A0A087YLM2_POEFO Loading...

DNA-directed DNA/RNA polymerase mu

Gap-filling polymerase involved in repair of DNA double-strand breaks by non-homologous end joining (NHEJ).

AlphaFold DB , UniProt , Accession A0A087YLM2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 439 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	38	Very low	29.7	Very low	247 Å²	247	182.7 Å²	182.7	100%	1.217	91%	0.912	S	S	*	*				0	105	0	-116.8	-179.1	-179.8	0	0	108
2	V	26.1	Very low	29.6	Very low	144 Å²	144	176.8 Å²	176.8	87%	0.873	90%	0.902	S	S	*	*			trans	-134.2	127.8	169.6	176.1	0	0	0	0	106.4
3	P	30	Very low	29.4	Very low	124 Å²	124	168.8 Å²	168.8	81%	0.805	89%	0.889	S	S	*	*			trans	-93.2	149.6	-160	-3	24.2	0	0	0	114.4
4	L	30.1	Very low	29.3	Very low	177 Å²	177	167.1 Å²	167.1	93%	0.927	89%	0.89	S	S	*	*			trans	-65.4	128.8	177.6	-69.9	147	0	0	0	112.5
5	K	29.8	Very low	29.6	Very low	212 Å²	212	166.9 Å²	166.9	92%	0.922	89%	0.887	S	S	*	*			trans	-87.7	108.3	168.7	-103.3	178.6	177.1	174.6	0	110.6
6	R	31.2	Very low	29.5	Very low	253 Å²	253	166.9 Å²	166.9	96%	0.955	89%	0.888	S	S	*	*			trans	-62.5	138	160	-90.7	175.7	165.1	172.6	-4.6	110.1
7	R	29.6	Very low	29.5	Very low	252 Å²	252	163.4 Å²	163.4	95%	0.951	89%	0.887	S	S	*	*			trans	-121.8	124.1	167.2	-148.9	174.3	-174	174	0.4	111.7
8	K	28.5	Very low	29.2	Very low	206 Å²	206	157.9 Å²	157.9	90%	0.896	88%	0.876	S	S	*	*			trans	-17	140.7	165.6	-127	168.5	177.2	180	0	119.4
9	V	29.4	Very low	29.1	Very low	139 Å²	139	157.1 Å²	157.1	84%	0.842	88%	0.876	S	S	*	*			trans	-80.4	140.1	164.4	177.2	0	0	0	0	110.6
10	A	27.4	Very low	29.2	Very low	96 Å²	96	158.5 Å²	158.5	79%	0.793	87%	0.874	S	S	*	*			trans	-157.3	117.7	151	0	0	0	0	0	110.5
11	N	26	Very low	29.3	Very low	160 Å²	160	159.2 Å²	159.2	86%	0.856	88%	0.877	S	S	*	*			trans	-72.4	158.4	154.4	-96.4	-4.8	0	0	0	107.8
12	S	29.6	Very low	29.1	Very low	112 Å²	112	152.2 Å²	152.2	78%	0.783	85%	0.852	S	S	*	*			cis	-173.4	147	38.2	44.6	0	0	0	0	110.5
13	G	27	Very low	29.6	Very low	72 Å²	72	150 Å²	150	74%	0.742	85%	0.85	S	S	*	*			trans	63.9	126.8	154.2	0	0	0	0	0	117.1
14	T	27.2	Very low	29.9	Very low	146 Å²	146	148.1 Å²	148.1	90%	0.896	85%	0.845	S	S	*	*				-162.1	161.7	55	17.1	0	0	0	0	111.1
15	L	34	Very low	30.7	Very low	163 Å²	163	146.4 Å²	146.4	85%	0.853	84%	0.841	S	S	*	*			trans	-46.5	135.1	-177.4	-65	140.2	0	0	0	115.7
16	N	28.1	Very low	31.9	Very low	168 Å²	168	141.5 Å²	141.5	90%	0.898	82%	0.822	S	S	*	*				-166.4	142.7	124.3	-98.5	-19.5	0	0	0	112.2
17	A	28.5	Very low	33.4	Very low	106 Å²	106	134.2 Å²	134.2	88%	0.876	81%	0.807	S	S	*	*			trans	-74.4	155	-166	0	0	0	0	0	114.6
18	G	25.5	Very low	35.6	Very low	66 Å²	66	125 Å²	125	68%	0.68	78%	0.777	S	S	*	*			trans	157.7	83.2	163.5	0	0	0	0	0	116.3
19	T	27.2	Very low	38.3	Very low	142 Å²	142	120.8 Å²	120.8	87%	0.871	76%	0.759	S	S	*	*			trans	63.1	85.8	149.5	46.3	0	0	0	0	119.5
20	H	30.3	Very low	41.1	Very low	184 Å²	184	115.7 Å²	115.7	85%	0.852	73%	0.725	S	S	*	*			trans	-85.3	122.7	147.5	-87.7	-79	0	0	0	109.6	S22	H20-S22 PolarHBondContact O-N 3.21Å
21	N	32	Very low	43.7	Very low	174 Å²	174	115.1 Å²	115.1	93%	0.93	71%	0.714	S	S	*	*			trans	-69.9	83.8	163	-99.6	-13.9	0	0	0	108.9	A23	N21-A23 PolarHBondContact O-N 3.45Å
22	S	32.5	Very low	46.6	Very low	100 Å²	100	113.6 Å²	113.6	70%	0.699	70%	0.701	S	S	*	*			trans	-72.2	118.5	161.6	-69.2	0	0	0	0	108.1	H20 A24	H20-S22 PolarHBondContact O-N 3.21Å; S22-A24 VanDerWaalsContact C-N 3.31Å; S22-A24 PolarHBondContact O-N 2.81Å
23	A	37.7	Very low	49.5	Very low	99 Å²	99	108.7 Å²	108.7	82%	0.818	67%	0.667	S	S	*	*			trans	-60	100	163.9	0	0	0	0	0	107.5	N21 T25	N21-A23 PolarHBondContact O-N 3.45Å; A23-T25 PolarHBondContact O-N 3.23Å
24	A	36.1	Very low	52.6	Low	84 Å²	84	106.2 Å²	106.2	69%	0.694	64%	0.636	S	S	*	*			trans	-60.6	110.3	-178.8	0	0	0	0	0	109.6	S22 Q26	S22-A24 VanDerWaalsContact C-N 3.31Å; S22-A24 PolarHBondContact O-N 2.81Å; A24-Q26 PolarHBondContact O-N 3.04Å
25	T	46.8	Very low	55.7	Low	140 Å²	140	99.3 Å²	99.3	86%	0.859	59%	0.594	S	S	*	*			trans	-61.2	104	159.1	-16	0	0	0	0	106.2	A23	A23-T25 PolarHBondContact O-N 3.23Å
26	Q	55.4	Low	58.6	Low	109 Å²	109	92 Å²	92	51%	0.509	56%	0.555	S	S	.	*			trans	-52.3	136.9	172.8	-75.9	-90.7	-28.9	0	0	108.8	A24 N28	A24-Q26 PolarHBondContact O-N 3.04Å; Q26-N28 PolarHBondContact O-N 3.19Å
27	P	63	Low	61.6	Low	101 Å²	101	84 Å²	84	66%	0.656	51%	0.512	S	S	*	.			trans	-60.1	136.8	176.6	23.8	-31	0	0	0	109.6	K29	P27-K29 PolarHBondContact O-N 3.11Å
28	N	74.9	Confident	64.5	Low	59 Å²	59	79 Å²	79	32%	0.316	47%	0.471	S	S	.	.			trans	-58.9	113.4	176.2	-178.8	6.4	0	0	0	108.9	Q26 F30 P31 G58 Q60	Q26-N28 PolarHBondContact O-N 3.19Å; N28-F30 VanDerWaalsContact C-N 3.32Å; N28-F30 PolarHBondContact OD1-N 2.87Å; N28-F30 PolarHBondContact OD1-O 3.02Å; N28-P31 WeakPolarHBondContact ND2-CA 3.38Å; N28-G58 PolarHBondContact OD1-O 3.49Å; N28-Q60 WeakPolarHBondContact ND2-CB 3.45Å; N28-Q60 PolarHBondContact ND2-OE1 2.81Å
29	K	85	Confident	67.4	Low	117 Å²	117	79.5 Å²	79.5	51%	0.509	46%	0.455	S	S	.	.	S	Bend	trans	-79.9	-19.7	-177	-65.7	-176.4	-178.7	177.9	0	112	P27 G58	P27-K29 PolarHBondContact O-N 3.11Å; K29-G58 PolarHBondContact N-O 3.24Å
30	F	88.6	Confident	70.1	Confident	31 Å²	31	73.9 Å²	73.9	14%	0.136	42%	0.418	C	S	.	.			trans	-135.1	70.5	-171	-48.3	-66.7	0	0	0	110.4	N28 Q32 V33 F59 G111 H112 P113	N28-F30 VanDerWaalsContact C-N 3.32Å; N28-F30 PolarHBondContact OD1-N 2.87Å; N28-F30 PolarHBondContact OD1-O 3.02Å; F30-Q32 PolarHBondContact O-N 3.11Å; F30-Q32 VanDerWaalsContact O-N 3.14Å; F30-V33 HydrophobicContact CB-CB 4.19Å; F30-V33 HydrophobicContact CB-CG2 4.47Å; F30-V33 PolarHBondContact O-N 3.1Å; F30-F59 HydrophobicContact CD2-CD1 4.11Å; F30-F59 HydrophobicContact CD2-CD2 4.16Å; F30-F59 HydrophobicContact CD2-CE1 4.17Å; F30-F59 HydrophobicContact CD2-CE2 4.18Å; F30-F59 HydrophobicContact CD2-CG 4.12Å; F30-F59 HydrophobicContact CD2-CZ 4.19Å; F30-F59 HydrophobicContact CE2-CD2 4.18Å; F30-F59 AromaticContact CE2-CE2 3.9Å; F30-F59 HydrophobicContact CE2-CE2 3.9Å; F30-F59 HydrophobicContact CE2-CZ 4.1Å; F30-G111 WeakPolarHBondContact CZ-O 3.49Å; F30-H112 HydrophobicContact CE1-CB 4Å; F30-H112 HydrophobicContact CZ-CB 3.82Å; F30-P113 HydrophobicContact CB-CG 4.18Å; F30-P113 VanDerWaalsContact CD1-CD 3.5Å; F30-P113 HydrophobicContact CD1-CG 3.94Å; F30-P113 HydrophobicContact CD2-CG 4.29Å; F30-P113 HydrophobicContact CE1-CG 4.44Å; F30-P113 HydrophobicContact CG-CG 3.86Å
31	P	83.4	Confident	72.4	Confident	85 Å²	85	68.6 Å²	68.6	55%	0.552	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.2	-176.4	25.2	-35.2	0	0	0	114.2	N28 V33	N28-P31 WeakPolarHBondContact ND2-CA 3.38Å; P31-V33 VanDerWaalsContact C-N 3.3Å
32	Q	85.2	Confident	75	Confident	128 Å²	128	60.8 Å²	60.8	60%	0.598	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.5	176.3	71.4	-78.1	13.9	0	0	114	F30	F30-Q32 PolarHBondContact O-N 3.11Å; F30-Q32 VanDerWaalsContact O-N 3.14Å
33	V	90.4	Very high	77.4	Confident	9 Å²	9	57.4 Å²	57.4	6%	0.055	33%	0.332	C	S	.	.			trans	-119.5	97.8	-178.8	-178	0	0	0	0	109.8	F30 P31 L35 F59 W103 P113	F30-V33 HydrophobicContact CB-CB 4.19Å; F30-V33 HydrophobicContact CB-CG2 4.47Å; F30-V33 PolarHBondContact O-N 3.1Å; P31-V33 VanDerWaalsContact C-N 3.3Å; V33-L35 HydrophobicContact CG1-CD2 3.46Å; V33-L35 VanDerWaalsContact CG1-CD2 3.46Å; V33-L35 HydrophobicContact CG1-CG 4.17Å; V33-F59 HydrophobicContact CG1-CD1 4.22Å; V33-W103 HydrophobicContact CG1-CH2 4.09Å; V33-P113 HydrophobicContact CB-CG 4.34Å; V33-P113 HydrophobicContact CG2-CB 4.15Å; V33-P113 HydrophobicContact CG2-CG 3.76Å
