	39.7	Very low	116 Å²	116	113 Å²	113	62%	0.62	60%	0.602	S	S	*	*			trans	-71.3	94.6	175	-156.1	-20.7	0	0	0	102.6	P323 T327	P323-D325 VanDerWaalsContact C-N 3.26Å; P323-D325 PolarHBondContact O-N 2.84Å; D325-T327 PolarHBondContact O-N 2.64Å; D325-T327 WeakPolarHBondContact OD1-CG2 3.44Å; D325-T327 PolarHBondContact OD1-OG1 2.86Å
326	I	38	Very low	40.4	Very low	141 Å²	141	108.2 Å²	108.2	72%	0.723	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	30	179.5	-62.9	156.7	0	0	0	110.1	P324	P324-I326 WeakPolarHBondContact O-CG1 3.5Å; P324-I326 PolarHBondContact O-N 3.34Å
327	T	36.6	Very low	41.1	Very low	102 Å²	102	108.6 Å²	108.6	63%	0.626	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-16.8	175.9	50.1	0	0	0	0	112.2	D325	D325-T327 PolarHBondContact O-N 2.64Å; D325-T327 WeakPolarHBondContact OD1-CG2 3.44Å; D325-T327 PolarHBondContact OD1-OG1 2.86Å
328	Q	40	Very low	42.2	Very low	171 Å²	171	103.4 Å²	103.4	80%	0.799	58%	0.576	S	S	*	*	S	Bend	trans	-121.5	-1.1	-167.8	-140.9	173.2	20.5	0	0	118.4	D330	Q328-D330 VanDerWaalsContact C-N 3.27Å; Q328-D330 PolarHBondContact O-N 2.91Å; Q328-D330 VanDerWaalsContact O-N 3.14Å
329	S	49.1	Very low	43.6	Very low	77 Å²	77	102 Å²	102	54%	0.538	57%	0.57	S	S	.	*	S	Bend	trans	-82.9	86.7	156.8	63.7	0	0	0	0	107
330	D	56.4	Low	44.9	Very low	60 Å²	60	96.7 Å²	96.7	32%	0.321	55%	0.545	S	S	.	.			trans	-46.9	146.4	174.6	-88.6	-39.9	0	0	0	110.7	Q328 L332	Q328-D330 VanDerWaalsContact C-N 3.27Å; Q328-D330 PolarHBondContact O-N 2.91Å; Q328-D330 VanDerWaalsContact O-N 3.14Å; D330-L332 PolarHBondContact O-N 3.22Å
331	C	65.6	Low	46.6	Very low	4 Å²	4	92.8 Å²	92.8	3%	0.027	53%	0.529	C	S	.	.			trans	-53.6	104.4	175.8	-66.2	0	0	0	0	109.9	C345 Y347	C331-C345 WeakPolarHBondContact CA-SG 3.41Å; C331-C345 VanDerWaalsContact CB-C 3.47Å; C331-C345 HydrophobicContact CB-CB 4.03Å; C331-C345 VanDerWaalsContact CB-O 3.25Å; C331-C345 WeakPolarHBondContact CB-O 3.23Å; C331-C345 WeakPolarHBondContact CB-SG 2.98Å; C331-C345 VanDerWaalsContact SG-C 3.58Å; C331-C345 WeakPolarHBondContact SG-CB 3.37Å; C331-C345 CovalentContact SG-SG 2.02Å; C331-C345 PolarHBondContact SG-SG 3.02Å; C331-Y347 HydrophobicContact CB-CD2 3.88Å; C331-Y347 HydrophobicContact CB-CE2 3.81Å; C331-Y347 VanDerWaalsContact SG-CD2 3.6Å; C331-Y347 WeakPolarHBondContact SG-CE2 3.05Å
332	L	58.3	Low	48.7	Very low	96 Å²	96	87.9 Å²	87.9	50%	0.503	51%	0.51	S	S	.	.			trans	-82.8	133.3	176.7	-72.7	156.4	0	0	0	108.8	P120 D330	P120-L332 WeakPolarHBondContact CB-O 3.5Å; D330-L332 PolarHBondContact O-N 3.22Å
333	I	54.6	Low	51.2	Low	42 Å²	42	83.2 Å²	83.2	22%	0.215	49%	0.49	C	S	.	.			trans	-89.9	150.1	162.6	-64.7	-171.9	0	0	0	107.7	P120 L123 L161 D335 I346	P120-I333 VanDerWaalsContact CB-C 3.49Å; L123-I333 HydrophobicContact CD1-CD1 4.21Å; L161-I333 WeakPolarHBondContact O-CD1 3.47Å; L161-I333 VanDerWaalsContact O-CG1 3.31Å; L161-I333 WeakPolarHBondContact O-CG1 3.42Å; I333-D335 PolarHBondContact O-N 3.26Å; I333-I346 HydrophobicContact CD1-CD1 3.73Å; I333-I346 HydrophobicContact CD1-CG1 4.04Å; I333-I346 HydrophobicContact CG1-CD1 4.17Å; I333-I346 HydrophobicContact CG1-CG1 4.29Å
334	D	54.1	Low	53.9	Low	40 Å²	40	78.5 Å²	78.5	21%	0.214	46%	0.46	C	S	.	.			trans	-63.8	105	178.9	-165.1	8.2	0	0	0	109.1	P120 K122 G336	P120-D334 HydrophobicContact CB-CB 3.83Å; K122-D334 WeakPolarHBondContact CE-OD2 3.46Å; K122-D334 IonicContact NZ-OD2 3.92Å; K122-D334 PolarHBondContact NZ-OD2 2.98Å; D334-G336 VanDerWaalsContact C-N 3.27Å; D334-G336 WeakPolarHBondContact OD1-CA 3.18Å; D334-G336 PolarHBondContact OD1-N 2.86Å
335	D	48.6	Very low	56.4	Low	125 Å²	125	73.7 Å²	73.7	67%	0.668	43%	0.429	S	S	*	.	S	Bend	trans	-88.5	2.3	169.7	65	-14.5	0	0	0	112	I333 N337	I333-D335 PolarHBondContact O-N 3.26Å; D335-N337 WeakPolarHBondContact OD1-CB 3.41Å; D335-N337 PolarHBondContact OD1-N 2.93Å; D335-N337 VanDerWaalsContact OD1-N 3.12Å; D335-N337 PolarHBondContact OD2-ND2 3.06Å
336	G	47.5	Very low	59.3	Low	62 Å²	62	68.1 Å²	68.1	64%	0.639	40%	0.399	S	S	*	.	S	Bend	trans	105	-9.1	-175.3	0	0	0	0	0	114.2	D334	D334-G336 VanDerWaalsContact C-N 3.27Å; D334-G336 WeakPolarHBondContact OD1-CA 3.18Å; D334-G336 PolarHBondContact OD1-N 2.86Å
337	N	45.8	Very low	61.6	Low	113 Å²	113	62.7 Å²	62.7	60%	0.604	37%	0.37	S	S	*	.			trans	-81.5	-9.8	178.5	-76.9	-32.6	0	0	0	114.3	D335 H339	D335-N337 WeakPolarHBondContact OD1-CB 3.41Å; D335-N337 PolarHBondContact OD1-N 2.93Å; D335-N337 VanDerWaalsContact OD1-N 3.12Å; D335-N337 PolarHBondContact OD2-ND2 3.06Å; N337-H339 VanDerWaalsContact C-N 3.29Å; N337-H339 PolarHBondContact O-N 2.81Å
338	G	52.4	Low	64	Low	31 Å²	31	57.8 Å²	57.8	32%	0.32	34%	0.34	S	S	.	.			trans	63.5	15.7	158.8	0	0	0	0	0	118	Y119 S340	Y119-G338 WeakPolarHBondContact CD1-O 3.49Å; Y119-G338 WeakPolarHBondContact CE1-O 3.19Å; G338-S340 PolarHBondContact O-N 2.8Å