34	I	92.4	Very high	79.6	Confident	20 Å²	20	55.3 Å²	55.3	10%	0.103	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112	174.8	-57.2	177.7	0	0	0	108.4	Q60 E62 N68 V69 T70 H71	I34-Q60 HydrophobicContact CG1-CG 4.34Å; I34-Q60 HydrophobicContact CG2-CG 4.27Å; I34-E62 HydrophobicContact CG2-CG 3.72Å; I34-E62 WeakPolarHBondContact CG2-OE1 3.35Å; I34-N68 WeakPolarHBondContact CB-O 3.4Å; I34-N68 HydrophobicContact CD1-CB 3.92Å; I34-N68 WeakPolarHBondContact CD1-O 3.09Å; I34-V69 HydrophobicContact CG2-CG2 4.46Å; I34-T70 HydrophobicContact CB-CG2 4.49Å; I34-T70 PolarHBondContact N-OG1 3.35Å; I34-T70 PolarHBondContact O-N 3.26Å; I34-T70 PolarHBondContact O-OG1 2.95Å; I34-H71 PolarHBondContact O-N 3.45Å; I34-H71 VanDerWaalsContact O-N 3.07Å
35	L	93.6	Very high	82	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	140.9	-175.9	-54.1	-173.3	0	0	0	111.6	V33 F59 Q60 V61 E62 H71 W103 Y104 M108	V33-L35 HydrophobicContact CG1-CD2 3.46Å; V33-L35 VanDerWaalsContact CG1-CD2 3.46Å; V33-L35 HydrophobicContact CG1-CG 4.17Å; L35-F59 HydrophobicContact CD1-CB 4.01Å; L35-F59 HydrophobicContact CD1-CD1 3.79Å; L35-F59 HydrophobicContact CD1-CG 4.14Å; L35-F59 HydrophobicContact CG-CD1 4.36Å; L35-Q60 PolarHBondContact N-O 3.12Å; L35-V61 HydrophobicContact CB-CG1 4.46Å; L35-V61 HydrophobicContact CB-CG2 4.26Å; L35-V61 HydrophobicContact CD1-CG2 4.29Å; L35-V61 WeakPolarHBondContact O-CA 3.48Å; L35-E62 PolarHBondContact O-N 3.21Å; L35-H71 CarbonylContact C-O 3.53Å; L35-H71 WeakPolarHBondContact CA-O 3.4Å; L35-H71 HydrophobicContact CD2-CB 3.59Å; L35-W103 HydrophobicContact CD2-CH2 3.98Å; L35-W103 HydrophobicContact CD2-CZ3 3.73Å; L35-Y104 HydrophobicContact CD1-CD2 3.93Å; L35-Y104 HydrophobicContact CD1-CE2 3.71Å; L35-M108 HydrophobicContact CD1-CE 4.15Å
36	F	93.3	Very high	84	Confident	9 Å²	9	54.7 Å²	54.7	4%	0.039	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125	163.6	176.9	-100.9	0	0	0	109.2	L38 F65 V69 H71 V72 I73 W85	F36-L38 HydrophobicContact CE1-CB 4.46Å; F36-L38 HydrophobicContact CE1-CD1 4.21Å; F36-F65 HydrophobicContact CB-CD2 4.49Å; F36-F65 AromaticContact CD1-CD2 3.85Å; F36-F65 HydrophobicContact CD1-CD2 3.85Å; F36-F65 HydrophobicContact CD2-CB 4.15Å; F36-F65 HydrophobicContact CD2-CD2 4.49Å; F36-F65 HydrophobicContact CE1-CB 4.25Å; F36-F65 HydrophobicContact CE1-CD2 4.19Å; F36-F65 HydrophobicContact CE2-CB 3.85Å; F36-F65 HydrophobicContact CG-CB 4.48Å; F36-F65 HydrophobicContact CG-CD2 4.02Å; F36-F65 HydrophobicContact CZ-CB 3.91Å; F36-V69 HydrophobicContact CB-CB 4.36Å; F36-V69 HydrophobicContact CB-CG1 3.51Å; F36-V69 HydrophobicContact CB-CG2 3.87Å; F36-H71 PolarHBondContact N-O 2.82Å; F36-V72 HydrophobicContact CD1-CG1 4.26Å; F36-V72 CarbonylContact O-C 3.58Å; F36-V72 WeakPolarHBondContact O-CA 3.44Å; F36-I73 PolarHBondContact O-N 3.47Å; F36-W85 HydrophobicContact CD1-CH2 4.33Å; F36-W85 HydrophobicContact CD1-CZ3 4.45Å; F36-W85 AromaticContact CE1-CH2 3.34Å; F36-W85 HydrophobicContact CE1-CH2 3.34Å; F36-W85 HydrophobicContact CE1-CZ2 4.11Å; F36-W85 AromaticContact CE1-CZ3 3.77Å; F36-W85 HydrophobicContact CE1-CZ3 3.77Å; F36-W85 AromaticContact CZ-CH2 3.62Å; F36-W85 HydrophobicContact CZ-CH2 3.62Å; F36-W85 HydrophobicContact CZ-CZ2 4.15Å; F36-W85 HydrophobicContact CZ-CZ3 4.48Å
37	L	92.3	Very high	85.8	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.6	176.1	-71	149.4	0	0	0	109	E39 M42 R47 L50 S51 V61 I73 Y104	L37-E39 PolarHBondContact O-N 3.4Å; L37-M42 HydrophobicContact CB-CE 4.35Å; L37-M42 HydrophobicContact CB-SD 4.15Å; L37-M42 HydrophobicContact CD2-CE 3.88Å; L37-M42 HydrophobicContact CD2-SD 4.11Å; L37-R47 HydrophobicContact CB-CG 3.98Å; L37-R47 PolarHBondContact O-NE 3.16Å; L37-L50 HydrophobicContact CD1-CB 3.75Å; L37-L50 HydrophobicContact CD2-CB 4Å; L37-L50 HydrophobicContact CD2-CD1 4.03Å; L37-S51 WeakPolarHBondContact CD1-OG 3.35Å; L37-V61 HydrophobicContact CD1-CG1 3.91Å; L37-I73 HydrophobicContact CD2-CB 3.83Å; L37-I73 HydrophobicContact CD2-CG1 4.48Å; L37-I73 HydrophobicContact CD2-CG2 3.79Å; L37-I73 HydrophobicContact CG-CB 4.46Å; L37-Y104 HydrophobicContact CD2-CD2 4.26Å; L37-Y104 HydrophobicContact CD2-CE2 4.22Å
38	L	89.9	Confident	87.1	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	27%	0.267	C	S	.	.			trans	-75	114.2	179	-178	63.6	0	0	0	110	F36 R40 V72 I73 C74 W85	F36-L38 HydrophobicContact CE1-CB 4.46Å; F36-L38 HydrophobicContact CE1-CD1 4.21Å; L38-R40 HydrophobicContact CD1-CG 4.03Å; L38-R40 HydrophobicContact CD2-CG 4.31Å; L38-R40 HydrophobicContact CG-CB 4.41Å; L38-R40 HydrophobicContact CG-CG 4Å; L38-R40 PolarHBondContact O-N 2.97Å; L38-V72 HydrophobicContact CB-CG1 4.35Å; L38-I73 PolarHBondContact N-O 2.96Å; L38-C74 HydrophobicContact CD2-CB 4.38Å; L38-C74 VanDerWaalsContact CD2-SG 3.57Å; L38-W85 HydrophobicContact CD1-CD2 3.49Å; L38-W85 VanDerWaalsContact CD1-CD2 3.49Å; L38-W85 HydrophobicContact CD1-CE3 3.76Å; L38-W85 HydrophobicContact CD1-CG 3.98Å; L38-W85 HydrophobicContact CD1-CH2 4.1Å; L38-W85 HydrophobicContact CD1-CZ2 3.84Å; L38-W85 HydrophobicContact CD1-CZ3 4.06Å
39	E	86	Confident	88	Confident	75 Å²	75	52 Å²	52	35%	0.35	28%	0.278	S	S	.	.			trans	-67.9	-32.4	-170.7	-162.4	170.5	131	0	0	114.6	L37 K41 M42 G43 A44 R47	L37-E39 PolarHBondContact O-N 3.4Å; E39-K41 PolarHBondContact O-N 3.3Å; E39-M42 CarbonylContact O-C 3.47Å; E39-M42 WeakPolarHBondContact O-CA 3.4Å; E39-M42 WeakPolarHBondContact O-CB 3.4Å; E39-M42 PolarHBondContact O-N 3.3Å; E39-G43 PolarHBondContact O-N 3.12Å; E39-A44 WeakPolarHBondContact OE1-CA 3.32Å; E39-A44 VanDerWaalsContact OE1-CB 3.3Å; E39-A44 WeakPolarHBondContact OE1-CB 3.18Å; E39-R47 HydrophobicContact CG-CB 4.27Å; E39-R47 VanDerWaalsContact OE2-CD 3.28Å; E39-R47 WeakPolarHBondContact OE2-CD 3.48Å; E39-R47 IonicContact OE2-CZ 3.64Å; E39-R47 IonicContact OE2-NE 3.86Å; E39-R47 IonicContact OE2-NH1 2.65Å; E39-R47 PolarHBondContact OE2-NH1 2.71Å
40	R	83.1	Confident	88.5	Confident	24 Å²	24	46.7 Å²	46.7	9%	0.091	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-25	-91.6	-168.9	-64.8	-174.6	78.4	-179.8	8.1	115.4	L38 M42 E81 E217 N218	L38-R40 HydrophobicContact CD1-CG 4.03Å; L38-R40 HydrophobicContact CD2-CG 4.31Å; L38-R40 HydrophobicContact CG-CB 4.41Å; L38-R40 HydrophobicContact CG-CG 4Å; L38-R40 PolarHBondContact O-N 2.97Å; R40-M42 VanDerWaalsContact C-N 3.26Å; R40-M42 PolarHBondContact O-N 3.28Å; R40-E81 PolarHBondContact NH1-O 2.83Å; R40-E81 VanDerWaalsContact NH1-O 3.15Å; R40-E217 IonicContact CZ-OE2 2.78Å; R40-E217 VanDerWaalsContact NH2-CB 3.32Å; R40-E217 IonicContact NH2-OE1 2.72Å; R40-E217 IonicContact NH2-OE2 3.6Å; R40-E217 PolarHBondContact NH2-OE2 3.43Å; R40-N218 CarbonylContact O-C 3.45Å; R40-N218 VanDerWaalsContact O-CA 3.28Å; R40-N218 WeakPolarHBondContact O-CA 3.4Å
41	K	79.8	Confident	88.7	Confident	73 Å²	73	45.3 Å²	45.3	32%	0.317	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-7.6	-179.7	-65.7	176.9	-176.7	167.3	0	113.1	E39 S76 E81 E217	E39-K41 PolarHBondContact O-N 3.3Å; K41-S76 WeakPolarHBondContact CD-O 3.48Å; K41-S76 PolarHBondContact NZ-O 3.43Å; K41-E81 VanDerWaalsContact NZ-CD 3.31Å; K41-E81 IonicContact NZ-OE1 3.11Å; K41-E81 PolarHBondContact NZ-OE1 2.81Å; K41-E81 IonicContact NZ-OE2 2.7Å; K41-E81 PolarHBondContact NZ-OE2 3.41Å; K41-E217 VanDerWaalsContact CG-O 3.32Å; K41-E217 WeakPolarHBondContact CG-O 3.24Å
42	M	86.4	Confident	89.2	Confident	10 Å²	10	46 Å²	46	5%	0.049	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-37.7	179.5	-174.5	-175	-65.6	0	0	111.7	L37 E39 R40 R46 R47 L50 E75	L37-M42 HydrophobicContact CB-CE 4.35Å; L37-M42 HydrophobicContact CB-SD 4.15Å; L37-M42 HydrophobicContact CD2-CE 3.88Å; L37-M42 HydrophobicContact CD2-SD 4.11Å; E39-M42 CarbonylContact O-C 3.47Å; E39-M42 WeakPolarHBondContact O-CA 3.4Å; E39-M42 WeakPolarHBondContact O-CB 3.4Å; E39-M42 PolarHBondContact O-N 3.3Å; R40-M42 VanDerWaalsContact C-N 3.26Å; R40-M42 PolarHBondContact O-N 3.28Å; M42-R46 HydrophobicContact CG-CB 4.14Å; M42-R46 HydrophobicContact CG-CG 3.91Å; M42-R46 VanDerWaalsContact O-CB 3.23Å; M42-R46 WeakPolarHBondContact O-CB 3.42Å; M42-R47 HydrophobicContact SD-CB 3.92Å; M42-R47 HydrophobicContact SD-CG 4.43Å; M42-L50 HydrophobicContact CE-CD1 4.27Å; M42-L50 HydrophobicContact CG-CD1 4.42Å; M42-L50 HydrophobicContact SD-CD1 3.79Å; M42-E75 HydrophobicContact CB-CB 4.19Å; M42-E75 HydrophobicContact CE-CB 3.94Å; M42-E75 HydrophobicContact CG-CB 4.35Å
43	G	82.6	Confident	89.6	Confident	29 Å²	29	42.4 Å²	42.4	30%	0.299	23%	0.23	S	C	.	.			trans	80.2	148.4	-175.5	0	0	0	0	0	114.4	E39 S45 R46 R47	E39-G43 PolarHBondContact O-N 3.12Å; G43-S45 PolarHBondContact O-N 3.46Å; G43-R46 PolarHBondContact O-N 2.8Å; G43-R47 WeakPolarHBondContact O-CB 3.49Å; G43-R47 PolarHBondContact O-N 3.45Å
44	A	83.9	Confident	89.7	Confident	55 Å²	55	42 Å²	42	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-54.3	-47.1	-176.3	0	0	0	0	0	114.1	E39 R46 R47 A48	E39-A44 WeakPolarHBondContact OE1-CA 3.32Å; E39-A44 VanDerWaalsContact OE1-CB 3.3Å; E39-A44 WeakPolarHBondContact OE1-CB 3.18Å; A44-R46 PolarHBondContact O-N 3.46Å; A44-R47 PolarHBondContact O-N 3.08Å; A44-A48 WeakPolarHBondContact O-CB 3.34Å; A44-A48 PolarHBondContact O-N 2.94Å
45	S	85.5	Confident	89.7	Confident	105 Å²	105	45.9 Å²	45.9	73%	0.734	24%	0.241	S	C	*	.	H	α-helix	trans	-64.8	-42	-177.3	-53.1	0	0	0	0	112.1	G43 A48 F49	G43-S45 PolarHBondContact O-N 3.46Å; S45-A48 PolarHBondContact O-N 3.24Å; S45-F49 PolarHBondContact O-N 3.21Å
46	R	89.6	Confident	89.6	Confident	106 Å²	106	54 Å²	54	40%	0.4	27%	0.271	S	S	.	.	H	α-helix	trans	-69.9	-43	177.8	-176.7	163.7	177	80.8	-0.4	110.9	M42 G43 A44 A48 F49 L50 E75	M42-R46 HydrophobicContact CG-CB 4.14Å; M42-R46 HydrophobicContact CG-CG 3.91Å; M42-R46 VanDerWaalsContact O-CB 3.23Å; M42-R46 WeakPolarHBondContact O-CB 3.42Å; G43-R46 PolarHBondContact O-N 2.8Å; A44-R46 PolarHBondContact O-N 3.46Å; R46-A48 VanDerWaalsContact C-N 3.33Å; R46-A48 PolarHBondContact O-N 2.93Å; R46-F49 PolarHBondContact O-N 3.42Å; R46-L50 HydrophobicContact CG-CD1 4.04Å; R46-L50 HydrophobicContact CG-CG 4.38Å; R46-L50 WeakPolarHBondContact O-CB 3.47Å; R46-L50 VanDerWaalsContact O-CG 3.29Å; R46-L50 WeakPolarHBondContact O-CG 3.35Å; R46-L50 PolarHBondContact O-N 2.81Å; R46-E75 WeakPolarHBondContact CD-OE2 3.48Å; R46-E75 IonicContact CZ-OE1 3.81Å; R46-E75 IonicContact CZ-OE2 3.62Å; R46-E75 IonicContact NE-OE1 2.76Å; R46-E75 PolarHBondContact NE-OE1 3.39Å; R46-E75 IonicContact NE-OE2 3.08Å; R46-E75 PolarHBondContact NE-OE2 3.18Å; R46-E75 IonicContact NH2-OE1 3.59Å; R46-E75 PolarHBondContact NH2-OE1 3.46Å; R46-E75 IonicContact NH2-OE2 2.73Å
47	R	92.9	Very high	89.5	Confident	32 Å²	32	57.2 Å²	57.2	12%	0.121	29%	0.285	C	S	.	.	H	α-helix	trans	-55.4	-47.8	172	179.3	179.2	179.1	-140.3	-9.5	111.6	L37 E39 M42 G43 A44 F49 L50 S51 E63	L37-R47 HydrophobicContact CB-CG 3.98Å; L37-R47 PolarHBondContact O-NE 3.16Å; E39-R47 HydrophobicContact CG-CB 4.27Å; E39-R47 VanDerWaalsContact OE2-CD 3.28Å; E39-R47 WeakPolarHBondContact OE2-CD 3.48Å; E39-R47 IonicContact OE2-CZ 3.64Å; E39-R47 IonicContact OE2-NE 3.86Å; E39-R47 IonicContact OE2-NH1 2.65Å; E39-R47 PolarHBondContact OE2-NH1 2.71Å; M42-R47 HydrophobicContact SD-CB 3.92Å; M42-R47 HydrophobicContact SD-CG 4.43Å; G43-R47 WeakPolarHBondContact O-CB 3.49Å; G43-R47 PolarHBondContact O-N 3.45Å; A44-R47 PolarHBondContact O-N 3.08Å; R47-F49 PolarHBondContact O-N 3.23Å; R47-L50 PolarHBondContact O-N 2.99Å; R47-S51 WeakPolarHBondContact O-CB 3.46Å; R47-S51 PolarHBondContact O-N 2.93Å; R47-S51 PolarHBondContact O-OG 3.49Å; R47-S51 VanDerWaalsContact O-OG 3.09Å; R47-E63 PolarHBondContact NH2-O 3.43Å
48	A	91.4	Very high	89.3	Confident	57 Å²	57	57.3 Å²	57.3	47%	0.471	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-43.6	179	0	0	0	0	0	112.3	A44 S45 R46 S51 Q52	A44-A48 WeakPolarHBondContact O-CB 3.34Å; A44-A48 PolarHBondContact O-N 2.94Å; S45-A48 PolarHBondContact O-N 3.24Å; R46-A48 VanDerWaalsContact C-N 3.33Å; R46-A48 PolarHBondContact O-N 2.93Å; A48-S51 PolarHBondContact O-N 2.94Å; A48-Q52 WeakPolarHBondContact O-CB 3.39Å; A48-Q52 PolarHBondContact O-N 3.3Å
49	F	93.3	Very high	89.4	Confident	123 Å²	123	57.5 Å²	57.5	54%	0.539	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-49.3	174.9	171.4	-98.4	0	0	0	111.8	S45 R46 R47 Q52 L53	S45-F49 PolarHBondContact O-N 3.21Å; R46-F49 PolarHBondContact O-N 3.42Å; R47-F49 PolarHBondContact O-N 3.23Å; F49-Q52 PolarHBondContact O-N 2.84Å; F49-L53 HydrophobicContact CE1-CD2 4.42Å; F49-L53 WeakPolarHBondContact O-CB 3.3Å; F49-L53 PolarHBondContact O-N 3.33Å
50	L	94.3	Very high	89.8	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-47.1	177.8	-65.4	175.6	0	0	0	110.2	L37 M42 R46 R47 Q52 L53 G54 V101 Y104	L37-L50 HydrophobicContact CD1-CB 3.75Å; L37-L50 HydrophobicContact CD2-CB 4Å; L37-L50 HydrophobicContact CD2-CD1 4.03Å; M42-L50 HydrophobicContact CE-CD1 4.27Å; M42-L50 HydrophobicContact CG-CD1 4.42Å; M42-L50 HydrophobicContact SD-CD1 3.79Å; R46-L50 HydrophobicContact CG-CD1 4.04Å; R46-L50 HydrophobicContact CG-CG 4.38Å; R46-L50 WeakPolarHBondContact O-CB 3.47Å; R46-L50 VanDerWaalsContact O-CG 3.29Å; R46-L50 WeakPolarHBondContact O-CG 3.35Å; R46-L50 PolarHBondContact O-N 2.81Å; R47-L50 PolarHBondContact O-N 2.99Å; L50-Q52 VanDerWaalsContact C-N 3.27Å; L50-Q52 PolarHBondContact O-N 3.35Å; L50-L53 WeakPolarHBondContact O-CB 3.27Å; L50-L53 PolarHBondContact O-N 3.43Å; L50-G54 PolarHBondContact O-N 2.72Å; L50-V101 HydrophobicContact CD1-CG2 4.3Å; L50-Y104 HydrophobicContact CB-CE1 4.12Å; L50-Y104 HydrophobicContact CD2-CD1 4.17Å; L50-Y104 HydrophobicContact CD2-CE1 3.72Å; L50-Y104 HydrophobicContact CG-CE1 4.41Å; L50-Y104 PolarHBondContact O-OH 2.96Å
51	S	94	Very high	90.2	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.007	28%	0.284	C	S	.	.	H	α-helix	trans	-53.3	-44.5	175.7	-70.5	0	0	0	0	112.4	L37 R47 A48 R55	L37-S51 WeakPolarHBondContact CD1-OG 3.35Å; R47-S51 WeakPolarHBondContact O-CB 3.46Å; R47-S51 PolarHBondContact O-N 2.93Å; R47-S51 PolarHBondContact O-OG 3.49Å; R47-S51 VanDerWaalsContact O-OG 3.09Å; A48-S51 PolarHBondContact O-N 2.94Å; S51-R55 WeakPolarHBondContact O-CG 3.26Å; S51-R55 PolarHBondContact O-N 3.22Å; S51-R55 VanDerWaalsContact O-N 3.16Å
52	Q	93	Very high	90.8	Very high	101 Å²	101	54.5 Å²	54.5	47%	0.472	28%	0.276	S	S	.	.	H	α-helix	trans	-67.1	-41.4	177.3	-167.7	179.1	27.5	0	0	112.3	A48 F49 L50 R55 R56	A48-Q52 WeakPolarHBondContact O-CB 3.39Å; A48-Q52 PolarHBondContact O-N 3.3Å; F49-Q52 PolarHBondContact O-N 2.84Å; L50-Q52 VanDerWaalsContact C-N 3.27Å; L50-Q52 PolarHBondContact O-N 3.35Å; Q52-R55 PolarHBondContact O-N 3.15Å; Q52-R56 VanDerWaalsContact CD-NH2 3.28Å; Q52-R56 WeakPolarHBondContact O-CG 3.45Å; Q52-R56 PolarHBondContact O-N 3.13Å
53	L	93.8	Very high	90.8	Very high	52 Å²	52	58.2 Å²	58.2	27%	0.272	29%	0.293	S	S	.	.	H	α-helix	trans	-60	-47.1	176.7	179	60.1	0	0	0	111.5	F49 L50 R55 R56 K57 M108	F49-L53 HydrophobicContact CE1-CD2 4.42Å; F49-L53 WeakPolarHBondContact O-CB 3.3Å; F49-L53 PolarHBondContact O-N 3.33Å; L50-L53 WeakPolarHBondContact O-CB 3.27Å; L50-L53 PolarHBondContact O-N 3.43Å; L53-R55 PolarHBondContact O-N 3.38Å; L53-R56 PolarHBondContact O-N 3.06Å; L53-K57 HydrophobicContact CD1-CG 4.38Å; L53-K57 WeakPolarHBondContact O-CG 3.3Å; L53-K57 PolarHBondContact O-N 2.79Å; L53-M108 HydrophobicContact CD2-CB 4.23Å; L53-M108 HydrophobicContact CD2-CG 4.08Å; L53-M108 HydrophobicContact CG-CB 4.44Å; L53-M108 HydrophobicContact CG-CG 4.13Å