339	H	56.7	Low	66.2	Low	146 Å²	146	51.9 Å²	51.9	68%	0.676	31%	0.314	S	S	*	.			trans	-71.6	117.5	178.9	-66.5	-42.9	0	0	0	111.7	P120 N337	P120-H339 WeakPolarHBondContact CD-O 3.24Å; N337-H339 VanDerWaalsContact C-N 3.29Å; N337-H339 PolarHBondContact O-N 2.81Å
340	S	58.5	Low	68	Low	42 Å²	42	48.3 Å²	48.3	29%	0.294	29%	0.289	S	S	.	.			trans	-82.7	140.8	178.1	60.2	0	0	0	0	111.7	D117 V118 G338	D117-S340 VanDerWaalsContact CB-CB 3.41Å; D117-S340 WeakPolarHBondContact CB-OG 3.37Å; V118-S340 WeakPolarHBondContact O-CA 3.13Å; G338-S340 PolarHBondContact O-N 2.8Å
341	Q	67.7	Low	69	Low	66 Å²	66	47.4 Å²	47.4	31%	0.308	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-126	163.1	179.7	-61.7	-176.8	11	0	0	111.3	D117 V118 A343	D117-Q341 CarbonylContact C-O 3.42Å; D117-Q341 WeakPolarHBondContact CA-O 3.24Å; V118-Q341 PolarHBondContact N-O 2.88Å; V118-Q341 PolarHBondContact O-N 3.36Å; Q341-A343 WeakPolarHBondContact CB-O 2.95Å; Q341-A343 PolarHBondContact O-N 2.76Å
342	A	74.1	Confident	69.3	Low	53 Å²	53	49.5 Å²	49.5	44%	0.438	31%	0.308	S	S	.	.	S	Bend	trans	-58.4	-26.6	178.3	0	0	0	0	0	113.6	P287	P287-A342 VanDerWaalsContact CD-O 3.27Å; P287-A342 WeakPolarHBondContact CD-O 3.45Å
343	A	80.3	Confident	69.6	Low	38 Å²	38	53 Å²	53	31%	0.314	32%	0.322	S	S	.	.	S	Bend	trans	-147.8	150.2	170.1	0	0	0	0	0	108.8	T284 C285 F286 Q341	T284-A343 HydrophobicContact CG2-CB 4.08Å; C285-A343 WeakPolarHBondContact O-CA 3.48Å; F286-A343 HydrophobicContact CB-CB 4.11Å; Q341-A343 WeakPolarHBondContact CB-O 2.95Å; Q341-A343 PolarHBondContact O-N 2.76Å
344	A	84.9	Confident	69.8	Low	7 Å²	7	56 Å²	56	6%	0.058	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	153	173.1	0	0	0	0	0	109.5	V118 P121 T284 C285	V118-A344 HydrophobicContact CB-CB 4.24Å; V118-A344 HydrophobicContact CG1-CB 3.64Å; P121-A344 HydrophobicContact CG-CB 4.08Å; T284-A344 CarbonylContact C-O 3.51Å; T284-A344 WeakPolarHBondContact CA-O 3.2Å; T284-A344 WeakPolarHBondContact CG2-O 2.95Å; C285-A344 PolarHBondContact N-O 2.86Å; C285-A344 PolarHBondContact O-N 2.81Å
345	C	87.6	Confident	70.1	Confident	15 Å²	15	57.5 Å²	57.5	10%	0.101	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	170.9	-176.7	57	0	0	0	0	112.2	K282 I283 T284 C331	K282-C345 VanDerWaalsContact CE-SG 3.5Å; K282-C345 HydrophobicContact CG-CB 4.37Å; I283-C345 CarbonylContact O-C 3.59Å; I283-C345 WeakPolarHBondContact O-CA 3.35Å; I283-C345 WeakPolarHBondContact O-CB 3.48Å; T284-C345 HydrophobicContact CG2-CB 4.2Å; C331-C345 WeakPolarHBondContact CA-SG 3.41Å; C331-C345 VanDerWaalsContact CB-C 3.47Å; C331-C345 HydrophobicContact CB-CB 4.03Å; C331-C345 VanDerWaalsContact CB-O 3.25Å; C331-C345 WeakPolarHBondContact CB-O 3.23Å; C331-C345 WeakPolarHBondContact CB-SG 2.98Å; C331-C345 VanDerWaalsContact SG-C 3.58Å; C331-C345 WeakPolarHBondContact SG-CB 3.37Å; C331-C345 CovalentContact SG-SG 2.02Å; C331-C345 PolarHBondContact SG-SG 3.02Å
346	I	87.6	Confident	70.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	141.8	179.6	-165.1	170.1	0	0	0	108.8	L123 I168 I183 I283 I333	L123-I346 HydrophobicContact CD1-CD1 4.45Å; L123-I346 HydrophobicContact CD2-CD1 4.2Å; L123-I346 HydrophobicContact CG-CD1 4.26Å; I168-I346 HydrophobicContact CD1-CD1 3.35Å; I168-I346 HydrophobicContact CD1-CG1 3.74Å; I183-I346 HydrophobicContact CD1-CG2 3.93Å; I183-I346 HydrophobicContact CG2-CG2 4.44Å; I283-I346 HydrophobicContact CB-CG2 3.84Å; I283-I346 HydrophobicContact CG2-CG2 4.37Å; I283-I346 PolarHBondContact N-O 3.41Å; I283-I346 PolarHBondContact O-N 2.83Å; I333-I346 HydrophobicContact CD1-CD1 3.73Å; I333-I346 HydrophobicContact CD1-CG1 4.04Å; I333-I346 HydrophobicContact CG1-CD1 4.17Å; I333-I346 HydrophobicContact CG1-CG1 4.29Å
347	Y	87.9	Confident	71.2	Confident	26 Å²	26	62.5 Å²	62.5	10%	0.102	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	131.7	176.9	-68.7	-89.1	0	0	0	110.9	G162 T163 L164 I168 L280 N281 K282 C331	G162-Y347 WeakPolarHBondContact O-CD2 3.36Å; G162-Y347 PolarHBondContact O-N 3.43Å; T163-Y347 VanDerWaalsContact C-CD2 3.41Å; L164-Y347 HydrophobicContact CB-CD2 4.1Å; L164-Y347 HydrophobicContact CB-CE1 4.28Å; L164-Y347 HydrophobicContact CB-CE2 3.71Å; L164-Y347 HydrophobicContact CB-CG 4.49Å; L164-Y347 HydrophobicContact CD1-CD1 3.87Å; L164-Y347 HydrophobicContact CD1-CE1 3.5Å; L164-Y347 VanDerWaalsContact CD1-CE1 3.5Å; L164-Y347 HydrophobicContact CD1-CE2 4.48Å; L164-Y347 HydrophobicContact CG-CE1 4.45Å; I168-Y347 PolarHBondContact N-O 3.33Å; L280-Y347 HydrophobicContact CD1-CD1 4.41Å; N281-Y347 CarbonylContact O-C 3.49Å; N281-Y347 WeakPolarHBondContact O-CA 3.45Å; K282-Y347 HydrophobicContact CB-CD1 3.91Å; K282-Y347 HydrophobicContact CB-CE1 3.55Å; K282-Y347 HydrophobicContact CD-CE1 4Å; K282-Y347 HydrophobicContact CG-CD1 4.29Å; K282-Y347 HydrophobicContact CG-CE1 3.75Å; C331-Y347 HydrophobicContact CB-CD2 3.88Å; C331-Y347 HydrophobicContact CB-CE2 3.81Å; C331-Y347 VanDerWaalsContact SG-CD2 3.6Å; C331-Y347 WeakPolarHBondContact SG-CE2 3.05Å