54	G	92.4	Very high	91.1	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-46.8	178.9	0	0	0	0	0	112.5	L50 R56 K57 G58 F59 Y104	L50-G54 PolarHBondContact O-N 2.72Å; G54-R56 PolarHBondContact O-N 3.48Å; G54-K57 CarbonylContact O-C 3.56Å; G54-K57 PolarHBondContact O-N 3.35Å; G54-K57 VanDerWaalsContact O-N 3.13Å; G54-G58 PolarHBondContact O-N 2.83Å; G54-G58 VanDerWaalsContact O-N 3.14Å; G54-F59 WeakPolarHBondContact O-CB 3.41Å; G54-F59 PolarHBondContact O-N 3.3Å; G54-Y104 WeakPolarHBondContact CA-OH 3.43Å; G54-Y104 PolarHBondContact N-OH 3.05Å
55	R	93.4	Very high	91.2	Very high	101 Å²	101	63.1 Å²	63.1	38%	0.381	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-42.7	176.1	-71	176.4	-174.6	132.5	10	112.3	S51 Q52 L53 K57 G58 V61 E63	S51-R55 WeakPolarHBondContact O-CG 3.26Å; S51-R55 PolarHBondContact O-N 3.22Å; S51-R55 VanDerWaalsContact O-N 3.16Å; Q52-R55 PolarHBondContact O-N 3.15Å; L53-R55 PolarHBondContact O-N 3.38Å; R55-K57 PolarHBondContact O-N 2.93Å; R55-G58 PolarHBondContact O-N 3.06Å; R55-G58 VanDerWaalsContact O-N 3.07Å; R55-V61 HydrophobicContact CG-CB 4.36Å; R55-V61 HydrophobicContact CG-CG2 4.35Å; R55-V61 PolarHBondContact NE-O 3.49Å; R55-V61 PolarHBondContact NH2-O 3.04Å; R55-E63 IonicContact CZ-OE1 3.15Å; R55-E63 IonicContact NH1-OE1 2.75Å; R55-E63 PolarHBondContact NH1-OE1 3.31Å; R55-E63 IonicContact NH2-OE1 3.74Å; R55-E63 PolarHBondContact NH2-OE1 2.98Å
56	R	91.4	Very high	91.3	Very high	170 Å²	170	59.8 Å²	59.8	64%	0.642	28%	0.279	S	S	*	.	H	α-helix	trans	-62.1	-33.2	175.9	-74.6	179.3	-171.6	-176.7	6.5	112.4	Q52 L53 G54 G58	Q52-R56 VanDerWaalsContact CD-NH2 3.28Å; Q52-R56 WeakPolarHBondContact O-CG 3.45Å; Q52-R56 PolarHBondContact O-N 3.13Å; L53-R56 PolarHBondContact O-N 3.06Å; G54-R56 PolarHBondContact O-N 3.48Å; R56-G58 VanDerWaalsContact C-N 3.27Å
57	K	90.7	Very high	91	Very high	77 Å²	77	63.6 Å²	63.6	34%	0.335	30%	0.298	S	S	.	.	H	α-helix	trans	-81.4	-4	176.9	-69.4	-75.3	-175.6	150.9	0	113.4	L53 G54 R55 F59 M108	L53-K57 HydrophobicContact CD1-CG 4.38Å; L53-K57 WeakPolarHBondContact O-CG 3.3Å; L53-K57 PolarHBondContact O-N 2.79Å; G54-K57 CarbonylContact O-C 3.56Å; G54-K57 PolarHBondContact O-N 3.35Å; G54-K57 VanDerWaalsContact O-N 3.13Å; R55-K57 PolarHBondContact O-N 2.93Å; K57-F59 HydrophobicContact CB-CD2 3.93Å; K57-F59 HydrophobicContact CB-CE2 4.1Å; K57-M108 HydrophobicContact CB-SD 3.79Å; K57-M108 VanDerWaalsContact CE-O 3.29Å; K57-M108 WeakPolarHBondContact CE-O 3.41Å; K57-M108 HydrophobicContact CG-SD 3.9Å; K57-M108 PolarHBondContact NZ-O 3.4Å
58	G	88.7	Confident	90.7	Very high	3 Å²	3	67.2 Å²	67.2	3%	0.031	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	12.7	175.1	0	0	0	0	0	114.8	N28 K29 G54 R55 R56	N28-G58 PolarHBondContact OD1-O 3.49Å; K29-G58 PolarHBondContact N-O 3.24Å; G54-G58 PolarHBondContact O-N 2.83Å; G54-G58 VanDerWaalsContact O-N 3.14Å; R55-G58 PolarHBondContact O-N 3.06Å; R55-G58 VanDerWaalsContact O-N 3.07Å; R56-G58 VanDerWaalsContact C-N 3.27Å
59	F	92.1	Very high	90.6	Very high	6 Å²	6	64.6 Å²	64.6	3%	0.026	30%	0.298	C	S	.	.			trans	-84.3	147.1	172.9	-67.5	-105.1	0	0	0	111.1	F30 V33 L35 G54 K57 V61 M108 P113	F30-F59 HydrophobicContact CD2-CD1 4.11Å; F30-F59 HydrophobicContact CD2-CD2 4.16Å; F30-F59 HydrophobicContact CD2-CE1 4.17Å; F30-F59 HydrophobicContact CD2-CE2 4.18Å; F30-F59 HydrophobicContact CD2-CG 4.12Å; F30-F59 HydrophobicContact CD2-CZ 4.19Å; F30-F59 HydrophobicContact CE2-CD2 4.18Å; F30-F59 AromaticContact CE2-CE2 3.9Å; F30-F59 HydrophobicContact CE2-CE2 3.9Å; F30-F59 HydrophobicContact CE2-CZ 4.1Å; V33-F59 HydrophobicContact CG1-CD1 4.22Å; L35-F59 HydrophobicContact CD1-CB 4.01Å; L35-F59 HydrophobicContact CD1-CD1 3.79Å; L35-F59 HydrophobicContact CD1-CG 4.14Å; L35-F59 HydrophobicContact CG-CD1 4.36Å; G54-F59 WeakPolarHBondContact O-CB 3.41Å; G54-F59 PolarHBondContact O-N 3.3Å; K57-F59 HydrophobicContact CB-CD2 3.93Å; K57-F59 HydrophobicContact CB-CE2 4.1Å; F59-V61 HydrophobicContact CB-CG2 4.47Å; F59-V61 PolarHBondContact O-N 2.96Å; F59-M108 HydrophobicContact CD1-CE 4.16Å; F59-M108 HydrophobicContact CD2-CE 3.56Å; F59-M108 HydrophobicContact CD2-SD 3.88Å; F59-M108 HydrophobicContact CE1-CE 4.22Å; F59-M108 HydrophobicContact CE2-CE 3.67Å; F59-M108 HydrophobicContact CE2-SD 3.82Å; F59-M108 HydrophobicContact CG-CE 3.83Å; F59-M108 HydrophobicContact CZ-CE 3.99Å; F59-P113 HydrophobicContact CE1-CB 4.19Å; F59-P113 HydrophobicContact CE1-CG 3.67Å; F59-P113 HydrophobicContact CZ-CG 4.18Å
60	Q	92.7	Very high	90.5	Very high	67 Å²	67	60.6 Å²	60.6	31%	0.313	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	116.5	167.1	-178.7	170.8	-27.7	0	0	109.8	N28 I34 L35	N28-Q60 WeakPolarHBondContact ND2-CB 3.45Å; N28-Q60 PolarHBondContact ND2-OE1 2.81Å; I34-Q60 HydrophobicContact CG1-CG 4.34Å; I34-Q60 HydrophobicContact CG2-CG 4.27Å; L35-Q60 PolarHBondContact N-O 3.12Å
61	V	93	Very high	90.4	Very high	9 Å²	9	61 Å²	61	6%	0.055	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.9	176.1	-169.8	0	0	0	0	109.4	L35 L37 R55 F59	L35-V61 HydrophobicContact CB-CG1 4.46Å; L35-V61 HydrophobicContact CB-CG2 4.26Å; L35-V61 HydrophobicContact CD1-CG2 4.29Å; L35-V61 WeakPolarHBondContact O-CA 3.48Å; L37-V61 HydrophobicContact CD1-CG1 3.91Å; R55-V61 HydrophobicContact CG-CB 4.36Å; R55-V61 HydrophobicContact CG-CG2 4.35Å; R55-V61 PolarHBondContact NE-O 3.49Å; R55-V61 PolarHBondContact NH2-O 3.04Å; F59-V61 HydrophobicContact CB-CG2 4.47Å; F59-V61 PolarHBondContact O-N 2.96Å
62	E	91.4	Very high	90.3	Very high	33 Å²	33	61 Å²	61	15%	0.154	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.4	178.3	-64.2	-167.9	173.2	0	0	111.6	I34 L35 L64 S66 V69	I34-E62 HydrophobicContact CG2-CG 3.72Å; I34-E62 WeakPolarHBondContact CG2-OE1 3.35Å; L35-E62 PolarHBondContact O-N 3.21Å; E62-L64 WeakPolarHBondContact CB-O 3.39Å; E62-S66 WeakPolarHBondContact OE2-CB 3.36Å; E62-S66 PolarHBondContact OE2-OG 3.25Å; E62-V69 WeakPolarHBondContact OE2-CG2 3.46Å
63	E	87.8	Confident	90.3	Very high	88 Å²	88	56.2 Å²	56.2	41%	0.411	26%	0.263	S	S	.	.	S	Bend	trans	-79.8	-25.7	175.3	-67.6	-60.5	159.1	0	0	112.7	R47 R55	R47-E63 PolarHBondContact NH2-O 3.43Å; R55-E63 IonicContact CZ-OE1 3.15Å; R55-E63 IonicContact NH1-OE1 2.75Å; R55-E63 PolarHBondContact NH1-OE1 3.31Å; R55-E63 IonicContact NH2-OE1 3.74Å; R55-E63 PolarHBondContact NH2-OE1 2.98Å
64	L	87.8	Confident	90.3	Very high	142 Å²	142	53.7 Å²	53.7	74%	0.743	25%	0.25	S	S	*	.	S	Bend	trans	-119.1	143	176.8	-64.5	176.3	0	0	0	108.3	E62 S66	E62-L64 WeakPolarHBondContact CB-O 3.39Å; L64-S66 PolarHBondContact O-N 2.87Å
65	F	86.6	Confident	90.1	Very high	45 Å²	45	55 Å²	55	20%	0.197	26%	0.256	C	S	.	.			trans	-68.3	129.2	176.1	-178.4	-94.8	0	0	0	110	F36 V69 V72 W85 L86 Q89 A91	F36-F65 HydrophobicContact CB-CD2 4.49Å; F36-F65 AromaticContact CD1-CD2 3.85Å; F36-F65 HydrophobicContact CD1-CD2 3.85Å; F36-F65 HydrophobicContact CD2-CB 4.15Å; F36-F65 HydrophobicContact CD2-CD2 4.49Å; F36-F65 HydrophobicContact CE1-CB 4.25Å; F36-F65 HydrophobicContact CE1-CD2 4.19Å; F36-F65 HydrophobicContact CE2-CB 3.85Å; F36-F65 HydrophobicContact CG-CB 4.48Å; F36-F65 HydrophobicContact CG-CD2 4.02Å; F36-F65 HydrophobicContact CZ-CB 3.91Å; F65-V69 HydrophobicContact CD2-CB 4.39Å; F65-V69 HydrophobicContact CD2-CG1 4.43Å; F65-V69 HydrophobicContact CD2-CG2 4.21Å; F65-V69 HydrophobicContact CE2-CB 4.09Å; F65-V69 HydrophobicContact CE2-CG1 4.11Å; F65-V69 HydrophobicContact CE2-CG2 4.4Å; F65-V72 HydrophobicContact CE2-CG2 4.12Å; F65-W85 HydrophobicContact CB-CH2 3.82Å; F65-W85 HydrophobicContact CB-CZ3 4.47Å; F65-W85 HydrophobicContact CD2-CH2 4.13Å; F65-W85 AromaticContact CD2-CZ3 3.96Å; F65-W85 HydrophobicContact CD2-CZ3 3.96Å; F65-W85 HydrophobicContact CE2-CZ3 4.43Å; F65-W85 AromaticContact CG-CH2 3.94Å; F65-W85 HydrophobicContact CG-CH2 3.94Å; F65-W85 HydrophobicContact CG-CZ3 4.1Å; F65-L86 HydrophobicContact CD2-CD2 4.24Å; F65-L86 HydrophobicContact CE1-CD2 4.22Å; F65-L86 HydrophobicContact CE2-CD2 3.42Å; F65-L86 VanDerWaalsContact CE2-CD2 3.42Å; F65-L86 HydrophobicContact CZ-CD2 3.41Å; F65-L86 VanDerWaalsContact CZ-CD2 3.41Å; F65-Q89 HydrophobicContact CD1-CB 4.36Å; F65-A91 HydrophobicContact CE1-CB 3.51Å; F65-A91 HydrophobicContact CZ-CB 3.81Å