348	V	87	Confident	72.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.1	179.6	-179.2	0	0	0	0	108.7	I168 L170 I181 I259 N281 I283	I168-V348 HydrophobicContact CB-CG2 4.42Å; I168-V348 HydrophobicContact CD1-CG2 4.45Å; L170-V348 HydrophobicContact CD1-CG1 3.34Å; L170-V348 HydrophobicContact CG-CG1 3.83Å; I181-V348 HydrophobicContact CD1-CG2 4.17Å; I259-V348 HydrophobicContact CG2-CG1 4.48Å; N281-V348 PolarHBondContact N-O 3.05Å; N281-V348 PolarHBondContact O-N 2.68Å; I283-V348 HydrophobicContact CD1-CB 4.19Å; I283-V348 HydrophobicContact CD1-CG2 3.63Å; I283-V348 HydrophobicContact CG1-CG2 4.46Å
349	L	86.5	Confident	73	Confident	47 Å²	47	64.3 Å²	64.3	25%	0.246	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	115.9	176.3	-178.3	65.9	0	0	0	109.3	P167 I168 L170 I171 L280	P167-L349 HydrophobicContact CB-CB 4.14Å; P167-L349 HydrophobicContact CG-CB 3.95Å; P167-L349 HydrophobicContact CG-CD2 4.39Å; I168-L349 PolarHBondContact O-N 2.74Å; L170-L349 WeakPolarHBondContact CB-O 3.37Å; L170-L349 PolarHBondContact N-O 2.83Å; I171-L349 HydrophobicContact CD1-CD2 3.63Å; I171-L349 HydrophobicContact CD1-CG 3.77Å; I171-L349 HydrophobicContact CG1-CG 4.29Å; L280-L349 HydrophobicContact CB-CD1 4.11Å; L280-L349 HydrophobicContact CD1-CB 4.46Å; L280-L349 HydrophobicContact CD1-CD1 4.45Å
350	C	85.6	Confident	73.7	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.014	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	154.9	175.7	-78	0	0	0	0	111.2	C261 L277 G279 G352	C261-C350 VanDerWaalsContact CA-SG 3.55Å; C261-C350 HydrophobicContact CB-CB 3.6Å; C261-C350 WeakPolarHBondContact CB-SG 3.17Å; C261-C350 WeakPolarHBondContact SG-CA 3.48Å; C261-C350 WeakPolarHBondContact SG-CB 3.36Å; C261-C350 CovalentContact SG-SG 2.04Å; C261-C350 PolarHBondContact SG-SG 2.97Å; L277-C350 HydrophobicContact CB-CB 4.41Å; L277-C350 VanDerWaalsContact CB-SG 3.58Å; L277-C350 WeakPolarHBondContact O-CB 3.34Å; G279-C350 VanDerWaalsContact CA-O 3.31Å; G279-C350 WeakPolarHBondContact CA-O 3.43Å; G279-C350 PolarHBondContact N-O 2.81Å; G279-C350 VanDerWaalsContact N-O 3.12Å; G279-C350 PolarHBondContact O-N 2.83Å; C350-G352 PolarHBondContact O-N 3.15Å
351	P	78.6	Confident	74.3	Confident	41 Å²	41	65.9 Å²	65.9	27%	0.266	37%	0.373	S	S	.	.	S	Bend	trans	-55.5	139.6	167.1	24.5	-33.5	0	0	0	110.3	C261	C261-P351 HydrophobicContact CB-CG 4.1Å
352	G	71.9	Confident	74.7	Confident	47 Å²	47	67.1 Å²	67.1	49%	0.485	38%	0.379	S	S	.	.			trans	173.4	166.8	-177.3	0	0	0	0	0	110.8	C350	C350-G352 PolarHBondContact O-N 3.15Å
353	Q	63	Low	74.9	Confident	169 Å²	169	70 Å²	70	79%	0.79	38%	0.381	S	S	*	.	S	Bend	trans	-55.3	135.4	173	-76.4	-175.9	-18	0	0	109	V355	Q353-V355 PolarHBondContact O-N 2.87Å
354	P	59.1	Low	75.1	Confident	106 Å²	106	72 Å²	72	69%	0.688	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-52.9	133.1	179.3	22.1	-32.3	0	0	0	108.5	A356	P354-A356 PolarHBondContact O-N 2.94Å
355	V	60.4	Low	75.1	Confident	71 Å²	71	74.1 Å²	74.1	43%	0.43	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-47	130.7	175.4	-129.1	0	0	0	0	107.4	S203 Q353 W357	S203-V355 VanDerWaalsContact OG-CG1 3.31Å; S203-V355 WeakPolarHBondContact OG-CG1 3.39Å; Q353-V355 PolarHBondContact O-N 2.87Å; V355-W357 PolarHBondContact O-N 2.75Å
356	A	58.5	Low	75.1	Confident	63 Å²	63	77.4 Å²	77.4	52%	0.521	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-54.4	118.6	176.2	0	0	0	0	0	107.3	P354 F358	P354-A356 PolarHBondContact O-N 2.94Å; A356-F358 CarbonylContact O-C 3.54Å; A356-F358 PolarHBondContact O-N 3.15Å
357	W	61.9	Low	75.3	Confident	230 Å²	230	79.4 Å²	79.4	87%	0.871	44%	0.444	S	S	*	.	S	Bend	trans	-56.4	-16.8	-174.1	-73.6	53	0	0	0	113.1	V355	V355-W357 PolarHBondContact O-N 2.75Å
358	F	63.7	Low	75.4	Confident	96 Å²	96	81 Å²	81	42%	0.421	46%	0.459	S	S	.	.	S	Bend	trans	-127.3	130.8	174.9	-61.6	-71.2	0	0	0	109.4	A356 E362 K363 I366	A356-F358 CarbonylContact O-C 3.54Å; A356-F358 PolarHBondContact O-N 3.15Å; F358-E362 WeakPolarHBondContact CA-OE2 3.34Å; F358-E362 HydrophobicContact CB-CB 3.98Å; F358-E362 HydrophobicContact CD1-CB 4.03Å; F358-E362 HydrophobicContact CG-CB 4.48Å; F358-K363 HydrophobicContact CB-CD 4.48Å; F358-K363 HydrophobicContact CB-CG 3.58Å; F358-K363 WeakPolarHBondContact O-CE 3.02Å; F358-I366 HydrophobicContact CD1-CD1 3.65Å; F358-I366 HydrophobicContact CE1-CD1 3.54Å; F358-I366 HydrophobicContact CE2-CD1 4.43Å; F358-I366 HydrophobicContact CG-CD1 4.15Å; F358-I366 HydrophobicContact CZ-CD1 3.95Å
359	T	70.6	Confident	75.8	Confident	86 Å²	86	84 Å²	84	53%	0.528	48%	0.48	S	S	.	.			trans	-56.8	156.9	163.4	62.1	0	0	0	0	109.9	G361 E362 K363	T359-G361 PolarHBondContact O-N 3.49Å; T359-E362 WeakPolarHBondContact CB-OE2 3.29Å; T359-E362 PolarHBondContact N-OE2 3.3Å; T359-E362 PolarHBondContact O-N 3.03Å; T359-E362 VanDerWaalsContact O-N 3.07Å; T359-E362 WeakPolarHBondContact OG1-CB 3.39Å; T359-E362 VanDerWaalsContact OG1-CD 3.24Å; T359-E362 VanDerWaalsContact OG1-CG 3.22Å; T359-E362 WeakPolarHBondContact OG1-CG 3.49Å; T359-E362 PolarHBondContact OG1-N 3.22Å; T359-E362 PolarHBondContact OG1-OE2 3.13Å; T359-K363 PolarHBondContact O-N 2.92Å
360	F	71.4	Confident	76.2	Confident	172 Å²	172	83.8 Å²	83.8	75%	0.754	49%	0.485	S	S	*	.	H	α-helix	trans	-55.9	-38.3	177.1	-174.1	-96.3	0	0	0	111.7	K363 V364	F360-K363 PolarHBondContact O-N 2.8Å; F360-V364 HydrophobicContact CD1-CG2 4.06Å; F360-V364 HydrophobicContact CE1-CG2 3.73Å; F360-V364 HydrophobicContact CZ-CG2 4.07Å; F360-V364 VanDerWaalsContact O-CG2 3.3Å; F360-V364 WeakPolarHBondContact O-CG2 3.28Å; F360-V364 PolarHBondContact O-N 3.25Å
361	G	72.6	Confident	76.6	Confident	49 Å²	49	86.3 Å²	86.3	51%	0.505	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-44.1	174.5	0	0	0	0	0	113.2	T359 V364 A365	T359-G361 PolarHBondContact O-N 3.49Å; G361-V364 PolarHBondContact O-N 2.89Å; G361-A365 WeakPolarHBondContact O-CB 3.48Å; G361-A365 PolarHBondContact O-N 2.81Å
362	E	76.1	Confident	77.4	Confident	91 Å²	91	89.6 Å²	89.6	43%	0.425	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-39.6	175.8	-73.6	162.3	155	0	0	112.1	F358 T359 V364 A365 I366	F358-E362 WeakPolarHBondContact CA-OE2 3.34Å; F358-E362 HydrophobicContact CB-CB 3.98Å; F358-E362 HydrophobicContact CD1-CB 4.03Å; F358-E362 HydrophobicContact CG-CB 4.48Å; T359-E362 WeakPolarHBondContact CB-OE2 3.29Å; T359-E362 PolarHBondContact N-OE2 3.3Å; T359-E362 PolarHBondContact O-N 3.03Å; T359-E362 VanDerWaalsContact O-N 3.07Å; T359-E362 WeakPolarHBondContact OG1-CB 3.39Å; T359-E362 VanDerWaalsContact OG1-CD 3.24Å; T359-E362 VanDerWaalsContact OG1-CG 3.22Å; T359-E362 WeakPolarHBondContact OG1-CG 3.49Å; T359-E362 PolarHBondContact OG1-N 3.22Å; T359-E362 PolarHBondContact OG1-OE2 3.13Å; E362-V364 VanDerWaalsContact C-N 3.32Å; E362-V364 PolarHBondContact O-N 3.29Å; E362-A365 PolarHBondContact O-N 3.38Å; E362-I366 WeakPolarHBondContact O-CB 3.09Å; E362-I366 VanDerWaalsContact O-CG1 3.27Å; E362-I366 WeakPolarHBondContact O-CG1 3.39Å; E362-I366 PolarHBondContact O-N 2.93Å
363	K	77.8	Confident	78.6	Confident	113 Å²	113	94.2 Å²	94.2	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-42.9	174.2	-68.5	-176.9	-179.3	179.5	0	111.6	F358 T359 F360 G367	F358-K363 HydrophobicContact CB-CD 4.48Å; F358-K363 HydrophobicContact CB-CG 3.58Å; F358-K363 WeakPolarHBondContact O-CE 3.02Å; T359-K363 PolarHBondContact O-N 2.92Å; F360-K363 PolarHBondContact O-N 2.8Å; K363-G367 PolarHBondContact O-N 3.49Å
364	V	83.7	Confident	80.2	Confident	80 Å²	80	92.9 Å²	92.9	49%	0.485	52%	0.52	S	S	.	.	H	α-helix	trans	-66.4	-39.4	176.4	173	0	0	0	0	111	F360 G361 E362 G367 S368	F360-V364 HydrophobicContact CD1-CG2 4.06Å; F360-V364 HydrophobicContact CE1-CG2 3.73Å; F360-V364 HydrophobicContact CZ-CG2 4.07Å; F360-V364 VanDerWaalsContact O-CG2 3.3Å; F360-V364 WeakPolarHBondContact O-CG2 3.28Å; F360-V364 PolarHBondContact O-N 3.25Å; G361-V364 PolarHBondContact O-N 2.89Å; E362-V364 VanDerWaalsContact C-N 3.32Å; E362-V364 PolarHBondContact O-N 3.29Å; V364-G367 PolarHBondContact O-N 2.04Å; V364-S368 VanDerWaalsContact O-CB 3.29Å; V364-S368 WeakPolarHBondContact O-CB 3.43Å; V364-S368 PolarHBondContact O-N 2.67Å; V364-S368 PolarHBondContact O-OG 2.87Å; V364-S368 VanDerWaalsContact O-OG 3.09Å
365	A	86.7	Confident	82	Confident	52 Å²	52	91.7 Å²	91.7	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-67.3	-41.4	177.2	0	0	0	0	0	112.8	G361 E362 S368 S369	G361-A365 WeakPolarHBondContact O-CB 3.48Å; G361-A365 PolarHBondContact O-N 2.81Å; E362-A365 PolarHBondContact O-N 3.38Å; A365-S368 PolarHBondContact O-OG 3.36Å; A365-S368 VanDerWaalsContact O-OG 3.09Å; A365-S369 VanDerWaalsContact O-CB 3.25Å; A365-S369 WeakPolarHBondContact O-CB 3.36Å; A365-S369 PolarHBondContact O-N 2.8Å; A365-S369 PolarHBondContact O-OG 3.29Å
366	I	87.6	Confident	83.7	Confident	84 Å²	84	93.6 Å²	93.6	43%	0.431	52%	0.517	S	S	.	.	H	α-helix	trans	-67	-43	174.9	-66.6	166.5	0	0	0	109.9	F358 E362 S369 A370	F358-I366 HydrophobicContact CD1-CD1 3.65Å; F358-I366 HydrophobicContact CE1-CD1 3.54Å; F358-I366 HydrophobicContact CE2-CD1 4.43Å; F358-I366 HydrophobicContact CG-CD1 4.15Å; F358-I366 HydrophobicContact CZ-CD1 3.95Å; E362-I366 WeakPolarHBondContact O-CB 3.09Å; E362-I366 VanDerWaalsContact O-CG1 3.27Å; E362-I366 WeakPolarHBondContact O-CG1 3.39Å; E362-I366 PolarHBondContact O-N 2.93Å; I366-S369 WeakPolarHBondContact CA-OG 3.43Å; I366-S369 PolarHBondContact O-OG 3.27Å; I366-A370 VanDerWaalsContact O-CB 3.31Å; I366-A370 WeakPolarHBondContact O-CB 3.38Å; I366-A370 PolarHBondContact O-N 2.84Å