66	S	86.3	Confident	89.5	Confident	35 Å²	35	54.4 Å²	54.4	25%	0.245	27%	0.268	C	S	.	.			trans	-134.1	169.3	-179.9	88.9	0	0	0	0	111.7	E62 L64 N68 V69	E62-S66 WeakPolarHBondContact OE2-CB 3.36Å; E62-S66 PolarHBondContact OE2-OG 3.25Å; L64-S66 PolarHBondContact O-N 2.87Å; S66-N68 PolarHBondContact O-N 3.21Å; S66-N68 PolarHBondContact OG-N 3.18Å; S66-V69 WeakPolarHBondContact O-CB 3.47Å; S66-V69 WeakPolarHBondContact O-CG2 3.31Å; S66-V69 PolarHBondContact O-N 3Å
67	K	83.9	Confident	89.1	Confident	186 Å²	186	46.9 Å²	46.9	81%	0.809	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.7	177.4	-65.4	-176.5	-179.1	-179.6	0	113	V69 R96	K67-V69 VanDerWaalsContact C-N 3.33Å; K67-R96 PolarHBondContact O-NH2 2.91Å
68	N	86.3	Confident	88.8	Confident	108 Å²	108	44.5 Å²	44.5	58%	0.578	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-12	-176.8	-60.7	-19.9	0	0	0	112.9	I34 S66 T70	I34-N68 WeakPolarHBondContact CB-O 3.4Å; I34-N68 HydrophobicContact CD1-CB 3.92Å; I34-N68 WeakPolarHBondContact CD1-O 3.09Å; S66-N68 PolarHBondContact O-N 3.21Å; S66-N68 PolarHBondContact OG-N 3.18Å; N68-T70 PolarHBondContact O-N 2.78Å
69	V	89.8	Confident	88.4	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	23%	0.232	C	C	.	.			trans	-61.1	125.1	176.7	174.9	0	0	0	0	110	I34 F36 E62 F65 S66 K67 V72 R96	I34-V69 HydrophobicContact CG2-CG2 4.46Å; F36-V69 HydrophobicContact CB-CB 4.36Å; F36-V69 HydrophobicContact CB-CG1 3.51Å; F36-V69 HydrophobicContact CB-CG2 3.87Å; E62-V69 WeakPolarHBondContact OE2-CG2 3.46Å; F65-V69 HydrophobicContact CD2-CB 4.39Å; F65-V69 HydrophobicContact CD2-CG1 4.43Å; F65-V69 HydrophobicContact CD2-CG2 4.21Å; F65-V69 HydrophobicContact CE2-CB 4.09Å; F65-V69 HydrophobicContact CE2-CG1 4.11Å; F65-V69 HydrophobicContact CE2-CG2 4.4Å; S66-V69 WeakPolarHBondContact O-CB 3.47Å; S66-V69 WeakPolarHBondContact O-CG2 3.31Å; S66-V69 PolarHBondContact O-N 3Å; K67-V69 VanDerWaalsContact C-N 3.33Å; V69-V72 HydrophobicContact CG1-CG2 3.93Å; V69-R96 WeakPolarHBondContact O-CD 2.97Å; V69-R96 PolarHBondContact O-NE 3.45Å
70	T	90.9	Very high	87.9	Confident	39 Å²	39	48.5 Å²	48.5	24%	0.239	25%	0.25	C	S	.	.			trans	-101.5	-34.9	179.8	57.3	0	0	0	0	112	I34 N68 H97	I34-T70 HydrophobicContact CB-CG2 4.49Å; I34-T70 PolarHBondContact N-OG1 3.35Å; I34-T70 PolarHBondContact O-N 3.26Å; I34-T70 PolarHBondContact O-OG1 2.95Å; N68-T70 PolarHBondContact O-N 2.78Å; T70-H97 PolarHBondContact O-N 3.42Å
71	H	92.4	Very high	87.3	Confident	16 Å²	16	47.2 Å²	47.2	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.2	-177.3	-61.1	61.3	0	0	0	109.6	I34 L35 F36 I73 H97 W103	I34-H71 PolarHBondContact O-N 3.45Å; I34-H71 VanDerWaalsContact O-N 3.07Å; L35-H71 CarbonylContact C-O 3.53Å; L35-H71 WeakPolarHBondContact CA-O 3.4Å; L35-H71 HydrophobicContact CD2-CB 3.59Å; F36-H71 PolarHBondContact N-O 2.82Å; H71-I73 HydrophobicContact CB-CD1 4.28Å; H71-H97 WeakPolarHBondContact CA-O 3.41Å; H71-H97 AromaticContact CE1-CD2 3.73Å; H71-H97 AromaticContact NE2-CD2 3.66Å; H71-W103 AromaticContact CD2-CH2 3.65Å; H71-W103 AromaticContact CD2-CZ2 3.81Å; H71-W103 AromaticContact NE2-CZ2 3.97Å
72	V	92.4	Very high	87	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.8	173.3	178.2	0	0	0	0	107.4	F36 L38 F65 V69 L86 H97 L98 L99	F36-V72 HydrophobicContact CD1-CG1 4.26Å; F36-V72 CarbonylContact O-C 3.58Å; F36-V72 WeakPolarHBondContact O-CA 3.44Å; L38-V72 HydrophobicContact CB-CG1 4.35Å; F65-V72 HydrophobicContact CE2-CG2 4.12Å; V69-V72 HydrophobicContact CG1-CG2 3.93Å; V72-L86 HydrophobicContact CG2-CD2 4.29Å; V72-H97 PolarHBondContact N-O 3Å; V72-L98 HydrophobicContact CB-CD2 3.76Å; V72-L98 HydrophobicContact CG1-CD2 4.01Å; V72-L98 HydrophobicContact CG2-CD2 4.29Å; V72-L99 PolarHBondContact O-N 3.3Å
73	I	93.5	Very high	86.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	120.7	-177.6	-51.1	-53.9	0	0	0	108.3	F36 L37 L38 H71 L99 W103 Y104	F36-I73 PolarHBondContact O-N 3.47Å; L37-I73 HydrophobicContact CD2-CB 3.83Å; L37-I73 HydrophobicContact CD2-CG1 4.48Å; L37-I73 HydrophobicContact CD2-CG2 3.79Å; L37-I73 HydrophobicContact CG-CB 4.46Å; L38-I73 PolarHBondContact N-O 2.96Å; H71-I73 HydrophobicContact CB-CD1 4.28Å; I73-L99 WeakPolarHBondContact CA-O 3.32Å; I73-L99 HydrophobicContact CD1-CB 3.96Å; I73-L99 HydrophobicContact CD1-CD1 4.24Å; I73-W103 HydrophobicContact CD1-CE3 3.58Å; I73-W103 HydrophobicContact CD1-CZ3 3.82Å; I73-Y104 HydrophobicContact CG1-CD2 4.04Å; I73-Y104 HydrophobicContact CG2-CD2 4.27Å; I73-Y104 HydrophobicContact CG2-CG 4.14Å
74	C	91.9	Very high	86.4	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	157.7	178.7	-49.5	0	0	0	0	110.5	L38 N77 L99 D100 V101 L122	L38-C74 HydrophobicContact CD2-CB 4.38Å; L38-C74 VanDerWaalsContact CD2-SG 3.57Å; C74-N77 HydrophobicContact CB-CB 3.82Å; C74-L99 PolarHBondContact N-O 3.12Å; C74-D100 CarbonylContact O-C 3.59Å; C74-V101 PolarHBondContact O-N 3.42Å; C74-L122 HydrophobicContact CB-CD1 4.11Å; C74-L122 HydrophobicContact CB-CD2 3.96Å
75	E	88.6	Confident	86.3	Confident	27 Å²	27	45.8 Å²	45.8	13%	0.126	23%	0.229	C	C	.	.	S	Bend	trans	-131	126.2	173.9	-178.5	171.4	-91.6	0	0	109.1	M42 R46 N77 V101	M42-E75 HydrophobicContact CB-CB 4.19Å; M42-E75 HydrophobicContact CE-CB 3.94Å; M42-E75 HydrophobicContact CG-CB 4.35Å; R46-E75 WeakPolarHBondContact CD-OE2 3.48Å; R46-E75 IonicContact CZ-OE1 3.81Å; R46-E75 IonicContact CZ-OE2 3.62Å; R46-E75 IonicContact NE-OE1 2.76Å; R46-E75 PolarHBondContact NE-OE1 3.39Å; R46-E75 IonicContact NE-OE2 3.08Å; R46-E75 PolarHBondContact NE-OE2 3.18Å; R46-E75 IonicContact NH2-OE1 3.59Å; R46-E75 PolarHBondContact NH2-OE1 3.46Å; R46-E75 IonicContact NH2-OE2 2.73Å; E75-N77 PolarHBondContact O-N 3.22Å; E75-N77 VanDerWaalsContact O-N 3.15Å; E75-N77 PolarHBondContact O-OD1 2.96Å; E75-V101 HydrophobicContact CB-CB 4.11Å; E75-V101 HydrophobicContact CB-CG1 4.27Å; E75-V101 HydrophobicContact CG-CB 4.31Å; E75-V101 HydrophobicContact CG-CG1 3.95Å
76	S	80.8	Confident	86.2	Confident	89 Å²	89	44.2 Å²	44.2	62%	0.622	22%	0.222	S	C	*	.	S	Bend	trans	59.5	19.7	-177.7	-50	0	0	0	0	114.7	K41	K41-S76 WeakPolarHBondContact CD-O 3.48Å; K41-S76 PolarHBondContact NZ-O 3.43Å
77	N	83.6	Confident	86.1	Confident	11 Å²	11	47.4 Å²	47.4	6%	0.059	23%	0.234	C	C	.	.			trans	-100.4	149.2	174.4	-66.7	112.3	0	0	0	111.8	C74 E75 E81	C74-N77 HydrophobicContact CB-CB 3.82Å; E75-N77 PolarHBondContact O-N 3.22Å; E75-N77 VanDerWaalsContact O-N 3.15Å; E75-N77 PolarHBondContact O-OD1 2.96Å; N77-E81 VanDerWaalsContact CA-OE2 3.24Å; N77-E81 WeakPolarHBondContact CA-OE2 3.41Å; N77-E81 PolarHBondContact ND2-OE2 2.95Å
78	T	83.3	Confident	85.9	Confident	28 Å²	28	42.4 Å²	42.4	17%	0.172	23%	0.227	C	C	.	.			trans	-82.9	161.7	168.7	70.4	0	0	0	0	111	Q80 E81 A82	T78-Q80 PolarHBondContact O-N 2.82Å; T78-E81 PolarHBondContact N-OE2 2.86Å; T78-E81 PolarHBondContact O-N 3.27Å; T78-E81 WeakPolarHBondContact OG1-CG 3.32Å; T78-E81 PolarHBondContact OG1-N 3.25Å; T78-A82 PolarHBondContact O-N 2.8Å; T78-A82 VanDerWaalsContact O-N 3.15Å