367	G	90	Very high	85.6	Confident	43 Å²	43	92.8 Å²	92.8	44%	0.443	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-44.6	176	0	0	0	0	0	112.9	K363 V364 A371	K363-G367 PolarHBondContact O-N 3.49Å; V364-G367 PolarHBondContact O-N 2.04Å; G367-A371 PolarHBondContact O-N 3.1Å; G367-A371 VanDerWaalsContact O-N 3.11Å
368	S	91.7	Very high	87.3	Confident	58 Å²	58	87.5 Å²	87.5	41%	0.406	50%	0.495	S	S	.	.	H	α-helix	trans	-71.2	-40.2	-179.8	67.7	0	0	0	0	112.5	V364 A365 A371 L372	V364-S368 VanDerWaalsContact O-CB 3.29Å; V364-S368 WeakPolarHBondContact O-CB 3.43Å; V364-S368 PolarHBondContact O-N 2.67Å; V364-S368 PolarHBondContact O-OG 2.87Å; V364-S368 VanDerWaalsContact O-OG 3.09Å; A365-S368 PolarHBondContact O-OG 3.36Å; A365-S368 VanDerWaalsContact O-OG 3.09Å; S368-A371 PolarHBondContact O-N 2.8Å; S368-L372 WeakPolarHBondContact O-CB 3.38Å; S368-L372 WeakPolarHBondContact O-CG 3.39Å; S368-L372 PolarHBondContact O-N 3.48Å
369	S	93.8	Very high	88.8	Confident	64 Å²	64	87 Å²	87	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176	57.9	0	0	0	0	112.1	A365 I366 L372 F373	A365-S369 VanDerWaalsContact O-CB 3.25Å; A365-S369 WeakPolarHBondContact O-CB 3.36Å; A365-S369 PolarHBondContact O-N 2.8Å; A365-S369 PolarHBondContact O-OG 3.29Å; I366-S369 WeakPolarHBondContact CA-OG 3.43Å; I366-S369 PolarHBondContact O-OG 3.27Å; S369-L372 PolarHBondContact O-N 2.89Å; S369-F373 VanDerWaalsContact O-CB 3.32Å; S369-F373 WeakPolarHBondContact O-CB 3.49Å; S369-F373 PolarHBondContact O-N 3.3Å
370	A	95.3	Very high	90.1	Very high	42 Å²	42	89.8 Å²	89.8	35%	0.347	50%	0.501	S	S	.	.	H	α-helix	trans	-61.6	-47.6	173.9	0	0	0	0	0	111.5	I366 L372 F373 F374	I366-A370 VanDerWaalsContact O-CB 3.31Å; I366-A370 WeakPolarHBondContact O-CB 3.38Å; I366-A370 PolarHBondContact O-N 2.84Å; A370-L372 PolarHBondContact O-N 2.89Å; A370-F373 WeakPolarHBondContact O-CB 3.34Å; A370-F373 PolarHBondContact O-N 2.63Å; A370-F374 WeakPolarHBondContact O-CD2 3.11Å; A370-F374 PolarHBondContact O-N 3.46Å
371	A	94.4	Very high	91.3	Very high	55 Å²	55	85.4 Å²	85.4	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-44.5	177.9	0	0	0	0	0	112.3	G367 S368 F373 F374 V375	G367-A371 PolarHBondContact O-N 3.1Å; G367-A371 VanDerWaalsContact O-N 3.11Å; S368-A371 PolarHBondContact O-N 2.8Å; A371-F373 VanDerWaalsContact C-N 3.35Å; A371-F373 PolarHBondContact O-N 3.29Å; A371-F374 PolarHBondContact O-N 2.85Å; A371-V375 WeakPolarHBondContact O-CG2 3.17Å; A371-V375 PolarHBondContact O-N 2.88Å
372	L	95.9	Very high	92.5	Very high	111 Å²	111	89.5 Å²	89.5	58%	0.581	49%	0.492	S	S	*	.	H	α-helix	trans	-61.9	-41.9	175.1	-76.9	169.8	0	0	0	111.9	S368 S369 A370 F374 V375 L376	S368-L372 WeakPolarHBondContact O-CB 3.38Å; S368-L372 WeakPolarHBondContact O-CG 3.39Å; S368-L372 PolarHBondContact O-N 3.48Å; S369-L372 PolarHBondContact O-N 2.89Å; A370-L372 PolarHBondContact O-N 2.89Å; L372-F374 VanDerWaalsContact C-N 3.34Å; L372-F374 PolarHBondContact O-N 2.95Å; L372-V375 PolarHBondContact O-N 2.8Å; L372-L376 WeakPolarHBondContact O-CB 3.48Å; L372-L376 VanDerWaalsContact O-CG 3.28Å; L372-L376 WeakPolarHBondContact O-CG 3.46Å; L372-L376 PolarHBondContact O-N 3.45Å
373	F	96.6	Very high	93.4	Very high	144 Å²	144	88.6 Å²	88.6	63%	0.632	49%	0.49	S	S	*	.	H	α-helix	trans	-61.8	-41	176.9	-172.7	-94.1	0	0	0	112	S369 A370 A371 S377	S369-F373 VanDerWaalsContact O-CB 3.32Å; S369-F373 WeakPolarHBondContact O-CB 3.49Å; S369-F373 PolarHBondContact O-N 3.3Å; A370-F373 WeakPolarHBondContact O-CB 3.34Å; A370-F373 PolarHBondContact O-N 2.63Å; A371-F373 VanDerWaalsContact C-N 3.35Å; A371-F373 PolarHBondContact O-N 3.29Å; F373-S377 VanDerWaalsContact O-CB 3.29Å; F373-S377 WeakPolarHBondContact O-CB 3.39Å; F373-S377 PolarHBondContact O-N 3.23Å; F373-S377 PolarHBondContact O-OG 2.86Å
374	F	96.7	Very high	94.2	Very high	141 Å²	141	85.5 Å²	85.5	62%	0.618	48%	0.481	S	S	*	.	H	α-helix	trans	-64	-44.9	174.2	-82.5	-68.9	0	0	0	112.3	A370 A371 L372 S377 I378	A370-F374 WeakPolarHBondContact O-CD2 3.11Å; A370-F374 PolarHBondContact O-N 3.46Å; A371-F374 PolarHBondContact O-N 2.85Å; L372-F374 VanDerWaalsContact C-N 3.34Å; L372-F374 PolarHBondContact O-N 2.95Å; F374-S377 PolarHBondContact O-N 2.83Å; F374-I378 WeakPolarHBondContact O-CG1 3.24Å; F374-I378 PolarHBondContact O-N 3.15Å
375	V	96.8	Very high	94.7	Very high	81 Å²	81	89.3 Å²	89.3	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-61.6	-46	177.4	171.8	0	0	0	0	111.1	A371 L372 S377 I378 L379	A371-V375 WeakPolarHBondContact O-CG2 3.17Å; A371-V375 PolarHBondContact O-N 2.88Å; L372-V375 PolarHBondContact O-N 2.8Å; V375-S377 VanDerWaalsContact C-N 3.33Å; V375-S377 PolarHBondContact O-N 3.49Å; V375-I378 PolarHBondContact O-N 2.85Å; V375-L379 HydrophobicContact CG1-CD1 4.09Å; V375-L379 WeakPolarHBondContact O-CB 3.31Å; V375-L379 PolarHBondContact O-N 2.91Å
376	L	96.8	Very high	95	Very high	111 Å²	111	91.6 Å²	91.6	58%	0.581	49%	0.488	S	S	*	.	H	α-helix	trans	-63.2	-39.1	176.9	-71.1	173.4	0	0	0	112	L372 L379 F380	L372-L376 WeakPolarHBondContact O-CB 3.48Å; L372-L376 VanDerWaalsContact O-CG 3.28Å; L372-L376 WeakPolarHBondContact O-CG 3.46Å; L372-L376 PolarHBondContact O-N 3.45Å; L376-L379 PolarHBondContact O-N 2.88Å; L376-F380 WeakPolarHBondContact O-CB 2.99Å; L376-F380 PolarHBondContact O-N 3.4Å
377	S	97.3	Very high	95.1	Very high	45 Å²	45	96.3 Å²	96.3	32%	0.315	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-42	175.9	-63.1	0	0	0	0	111.9	F373 F374 V375 F380 C381	F373-S377 VanDerWaalsContact O-CB 3.29Å; F373-S377 WeakPolarHBondContact O-CB 3.39Å; F373-S377 PolarHBondContact O-N 3.23Å; F373-S377 PolarHBondContact O-OG 2.86Å; F374-S377 PolarHBondContact O-N 2.83Å; V375-S377 VanDerWaalsContact C-N 3.33Å; V375-S377 PolarHBondContact O-N 3.49Å; S377-F380 PolarHBondContact O-N 2.8Å; S377-C381 WeakPolarHBondContact O-CB 3.13Å; S377-C381 PolarHBondContact O-N 3.02Å; S377-C381 PolarHBondContact O-SG 2.05Å; S377-C381 VanDerWaalsContact O-SG 3.34Å
378	I	97	Very high	95.2	Very high	119 Å²	119	103 Å²	103	61%	0.61	51%	0.512	S	S	*	.	H	α-helix	trans	-65.9	-43.8	175.5	-67.7	168.1	0	0	0	110.7	F374 V375 F380 C381 Y382	F374-I378 WeakPolarHBondContact O-CG1 3.24Å; F374-I378 PolarHBondContact O-N 3.15Å; V375-I378 PolarHBondContact O-N 2.85Å; I378-F380 VanDerWaalsContact C-N 3.34Å; I378-F380 PolarHBondContact O-N 2.88Å; I378-C381 WeakPolarHBondContact O-CB 3.4Å; I378-C381 PolarHBondContact O-N 2.82Å; I378-Y382 WeakPolarHBondContact O-CB 3.49Å; I378-Y382 PolarHBondContact O-N 3.31Å
379	L	97	Very high	95	Very high	87 Å²	87	107.8 Å²	107.8	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-59.7	-44	175.4	-107.4	148.2	0	0	0	111.6	V375 L376 Y382 I383	V375-L379 HydrophobicContact CG1-CD1 4.09Å; V375-L379 WeakPolarHBondContact O-CB 3.31Å; V375-L379 PolarHBondContact O-N 2.91Å; L376-L379 PolarHBondContact O-N 2.88Å; L379-Y382 WeakPolarHBondContact O-CB 3.29Å; L379-Y382 PolarHBondContact O-N 3.47Å; L379-I383 HydrophobicContact CD2-CD1 4.26Å; L379-I383 WeakPolarHBondContact O-CB 3.34Å; L379-I383 VanDerWaalsContact O-CG1 3.27Å; L379-I383 WeakPolarHBondContact O-CG1 3.08Å; L379-I383 PolarHBondContact O-N 2.94Å
380	F	97	Very high	94.6	Very high	143 Å²	143	107.6 Å²	107.6	63%	0.627	52%	0.524	S	S	*	.	H	α-helix	trans	-63.8	-44.2	176.3	-171.9	-98.1	0	0	0	111.7	L376 S377 I378 Y382 I383 T384	L376-F380 WeakPolarHBondContact O-CB 2.99Å; L376-F380 PolarHBondContact O-N 3.4Å; S377-F380 PolarHBondContact O-N 2.8Å; I378-F380 VanDerWaalsContact C-N 3.34Å; I378-F380 PolarHBondContact O-N 2.88Å; F380-Y382 VanDerWaalsContact C-N 3.3Å; F380-Y382 PolarHBondContact O-N 2.9Å; F380-I383 PolarHBondContact O-N 2.87Å; F380-T384 HydrophobicContact CD1-CG2 4.1Å; F380-T384 HydrophobicContact CE1-CG2 3.77Å; F380-T384 HydrophobicContact CE2-CG2 4.41Å; F380-T384 HydrophobicContact CZ-CG2 3.94Å; F380-T384 WeakPolarHBondContact O-CB 3.48Å; F380-T384 VanDerWaalsContact O-CG2 3.26Å; F380-T384 WeakPolarHBondContact O-CG2 3.36Å; F380-T384 PolarHBondContact O-N 2.91Å; F380-T384 PolarHBondContact O-OG1 3.28Å
381	C	96.9	Very high	94.2	Very high	80 Å²	80	112.8 Å²	112.8	54%	0.541	54%	0.538	S	S	.	.	H	α-helix	trans	-59.2	-39.9	171.9	-76.8	0	0	0	0	112.2	S377 I378 T384 R385	S377-C381 WeakPolarHBondContact O-CB 3.13Å; S377-C381 PolarHBondContact O-N 3.02Å; S377-C381 PolarHBondContact O-SG 2.05Å; S377-C381 VanDerWaalsContact O-SG 3.34Å; I378-C381 WeakPolarHBondContact O-CB 3.4Å; I378-C381 PolarHBondContact O-N 2.82Å; C381-T384 WeakPolarHBondContact CA-OG1 3.3Å; C381-T384 PolarHBondContact O-OG1 3.15Å; C381-R385 VanDerWaalsContact O-CB 3.24Å; C381-R385 WeakPolarHBondContact O-CB 3.43Å; C381-R385 PolarHBondContact O-N 2.86Å
382	Y	96.7	Very high	93.6	Very high	135 Å²	135	118.9 Å²	118.9	53%	0.529	55%	0.55	S	S	.	.	H	α-helix	trans	-66.8	-48.6	177.7	-178.3	-101.9	0	0	0	112.1	I378 L379 F380 T384 R385 Q386	I378-Y382 WeakPolarHBondContact O-CB 3.49Å; I378-Y382 PolarHBondContact O-N 3.31Å; L379-Y382 WeakPolarHBondContact O-CB 3.29Å; L379-Y382 PolarHBondContact O-N 3.47Å; F380-Y382 VanDerWaalsContact C-N 3.3Å; F380-Y382 PolarHBondContact O-N 2.9Å; Y382-T384 PolarHBondContact O-N 3.35Å; Y382-R385 PolarHBondContact O-N 3.23Å; Y382-Q386 HydrophobicContact CD1-CG 4.35Å; Y382-Q386 VanDerWaalsContact CE1-CD 3.45Å; Y382-Q386 HydrophobicContact CE1-CG 3.96Å; Y382-Q386 VanDerWaalsContact CE1-NE2 3.25Å; Y382-Q386 HydrophobicContact CE2-CG 4.46Å; Y382-Q386 PolarHBondContact O-N 2.79Å; Y382-Q386 PolarHBondContact OH-NE2 3.38Å