79	A	82.3	Confident	85.5	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.033	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-39.3	174.7	0	0	0	0	0	112.1	A82 R83 L122 Q123 E124	A79-A82 PolarHBondContact O-N 3.4Å; A79-R83 VanDerWaalsContact O-CG 3.27Å; A79-R83 WeakPolarHBondContact O-CG 3.48Å; A79-R83 PolarHBondContact O-N 2.9Å; A79-L122 HydrophobicContact CB-CB 3.88Å; A79-Q123 PolarHBondContact N-O 3.42Å; A79-E124 HydrophobicContact CB-CG 3.88Å
80	Q	80.6	Confident	84.6	Confident	88 Å²	88	45.8 Å²	45.8	41%	0.411	26%	0.258	S	S	.	.	H	α-helix	trans	-66.7	-44.1	178.8	-171.2	177.8	6.5	0	0	112.1	T78 A82 R83 M84	T78-Q80 PolarHBondContact O-N 2.82Å; Q80-A82 VanDerWaalsContact C-N 3.29Å; Q80-A82 PolarHBondContact O-N 3.44Å; Q80-R83 PolarHBondContact O-N 2.91Å; Q80-M84 HydrophobicContact CG-CE 4.35Å; Q80-M84 WeakPolarHBondContact O-CG 3.49Å; Q80-M84 PolarHBondContact O-N 3.38Å
81	E	80.9	Confident	83.3	Confident	41 Å²	41	44.7 Å²	44.7	19%	0.192	25%	0.253	C	S	.	.	H	α-helix	trans	-58.2	-42.2	175.9	-77.2	176	176.1	0	0	112	R40 K41 N77 T78 W85	R40-E81 PolarHBondContact NH1-O 2.83Å; R40-E81 VanDerWaalsContact NH1-O 3.15Å; K41-E81 VanDerWaalsContact NZ-CD 3.31Å; K41-E81 IonicContact NZ-OE1 3.11Å; K41-E81 PolarHBondContact NZ-OE1 2.81Å; K41-E81 IonicContact NZ-OE2 2.7Å; K41-E81 PolarHBondContact NZ-OE2 3.41Å; N77-E81 VanDerWaalsContact CA-OE2 3.24Å; N77-E81 WeakPolarHBondContact CA-OE2 3.41Å; N77-E81 PolarHBondContact ND2-OE2 2.95Å; T78-E81 PolarHBondContact N-OE2 2.86Å; T78-E81 PolarHBondContact O-N 3.27Å; T78-E81 WeakPolarHBondContact OG1-CG 3.32Å; T78-E81 PolarHBondContact OG1-N 3.25Å; E81-W85 PolarHBondContact O-N 3Å
82	A	85.4	Confident	81.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-69.1	-39.8	178.6	0	0	0	0	0	112.1	T78 A79 Q80 W85 L86 L98 L122	T78-A82 PolarHBondContact O-N 2.8Å; T78-A82 VanDerWaalsContact O-N 3.15Å; A79-A82 PolarHBondContact O-N 3.4Å; Q80-A82 VanDerWaalsContact C-N 3.29Å; Q80-A82 PolarHBondContact O-N 3.44Å; A82-W85 PolarHBondContact O-N 3.13Å; A82-L86 WeakPolarHBondContact O-CG 3.39Å; A82-L86 PolarHBondContact O-N 3.35Å; A82-L86 VanDerWaalsContact O-N 3.07Å; A82-L98 HydrophobicContact CB-CD1 4.22Å; A82-L98 HydrophobicContact CB-CD2 4Å; A82-L122 HydrophobicContact CB-CD1 3.64Å
83	R	85.4	Confident	80.1	Confident	90 Å²	90	52.5 Å²	52.5	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-49.4	176.2	-73.8	173.3	-172.1	147.5	3.5	112.2	A79 Q80 W85 L86 E87 L98 E124	A79-R83 VanDerWaalsContact O-CG 3.27Å; A79-R83 WeakPolarHBondContact O-CG 3.48Å; A79-R83 PolarHBondContact O-N 2.9Å; Q80-R83 PolarHBondContact O-N 2.91Å; R83-W85 PolarHBondContact O-N 3.01Å; R83-L86 WeakPolarHBondContact O-CB 3.43Å; R83-L86 PolarHBondContact O-N 3Å; R83-L86 VanDerWaalsContact O-N 3.08Å; R83-E87 WeakPolarHBondContact O-CG 3.32Å; R83-E87 PolarHBondContact O-N 3.33Å; R83-L98 HydrophobicContact CG-CD1 3.61Å; R83-E124 IonicContact CZ-OE1 2.93Å; R83-E124 VanDerWaalsContact CZ-OE1 3.26Å; R83-E124 IonicContact NH1-OE1 2.92Å; R83-E124 PolarHBondContact NH1-OE1 3.49Å; R83-E124 IonicContact NH2-OE1 3.34Å; R83-E124 PolarHBondContact NH2-OE1 2.94Å
84	M	82	Confident	78.4	Confident	97 Å²	97	56.9 Å²	56.9	48%	0.478	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-38.5	177.7	-72.4	-169.1	-63	0	0	111.7	Q80 E87 A88	Q80-M84 HydrophobicContact CG-CE 4.35Å; Q80-M84 WeakPolarHBondContact O-CG 3.49Å; Q80-M84 PolarHBondContact O-N 3.38Å; M84-E87 PolarHBondContact O-N 2.99Å; M84-A88 WeakPolarHBondContact O-CB 3.43Å; M84-A88 PolarHBondContact O-N 3.15Å
85	W	85.4	Confident	77.3	Confident	53 Å²	53	60.5 Å²	60.5	20%	0.201	38%	0.378	C	S	.	.	H	α-helix	trans	-64.1	-45.2	175.5	-177.7	88.7	0	0	0	111.8	F36 L38 F65 E81 A82 R83 E87 A88 Q89	F36-W85 HydrophobicContact CD1-CH2 4.33Å; F36-W85 HydrophobicContact CD1-CZ3 4.45Å; F36-W85 AromaticContact CE1-CH2 3.34Å; F36-W85 HydrophobicContact CE1-CH2 3.34Å; F36-W85 HydrophobicContact CE1-CZ2 4.11Å; F36-W85 AromaticContact CE1-CZ3 3.77Å; F36-W85 HydrophobicContact CE1-CZ3 3.77Å; F36-W85 AromaticContact CZ-CH2 3.62Å; F36-W85 HydrophobicContact CZ-CH2 3.62Å; F36-W85 HydrophobicContact CZ-CZ2 4.15Å; F36-W85 HydrophobicContact CZ-CZ3 4.48Å; L38-W85 HydrophobicContact CD1-CD2 3.49Å; L38-W85 VanDerWaalsContact CD1-CD2 3.49Å; L38-W85 HydrophobicContact CD1-CE3 3.76Å; L38-W85 HydrophobicContact CD1-CG 3.98Å; L38-W85 HydrophobicContact CD1-CH2 4.1Å; L38-W85 HydrophobicContact CD1-CZ2 3.84Å; L38-W85 HydrophobicContact CD1-CZ3 4.06Å; F65-W85 HydrophobicContact CB-CH2 3.82Å; F65-W85 HydrophobicContact CB-CZ3 4.47Å; F65-W85 HydrophobicContact CD2-CH2 4.13Å; F65-W85 AromaticContact CD2-CZ3 3.96Å; F65-W85 HydrophobicContact CD2-CZ3 3.96Å; F65-W85 HydrophobicContact CE2-CZ3 4.43Å; F65-W85 AromaticContact CG-CH2 3.94Å; F65-W85 HydrophobicContact CG-CH2 3.94Å; F65-W85 HydrophobicContact CG-CZ3 4.1Å; E81-W85 PolarHBondContact O-N 3Å; A82-W85 PolarHBondContact O-N 3.13Å; R83-W85 PolarHBondContact O-N 3.01Å; W85-E87 VanDerWaalsContact C-N 3.34Å; W85-E87 PolarHBondContact O-N 3.43Å; W85-A88 PolarHBondContact O-N 2.95Å; W85-Q89 HydrophobicContact CD2-CG 4.21Å; W85-Q89 HydrophobicContact CE3-CG 4.24Å; W85-Q89 HydrophobicContact CH2-CG 3.87Å; W85-Q89 HydrophobicContact CZ2-CG 3.84Å; W85-Q89 HydrophobicContact CZ3-CG 4.08Å; W85-Q89 WeakPolarHBondContact O-CG 3.5Å; W85-Q89 PolarHBondContact O-N 3.32Å
86	L	85.1	Confident	77.1	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.068	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-41.7	176.9	-74.1	172.1	0	0	0	112.5	F65 V72 A82 R83 A88 Q89 A91 L98	F65-L86 HydrophobicContact CD2-CD2 4.24Å; F65-L86 HydrophobicContact CE1-CD2 4.22Å; F65-L86 HydrophobicContact CE2-CD2 3.42Å; F65-L86 VanDerWaalsContact CE2-CD2 3.42Å; F65-L86 HydrophobicContact CZ-CD2 3.41Å; F65-L86 VanDerWaalsContact CZ-CD2 3.41Å; V72-L86 HydrophobicContact CG2-CD2 4.29Å; A82-L86 WeakPolarHBondContact O-CG 3.39Å; A82-L86 PolarHBondContact O-N 3.35Å; A82-L86 VanDerWaalsContact O-N 3.07Å; R83-L86 WeakPolarHBondContact O-CB 3.43Å; R83-L86 PolarHBondContact O-N 3Å; R83-L86 VanDerWaalsContact O-N 3.08Å; L86-A88 VanDerWaalsContact C-N 3.35Å; L86-Q89 PolarHBondContact O-N 2.88Å; L86-Q89 VanDerWaalsContact O-N 3.14Å; L86-A91 WeakPolarHBondContact O-CB 3.35Å; L86-A91 PolarHBondContact O-N 3.27Å; L86-A91 VanDerWaalsContact O-N 3.13Å; L86-L98 HydrophobicContact CD1-CD1 4.39Å; L86-L98 HydrophobicContact CD1-CD2 3.55Å; L86-L98 HydrophobicContact CD1-CG 4.32Å
87	E	83.1	Confident	77.5	Confident	102 Å²	102	62 Å²	62	48%	0.477	37%	0.373	S	S	.	.	H	α-helix	trans	-62.5	-42	177.1	-73.2	169	-172.1	0	0	111.4	R83 M84 W85 Q89 G90 Q93	R83-E87 WeakPolarHBondContact O-CG 3.32Å; R83-E87 PolarHBondContact O-N 3.33Å; M84-E87 PolarHBondContact O-N 2.99Å; W85-E87 VanDerWaalsContact C-N 3.34Å; W85-E87 PolarHBondContact O-N 3.43Å; E87-Q89 PolarHBondContact O-N 3.47Å; E87-G90 PolarHBondContact O-N 2.86Å; E87-Q93 PolarHBondContact OE1-NE2 3.2Å
88	A	80.4	Confident	77.9	Confident	81 Å²	81	62.9 Å²	62.9	67%	0.669	38%	0.377	S	S	*	.	H	α-helix	trans	-63.3	-25.8	175	0	0	0	0	0	113.4	M84 W85 L86 G90	M84-A88 WeakPolarHBondContact O-CB 3.43Å; M84-A88 PolarHBondContact O-N 3.15Å; W85-A88 PolarHBondContact O-N 2.95Å; L86-A88 VanDerWaalsContact C-N 3.35Å; A88-G90 PolarHBondContact O-N 3.4Å
89	Q	78.5	Confident	78.3	Confident	108 Å²	108	61.7 Å²	61.7	51%	0.505	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4	173.3	-59.8	-54.1	-49.7	0	0	113.3	F65 W85 L86 E87 A91	F65-Q89 HydrophobicContact CD1-CB 4.36Å; W85-Q89 HydrophobicContact CD2-CG 4.21Å; W85-Q89 HydrophobicContact CE3-CG 4.24Å; W85-Q89 HydrophobicContact CH2-CG 3.87Å; W85-Q89 HydrophobicContact CZ2-CG 3.84Å; W85-Q89 HydrophobicContact CZ3-CG 4.08Å; W85-Q89 WeakPolarHBondContact O-CG 3.5Å; W85-Q89 PolarHBondContact O-N 3.32Å; L86-Q89 PolarHBondContact O-N 2.88Å; L86-Q89 VanDerWaalsContact O-N 3.14Å; E87-Q89 PolarHBondContact O-N 3.47Å; Q89-A91 VanDerWaalsContact C-N 3.26Å; Q89-A91 PolarHBondContact O-N 2.95Å