383	I	95.7	Very high	92.9	Very high	73 Å²	73	120.1 Å²	120.1	37%	0.374	55%	0.55	S	S	.	*	H	α-helix	trans	-62.7	-44.1	178.9	-68.4	166.2	0	0	0	110.6	L379 F380 R385 Q386 R387	L379-I383 HydrophobicContact CD2-CD1 4.26Å; L379-I383 WeakPolarHBondContact O-CB 3.34Å; L379-I383 VanDerWaalsContact O-CG1 3.27Å; L379-I383 WeakPolarHBondContact O-CG1 3.08Å; L379-I383 PolarHBondContact O-N 2.94Å; F380-I383 PolarHBondContact O-N 2.87Å; I383-R385 VanDerWaalsContact C-N 3.34Å; I383-R385 PolarHBondContact O-N 3.22Å; I383-Q386 PolarHBondContact O-N 2.94Å; I383-R387 WeakPolarHBondContact O-CB 3.26Å; I383-R387 WeakPolarHBondContact O-CG 3.46Å; I383-R387 PolarHBondContact O-N 2.88Å
384	T	94.9	Very high	92	Very high	48 Å²	48	117.2 Å²	117.2	29%	0.294	55%	0.553	S	S	.	*	H	α-helix	trans	-64.7	-38.3	176.9	53.5	0	0	0	0	111.8	F380 C381 Y382 R387 R388	F380-T384 HydrophobicContact CD1-CG2 4.1Å; F380-T384 HydrophobicContact CE1-CG2 3.77Å; F380-T384 HydrophobicContact CE2-CG2 4.41Å; F380-T384 HydrophobicContact CZ-CG2 3.94Å; F380-T384 WeakPolarHBondContact O-CB 3.48Å; F380-T384 VanDerWaalsContact O-CG2 3.26Å; F380-T384 WeakPolarHBondContact O-CG2 3.36Å; F380-T384 PolarHBondContact O-N 2.91Å; F380-T384 PolarHBondContact O-OG1 3.28Å; C381-T384 WeakPolarHBondContact CA-OG1 3.3Å; C381-T384 PolarHBondContact O-OG1 3.15Å; Y382-T384 PolarHBondContact O-N 3.35Å; T384-R387 PolarHBondContact O-N 3.06Å; T384-R388 WeakPolarHBondContact O-CG 3.48Å; T384-R388 PolarHBondContact O-N 3.41Å
385	R	93.7	Very high	91.1	Very high	160 Å²	160	117.1 Å²	117.1	60%	0.604	56%	0.559	S	S	*	*	H	α-helix	trans	-66	-42.1	173.7	-169.4	176.6	-173.9	176.2	1.9	112.2	C381 Y382 I383 R388 R389	C381-R385 VanDerWaalsContact O-CB 3.24Å; C381-R385 WeakPolarHBondContact O-CB 3.43Å; C381-R385 PolarHBondContact O-N 2.86Å; Y382-R385 PolarHBondContact O-N 3.23Å; I383-R385 VanDerWaalsContact C-N 3.34Å; I383-R385 PolarHBondContact O-N 3.22Å; R385-R388 PolarHBondContact O-N 3.21Å; R385-R389 PolarHBondContact O-N 3.03Å
386	Q	92.4	Very high	89.9	Confident	100 Å²	100	116.7 Å²	116.7	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-61.5	-46.3	174	-80.4	-162.8	-21.1	0	0	111.5	Y382 I383 R388 R389 A390	Y382-Q386 HydrophobicContact CD1-CG 4.35Å; Y382-Q386 VanDerWaalsContact CE1-CD 3.45Å; Y382-Q386 HydrophobicContact CE1-CG 3.96Å; Y382-Q386 VanDerWaalsContact CE1-NE2 3.25Å; Y382-Q386 HydrophobicContact CE2-CG 4.46Å; Y382-Q386 PolarHBondContact O-N 2.79Å; Y382-Q386 PolarHBondContact OH-NE2 3.38Å; I383-Q386 PolarHBondContact O-N 2.94Å; Q386-R388 VanDerWaalsContact C-N 3.31Å; Q386-R388 PolarHBondContact O-N 3.31Å; Q386-R389 PolarHBondContact O-N 3.37Å; Q386-R389 VanDerWaalsContact O-N 3.1Å; Q386-A390 PolarHBondContact O-N 3.18Å
387	R	91.4	Very high	88.7	Confident	182 Å²	182	114.6 Å²	114.6	69%	0.687	55%	0.547	S	S	*	.	H	α-helix	trans	-58	-42.1	175.3	-78.5	-175.9	175	-177	-0.6	112.2	I383 T384 A390 K391	I383-R387 WeakPolarHBondContact O-CB 3.26Å; I383-R387 WeakPolarHBondContact O-CG 3.46Å; I383-R387 PolarHBondContact O-N 2.88Å; T384-R387 PolarHBondContact O-N 3.06Å; R387-A390 PolarHBondContact O-N 3.38Å; R387-K391 PolarHBondContact O-N 3.14Å
388	R	90.3	Very high	87.3	Confident	184 Å²	184	118.2 Å²	118.2	69%	0.694	57%	0.569	S	S	*	*	H	α-helix	trans	-63.1	-39.9	175.2	-73.8	178.7	-175.3	-178.6	2.9	112.2	T384 R385 Q386 R392	T384-R388 WeakPolarHBondContact O-CG 3.48Å; T384-R388 PolarHBondContact O-N 3.41Å; R385-R388 PolarHBondContact O-N 3.21Å; Q386-R388 VanDerWaalsContact C-N 3.31Å; Q386-R388 PolarHBondContact O-N 3.31Å; R388-R392 WeakPolarHBondContact O-CG 3.29Å; R388-R392 PolarHBondContact O-N 2.86Å
389	R	88.1	Confident	85.7	Confident	158 Å²	158	115.6 Å²	115.6	60%	0.596	57%	0.572	S	S	*	*	H	α-helix	trans	-66.9	-41.6	175.4	-75.3	-177.6	171.6	179.6	-3.2	112.3	R385 Q386 R392 K393	R385-R389 PolarHBondContact O-N 3.03Å; Q386-R389 PolarHBondContact O-N 3.37Å; Q386-R389 VanDerWaalsContact O-N 3.1Å; R389-R392 PolarHBondContact O-N 2.93Å; R389-K393 PolarHBondContact O-N 2.77Å; R389-K393 VanDerWaalsContact O-N 3.11Å
390	A	86.1	Confident	84.1	Confident	60 Å²	60	116.8 Å²	116.8	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-62.7	-42.9	177.2	0	0	0	0	0	111.9	Q386 R387 R392 K393 A394	Q386-A390 PolarHBondContact O-N 3.18Å; R387-A390 PolarHBondContact O-N 3.38Å; A390-R392 PolarHBondContact O-N 2.71Å; A390-K393 PolarHBondContact O-N 2.8Å; A390-A394 PolarHBondContact O-N 2.9Å
391	K	85.9	Confident	82.1	Confident	151 Å²	151	115 Å²	115	66%	0.657	57%	0.569	S	S	*	*	H	α-helix	trans	-58.7	-46.2	173.5	-75.8	-170.7	175.5	-166.9	0	112.2	R387 K393 A394 D395	R387-K391 PolarHBondContact O-N 3.14Å; K391-K393 VanDerWaalsContact C-N 3.26Å; K391-K393 PolarHBondContact O-N 2.87Å; K391-A394 PolarHBondContact O-N 2.72Å; K391-A394 VanDerWaalsContact O-N 3.08Å; K391-D395 PolarHBondContact O-N 2.81Å
392	R	83.3	Confident	80.4	Confident	184 Å²	184	118.3 Å²	118.3	69%	0.694	58%	0.576	S	S	*	*	H	α-helix	trans	-59.8	-34.5	176.6	-72	-177.8	-175.5	-170.5	-0.8	113.2	R388 R389 A390 M396	R388-R392 WeakPolarHBondContact O-CG 3.29Å; R388-R392 PolarHBondContact O-N 2.86Å; R389-R392 PolarHBondContact O-N 2.93Å; A390-R392 PolarHBondContact O-N 2.71Å; R392-M396 VanDerWaalsContact O-CG 3.27Å; R392-M396 WeakPolarHBondContact O-CG 3.36Å; R392-M396 PolarHBondContact O-N 2.82Å
393	K	79.9	Confident	78.7	Confident	136 Å²	136	118.1 Å²	118.1	59%	0.591	58%	0.58	S	S	*	*	H	α-helix	trans	-73.4	-32.9	175.3	-70.8	-171	175.4	-165.6	0	112.7	R389 A390 K391 M396	R389-K393 PolarHBondContact O-N 2.77Å; R389-K393 VanDerWaalsContact O-N 3.11Å; A390-K393 PolarHBondContact O-N 2.8Å; K391-K393 VanDerWaalsContact C-N 3.26Å; K391-K393 PolarHBondContact O-N 2.87Å; K393-M396 PolarHBondContact O-N 3.08Å
394	A	78.4	Confident	77	Confident	83 Å²	83	118.7 Å²	118.7	69%	0.686	58%	0.583	S	S	*	*	H	α-helix	trans	-72.8	-30.6	176.4	0	0	0	0	0	112.7	A390 K391 M396	A390-A394 PolarHBondContact O-N 2.9Å; K391-A394 PolarHBondContact O-N 2.72Å; K391-A394 VanDerWaalsContact O-N 3.08Å; A394-M396 VanDerWaalsContact C-N 3.32Å
395	D	78.6	Confident	75.3	Confident	140 Å²	140	123.8 Å²	123.8	75%	0.749	60%	0.603	S	S	*	*	S	Bend	trans	-81.4	-12	175.8	-64.1	-26.6	0	0	0	112.8	K391	K391-D395 PolarHBondContact O-N 2.81Å
396	M	70.7	Confident	73.6	Confident	71 Å²	71	123.5 Å²	123.5	35%	0.35	61%	0.613	S	S	.	*	S	Bend	trans	-76	127.5	173.9	-80.2	168.2	172.9	0	0	109.4	R392 K393 A394 I404	R392-M396 VanDerWaalsContact O-CG 3.27Å; R392-M396 WeakPolarHBondContact O-CG 3.36Å; R392-M396 PolarHBondContact O-N 2.82Å; K393-M396 PolarHBondContact O-N 3.08Å; A394-M396 VanDerWaalsContact C-N 3.32Å; M396-I404 HydrophobicContact CE-CD1 4.24Å; M396-I404 HydrophobicContact SD-CD1 4.31Å
397	S	70.9	Confident	71.8	Confident	67 Å²	67	126.2 Å²	126.2	47%	0.469	63%	0.628	S	S	.	*			trans	-61	148.4	178	60.1	0	0	0	0	110.6	G399 Q400	S397-G399 PolarHBondContact O-N 2.81Å; S397-Q400 PolarHBondContact O-N 2.82Å
398	P	67.6	Low	69.7	Low	121 Å²	121	127.2 Å²	127.2	79%	0.786	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	-21	-174.9	-25.6	31.8	0	0	0	114.8
399	G	65.2	Low	68.7	Low	65 Å²	65	124.4 Å²	124.4	67%	0.67	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-22.8	179.5	0	0	0	0	0	115.8	S397	S397-G399 PolarHBondContact O-N 2.81Å
400	Q	62.1	Low	67.6	Low	112 Å²	112	122.6 Å²	122.6	52%	0.523	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.9	-8.7	-177.9	-74.5	-162.4	-42	0	0	113.9	S397 H402	S397-Q400 PolarHBondContact O-N 2.82Å; Q400-H402 PolarHBondContact O-N 3.16Å
401	Q	56.2	Low	66.6	Low	106 Å²	106	126.1 Å²	126.1	50%	0.495	65%	0.654	S	S	.	*	H	α-helix	trans	-71.7	-29.4	-176.5	-126.7	172.2	-22.6	0	0	113
402	H	59.7	Low	65.5	Low	148 Å²	148	124.6 Å²	124.6	69%	0.685	65%	0.654	S	S	*	*	H	α-helix	trans	-72.5	-26.7	180	-97.1	30.7	0	0	0	114.2	Q400	Q400-H402 PolarHBondContact O-N 3.16Å
403	E	60.9	Low	64.4	Low	132 Å²	132	120.9 Å²	120.9	62%	0.617	65%	0.651	S	S	*	*	H	α-helix	trans	-78.8	-27.2	-176.1	-154.2	172.8	-164.4	0	0	112.4
404	I	60.4	Low	63.3	Low	84 Å²	84	119.9 Å²	119.9	43%	0.431	66%	0.655	S	S	.	*	H	α-helix	trans	-82.4	-29	-179.9	-61.7	175.8	0	0	0	112	M396 L406 M407 L408	M396-I404 HydrophobicContact CE-CD1 4.24Å; M396-I404 HydrophobicContact SD-CD1 4.31Å; I404-L406 PolarHBondContact O-N 3.22Å; I404-M407 PolarHBondContact O-N 3.31Å; I404-L408 HydrophobicContact CG2-CD1 4.12Å
405	E	58.6	Low	62.3	Low	155 Å²	155	122.6 Å²	122.6	72%	0.724	65%	0.653	S	S	*	*	H	α-helix	trans	-73.8	-16.1	179.2	-146.7	167.7	-144.3	0	0	112.8
406	L	58.9	Low	61	Low	154 Å²	154	121.2 Å²	121.2	81%	0.806	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-8.3	172.6	-99.8	140.4	0	0	0	114	I404	I404-L406 PolarHBondContact O-N 3.22Å
407	M	54.6	Low	60.2	Low	157 Å²	157	125.4 Å²	125.4	77%	0.773	67%	0.671	S	S	*	*			trans	-110.4	-3	-179.2	-67.7	-163.2	-170.2	0	0	114.7	I404	I404-M407 PolarHBondContact O-N 3.31Å
408	L	47.2	Very low	59.2	Low	204 Å²	204	130.7 Å²	130.7	100%	1.068	69%	0.689	S	S	*	*			trans	-108.8	0	173.5	-102.8	136.2	0	0	0	109.4	I404	I404-L408 HydrophobicContact CG2-CD1 4.12Å

Retrieved 408 of 408 residues in 381.3 ms (Link to these results)

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