90	G	69.9	Low	78.8	Confident	73 Å²	73	63.6 Å²	63.6	75%	0.753	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	21.5	-177.3	0	0	0	0	0	113.5	E87 A88	E87-G90 PolarHBondContact O-N 2.86Å; A88-G90 PolarHBondContact O-N 3.4Å
91	A	64.4	Low	79.4	Confident	16 Å²	16	60.2 Å²	60.2	13%	0.132	37%	0.365	C	S	.	.			trans	-96.3	117.4	-178.5	0	0	0	0	0	110.6	F65 L86 Q89	F65-A91 HydrophobicContact CE1-CB 3.51Å; F65-A91 HydrophobicContact CZ-CB 3.81Å; L86-A91 WeakPolarHBondContact O-CB 3.35Å; L86-A91 PolarHBondContact O-N 3.27Å; L86-A91 VanDerWaalsContact O-N 3.13Å; Q89-A91 VanDerWaalsContact C-N 3.26Å; Q89-A91 PolarHBondContact O-N 2.95Å
92	G	60	Low	80	Confident	55 Å²	55	59.7 Å²	59.7	57%	0.567	37%	0.366	S	S	*	.			trans	-65.7	147.2	172	0	0	0	0	0	112.1	A94 R96	G92-A94 PolarHBondContact O-N 3.37Å; G92-R96 PolarHBondContact O-NH1 3.11Å
93	Q	57.6	Low	80.5	Confident	125 Å²	125	59.7 Å²	59.7	58%	0.584	37%	0.365	S	S	*	.			trans	-65.8	-17	-174.5	-64.1	-176.9	-5.6	0	0	114.9	E87 G95	E87-Q93 PolarHBondContact OE1-NE2 3.2Å; Q93-G95 PolarHBondContact O-N 2.97Å; Q93-G95 VanDerWaalsContact O-N 3.1Å
94	A	57.8	Low	80.9	Confident	92 Å²	92	55.5 Å²	55.5	76%	0.76	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	113.4	-165.3	0	0	0	0	0	113.1	G92	G92-A94 PolarHBondContact O-N 3.37Å
95	G	68.3	Low	81.5	Confident	76 Å²	76	54.5 Å²	54.5	78%	0.784	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	14.3	162.5	0	0	0	0	0	117.7	Q93	Q93-G95 PolarHBondContact O-N 2.97Å; Q93-G95 VanDerWaalsContact O-N 3.1Å
96	R	84.9	Confident	81.9	Confident	62 Å²	62	53.6 Å²	53.6	23%	0.234	35%	0.347	C	S	.	.			trans	-107.9	143.2	-179.5	-62.2	-178.6	179.4	77.8	10.3	112.6	K67 V69 G92	K67-R96 PolarHBondContact O-NH2 2.91Å; V69-R96 WeakPolarHBondContact O-CD 2.97Å; V69-R96 PolarHBondContact O-NE 3.45Å; G92-R96 PolarHBondContact O-NH1 3.11Å
97	H	89.6	Confident	82.3	Confident	86 Å²	86	53 Å²	53	40%	0.398	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.4	175.5	-61.3	-68.8	0	0	0	110.7	T70 H71 V72 L99 I116	T70-H97 PolarHBondContact O-N 3.42Å; H71-H97 WeakPolarHBondContact CA-O 3.41Å; H71-H97 AromaticContact CE1-CD2 3.73Å; H71-H97 AromaticContact NE2-CD2 3.66Å; V72-H97 PolarHBondContact N-O 3Å; H97-L99 HydrophobicContact CB-CD1 4.1Å; H97-L99 HydrophobicContact CB-CD2 4.27Å; H97-L99 HydrophobicContact CB-CG 4.01Å; H97-I116 HydrophobicContact CB-CD1 3.99Å; H97-I116 VanDerWaalsContact CG-CD1 3.48Å
98	L	90.8	Very high	82.9	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.157	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	110.6	170	-70.3	177.6	0	0	0	109	V72 A82 R83 L86 L122	V72-L98 HydrophobicContact CB-CD2 3.76Å; V72-L98 HydrophobicContact CG1-CD2 4.01Å; V72-L98 HydrophobicContact CG2-CD2 4.29Å; A82-L98 HydrophobicContact CB-CD1 4.22Å; A82-L98 HydrophobicContact CB-CD2 4Å; R83-L98 HydrophobicContact CG-CD1 3.61Å; L86-L98 HydrophobicContact CD1-CD1 4.39Å; L86-L98 HydrophobicContact CD1-CD2 3.55Å; L86-L98 HydrophobicContact CD1-CG 4.32Å; L98-L122 HydrophobicContact CB-CD1 4.06Å
99	L	92.9	Very high	83.5	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.5	-169.6	-57	177	0	0	0	111.8	V72 I73 C74 H97 W103 I116 H120	V72-L99 PolarHBondContact O-N 3.3Å; I73-L99 WeakPolarHBondContact CA-O 3.32Å; I73-L99 HydrophobicContact CD1-CB 3.96Å; I73-L99 HydrophobicContact CD1-CD1 4.24Å; C74-L99 PolarHBondContact N-O 3.12Å; H97-L99 HydrophobicContact CB-CD1 4.1Å; H97-L99 HydrophobicContact CB-CD2 4.27Å; H97-L99 HydrophobicContact CB-CG 4.01Å; L99-W103 HydrophobicContact CB-CB 4.24Å; L99-W103 HydrophobicContact CD1-CB 4.21Å; L99-W103 HydrophobicContact CD1-CD2 3.5Å; L99-W103 VanDerWaalsContact CD1-CD2 3.5Å; L99-W103 HydrophobicContact CD1-CE3 3.79Å; L99-W103 HydrophobicContact CD1-CG 3.68Å; L99-W103 HydrophobicContact CD1-CZ3 4.41Å; L99-I116 HydrophobicContact CD1-CD1 4.01Å; L99-I116 HydrophobicContact CD1-CG1 4.15Å; L99-I116 HydrophobicContact CD2-CD1 4.31Å; L99-I116 HydrophobicContact CD2-CG1 4.36Å; L99-I116 HydrophobicContact CD2-CG2 3.6Å; L99-H120 CarbonylContact C-O 3.53Å; L99-H120 VanDerWaalsContact CA-O 3.27Å; L99-H120 WeakPolarHBondContact CA-O 3.29Å; L99-H120 HydrophobicContact CD2-CB 4.45Å; L99-H120 WeakPolarHBondContact CD2-O 3.42Å
100	D	92.6	Very high	84.1	Confident	44 Å²	44	51 Å²	51	24%	0.235	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	155.9	168.1	179.5	-103.1	0	0	0	111	C74 S102 W103 H120 L122	C74-D100 CarbonylContact O-C 3.59Å; D100-S102 PolarHBondContact O-N 2.9Å; D100-S102 VanDerWaalsContact O-N 3.08Å; D100-S102 WeakPolarHBondContact OD1-CB 3.39Å; D100-S102 PolarHBondContact OD1-N 3.46Å; D100-S102 PolarHBondContact OD1-OG 2.83Å; D100-W103 PolarHBondContact O-N 3.15Å; D100-W103 VanDerWaalsContact O-N 3.13Å; D100-H120 PolarHBondContact N-O 3.24Å; D100-L122 HydrophobicContact CB-CD2 3.95Å
101	V	93.3	Very high	85.1	Confident	17 Å²	17	48.9 Å²	48.9	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-21.3	178.7	73.1	0	0	0	0	113	L50 C74 E75 W103 Y104 T105	L50-V101 HydrophobicContact CD1-CG2 4.3Å; C74-V101 PolarHBondContact O-N 3.42Å; E75-V101 HydrophobicContact CB-CB 4.11Å; E75-V101 HydrophobicContact CB-CG1 4.27Å; E75-V101 HydrophobicContact CG-CB 4.31Å; E75-V101 HydrophobicContact CG-CG1 3.95Å; V101-W103 PolarHBondContact O-N 3.12Å; V101-Y104 WeakPolarHBondContact O-CB 3.3Å; V101-Y104 PolarHBondContact O-N 3Å; V101-T105 WeakPolarHBondContact O-CB 3.43Å; V101-T105 PolarHBondContact O-N 2.94Å; V101-T105 PolarHBondContact O-OG1 2.95Å
102	S	92.5	Very high	86.4	Confident	31 Å²	31	52.6 Å²	52.6	22%	0.217	31%	0.308	C	S	.	.	H	α-helix	trans	-54.2	-47.7	172	51.9	0	0	0	0	112.6	D100 Y104 T105 E106	D100-S102 PolarHBondContact O-N 2.9Å; D100-S102 VanDerWaalsContact O-N 3.08Å; D100-S102 WeakPolarHBondContact OD1-CB 3.39Å; D100-S102 PolarHBondContact OD1-N 3.46Å; D100-S102 PolarHBondContact OD1-OG 2.83Å; S102-Y104 VanDerWaalsContact C-N 3.28Å; S102-Y104 PolarHBondContact O-N 3.39Å; S102-T105 PolarHBondContact O-N 3.21Å; S102-T105 VanDerWaalsContact O-N 3.16Å; S102-E106 WeakPolarHBondContact O-CG 3.19Å; S102-E106 PolarHBondContact O-N 3.28Å
103	W	95.5	Very high	87.9	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-43	177.3	-179.4	82	0	0	0	112.1	V33 L35 H71 I73 L99 D100 V101 T105 E106 S107 P113 V114 H120	V33-W103 HydrophobicContact CG1-CH2 4.09Å; L35-W103 HydrophobicContact CD2-CH2 3.98Å; L35-W103 HydrophobicContact CD2-CZ3 3.73Å; H71-W103 AromaticContact CD2-CH2 3.65Å; H71-W103 AromaticContact CD2-CZ2 3.81Å; H71-W103 AromaticContact NE2-CZ2 3.97Å; I73-W103 HydrophobicContact CD1-CE3 3.58Å; I73-W103 HydrophobicContact CD1-CZ3 3.82Å; L99-W103 HydrophobicContact CB-CB 4.24Å; L99-W103 HydrophobicContact CD1-CB 4.21Å; L99-W103 HydrophobicContact CD1-CD2 3.5Å; L99-W103 VanDerWaalsContact CD1-CD2 3.5Å; L99-W103 HydrophobicContact CD1-CE3 3.79Å; L99-W103 HydrophobicContact CD1-CG 3.68Å; L99-W103 HydrophobicContact CD1-CZ3 4.41Å; D100-W103 PolarHBondContact O-N 3.15Å; D100-W103 VanDerWaalsContact O-N 3.13Å; V101-W103 PolarHBondContact O-N 3.12Å; W103-T105 VanDerWaalsContact C-N 3.33Å; W103-E106 PolarHBondContact O-N 3.06Å; W103-S107 WeakPolarHBondContact O-CB 3.16Å; W103-S107 PolarHBondContact O-N 2.76Å; W103-S107 PolarHBondContact O-OG 3.03Å; W103-P113 HydrophobicContact CH2-CB 4.38Å; W103-P113 HydrophobicContact CZ2-CB 4.02Å; W103-V114 HydrophobicContact CG-CG2 4.5Å; W103-V114 PolarHBondContact NE1-O 3.23Å; W103-H120 HydrophobicContact CB-CB 3.77Å; W103-H120 AromaticContact CD1-CG 3.72Å; W103-H120 AromaticContact CD1-ND1 3.51Å; W103-H120 HydrophobicContact CG-CB 4.24Å
104	Y	95	Very high	89.7	Confident	1 Å²	1	46.4 Å²	46.4	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-46.2	178.7	-179.7	-83.9	0	0	0	110.1	L35 L37 L50 G54 I73 V101 S102 S107 M108	L35-Y104 HydrophobicContact CD1-CD2 3.93Å; L35-Y104 HydrophobicContact CD1-CE2 3.71Å; L37-Y104 HydrophobicContact CD2-CD2 4.26Å; L37-Y104 HydrophobicContact CD2-CE2 4.22Å; L50-Y104 HydrophobicContact CB-CE1 4.12Å; L50-Y104 HydrophobicContact CD2-CD1 4.17Å; L50-Y104 HydrophobicContact CD2-CE1 3.72Å; L50-Y104 HydrophobicContact CG-CE1 4.41Å; L50-Y104 PolarHBondContact O-OH 2.96Å; G54-Y104 WeakPolarHBondContact CA-OH 3.43Å; G54-Y104 PolarHBondContact N-OH 3.05Å; I73-Y104 HydrophobicContact CG1-CD2 4.04Å; I73-Y104 HydrophobicContact CG2-CD2 4.27Å; I73-Y104 HydrophobicContact CG2-CG 4.14Å; V101-Y104 WeakPolarHBondContact O-CB 3.3Å; V101-Y104 PolarHBondContact O-N 3Å; S102-Y104 VanDerWaalsContact C-N 3.28Å; S102-Y104 PolarHBondContact O-N 3.39Å; Y104-S107 PolarHBondContact O-N 3.01Å; Y104-M108 HydrophobicContact CD1-CE 4.45Å; Y104-M108 HydrophobicContact CD1-CG 3.94Å; Y104-M108 HydrophobicContact CD2-CE 3.79Å; Y104-M108 HydrophobicContact CE1-CE 3.98Å; Y104-M108 HydrophobicContact CE1-CG 3.44Å; Y104-M108 VanDerWaalsContact CE1-CG 3.44Å; Y104-M108 HydrophobicContact CE1-SD 4.33Å; Y104-M108 HydrophobicContact CE2-CE 3.3Å; Y104-M108 HydrophobicContact CG-CE 4.33Å; Y104-M108 VanDerWaalsContact O-CG 3.28Å; Y104-M108 WeakPolarHBondContact O-CG 3.48Å; Y104-M108 PolarHBondContact O-N 3.18Å
105	T	93.4	Very high	91.4	Very high	77 Å²	77	49.4 Å²	49.4	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-44.4	-179.3	-54.5	0	0	0	0	111.7	V101 S102 W103 M108 R109	V101-T105 WeakPolarHBondContact O-CB 3.43Å; V101-T105 PolarHBondContact O-N 2.94Å; V101-T105 PolarHBondContact O-OG1 2.95Å; S102-T105 PolarHBondContact O-N 3.21Å; S102-T105 VanDerWaalsContact O-N 3.16Å; W103-T105 VanDerWaalsContact C-N 3.33Å; T105-M108 PolarHBondContact O-N 2.78Å; T105-R109 WeakPolarHBondContact O-CB 3.3Å; T105-R109 PolarHBondContact O-N 2.81Å
106	E	94.1	Very high	92.5	Very high	33 Å²	33	47.9 Å²	47.9	15%	0.154	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-43.8	175.3	-68.8	-172.1	-156.8	0	0	111.4	S102 W103 M108 R109 D110 V114 R119 H120	S102-E106 WeakPolarHBondContact O-CG 3.19Å; S102-E106 PolarHBondContact O-N 3.28Å; W103-E106 PolarHBondContact O-N 3.06Å; E106-M108 VanDerWaalsContact C-N 3.34Å; E106-M108 PolarHBondContact O-N 3.27Å; E106-R109 WeakPolarHBondContact O-CB 3.2Å; E106-R109 PolarHBondContact O-N 3.39Å; E106-D110 PolarHBondContact O-N 2.67Å; E106-V114 HydrophobicContact CB-CG1 4.49Å; E106-V114 HydrophobicContact CB-CG2 4.02Å; E106-R119 IonicContact OE1-CZ 3.57Å; E106-R119 IonicContact OE1-NE 2.84Å; E106-R119 PolarHBondContact OE1-NE 2.95Å; E106-R119 IonicContact OE1-NH2 3.5Å; E106-R119 PolarHBondContact OE1-NH2 3.36Å; E106-R119 IonicContact OE2-CZ 3.66Å; E106-R119 IonicContact OE2-NE 2.83Å; E106-R119 IonicContact OE2-NH2 3.61Å; E106-R119 PolarHBondContact OE2-NH2 2.8Å; E106-H120 IonicContact OE1-NE2 2.84Å; E106-H120 PolarHBondContact OE1-NE2 2.94Å; E106-H120 IonicContact OE2-CE1 3.21Å; E106-H120 PolarHBondContact OE2-CE1 3.42Å; E106-H120 IonicContact OE2-NE2 2.72Å; E106-H120 PolarHBondContact OE2-NE2 2.75Å
107	S	93.9	Very high	92.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-37.3	176.6	-60.6	0	0	0	0	113.1	W103 Y104 G111 H112 V114	W103-S107 WeakPolarHBondContact O-CB 3.16Å; W103-S107 PolarHBondContact O-N 2.76Å; W103-S107 PolarHBondContact O-OG 3.03Å; Y104-S107 PolarHBondContact O-N 3.01Å; S107-G111 WeakPolarHBondContact O-CA 3.25Å; S107-G111 PolarHBondContact O-N 3.1Å; S107-H112 WeakPolarHBondContact CA-O 3.45Å; S107-H112 PolarHBondContact O-N 3.3Å; S107-V114 PolarHBondContact OG-N 2.86Å
108	M	95	Very high	92.6	Very high	8 Å²	8	49.7 Å²	49.7	4%	0.039	26%	0.257	C	S	.	.	H	α-helix	trans	-72.3	-33.3	176.3	-65.2	-46.4	140.1	0	0	112.9	L35 L53 K57 F59 Y104 T105 E106	L35-M108 HydrophobicContact CD1-CE 4.15Å; L53-M108 HydrophobicContact CD2-CB 4.23Å; L53-M108 HydrophobicContact CD2-CG 4.08Å; L53-M108 HydrophobicContact CG-CB 4.44Å; L53-M108 HydrophobicContact CG-CG 4.13Å; K57-M108 HydrophobicContact CB-SD 3.79Å; K57-M108 VanDerWaalsContact CE-O 3.29Å; K57-M108 WeakPolarHBondContact CE-O 3.41Å; K57-M108 HydrophobicContact CG-SD 3.9Å; K57-M108 PolarHBondContact NZ-O 3.4Å; F59-M108 HydrophobicContact CD1-CE 4.16Å; F59-M108 HydrophobicContact CD2-CE 3.56Å; F59-M108 HydrophobicContact CD2-SD 3.88Å; F59-M108 HydrophobicContact CE1-CE 4.22Å; F59-M108 HydrophobicContact CE2-CE 3.67Å; F59-M108 HydrophobicContact CE2-SD 3.82Å; F59-M108 HydrophobicContact CG-CE 3.83Å; F59-M108 HydrophobicContact CZ-CE 3.99Å; Y104-M108 HydrophobicContact CD1-CE 4.45Å; Y104-M108 HydrophobicContact CD1-CG 3.94Å; Y104-M108 HydrophobicContact CD2-CE 3.79Å; Y104-M108 HydrophobicContact CE1-CE 3.98Å; Y104-M108 HydrophobicContact CE1-CG 3.44Å; Y104-M108 VanDerWaalsContact CE1-CG 3.44Å; Y104-M108 HydrophobicContact CE1-SD 4.33Å; Y104-M108 HydrophobicContact CE2-CE 3.3Å; Y104-M108 HydrophobicContact CG-CE 4.33Å; Y104-M108 VanDerWaalsContact O-CG 3.28Å; Y104-M108 WeakPolarHBondContact O-CG 3.48Å; Y104-M108 PolarHBondContact O-N 3.18Å; T105-M108 PolarHBondContact O-N 2.78Å; E106-M108 VanDerWaalsContact C-N 3.34Å; E106-M108 PolarHBondContact O-N 3.27Å
109	R	93.4	Very high	92.4	Very high	166 Å²	166	55.3 Å²	55.3	63%	0.626	28%	0.276	S	S	*	.	H	α-helix	trans	-65.2	-50.1	175.4	-177.6	-176.3	64.4	-156	-6.8	110.6	T105 E106 G111	T105-R109 WeakPolarHBondContact O-CB 3.3Å; T105-R109 PolarHBondContact O-N 2.81Å; E106-R109 WeakPolarHBondContact O-CB 3.2Å; E106-R109 PolarHBondContact O-N 3.39Å; R109-G111 VanDerWaalsContact C-N 3.33Å
110	D	91.1	Very high	92.3	Very high	77 Å²	77	55.2 Å²	55.2	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-83.3	-15.2	-173.9	-61.3	6.7	0	0	0	111.8	E106 H112 V114	E106-D110 PolarHBondContact O-N 2.67Å; D110-H112 VanDerWaalsContact C-N 3.3Å; D110-H112 PolarHBondContact O-CD2 3.13Å; D110-H112 PolarHBondContact O-N 3.03Å; D110-V114 HydrophobicContact CB-CG1 4.16Å
111	G	90.6	Very high	92.1	Very high	27 Å²	27	57.8 Å²	57.8	28%	0.278	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	7.9	173.2	0	0	0	0	0	114.6	F30 S107 R109	F30-G111 WeakPolarHBondContact CZ-O 3.49Å; S107-G111 WeakPolarHBondContact O-CA 3.25Å; S107-G111 PolarHBondContact O-N 3.1Å; R109-G111 VanDerWaalsContact C-N 3.33Å
112	H	92	Very high	91.7	Very high	94 Å²	94	57.5 Å²	57.5	44%	0.435	28%	0.283	S	S	.	.	S	Bend	trans	-144.1	160.4	173.4	62.4	77	0	0	0	110	F30 S107 D110 V114	F30-H112 HydrophobicContact CE1-CB 4Å; F30-H112 HydrophobicContact CZ-CB 3.82Å; S107-H112 WeakPolarHBondContact CA-O 3.45Å; S107-H112 PolarHBondContact O-N 3.3Å; D110-H112 VanDerWaalsContact C-N 3.3Å; D110-H112 PolarHBondContact O-CD2 3.13Å; D110-H112 PolarHBondContact O-N 3.03Å; H112-V114 PolarHBondContact O-N 2.8Å
113	P	92.8	Very high	90.9	Very high	32 Å²	32	62.4 Å²	62.4	21%	0.208	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-58.1	122.3	172.7	-16.7	26.5	0	0	0	109.6	F30 V33 F59 W103	F30-P113 HydrophobicContact CB-CG 4.18Å; F30-P113 VanDerWaalsContact CD1-CD 3.5Å; F30-P113 HydrophobicContact CD1-CG 3.94Å; F30-P113 HydrophobicContact CD2-CG 4.29Å; F30-P113 HydrophobicContact CE1-CG 4.44Å; F30-P113 HydrophobicContact CG-CG 3.86Å; V33-P113 HydrophobicContact CB-CG 4.34Å; V33-P113 HydrophobicContact CG2-CB 4.15Å; V33-P113 HydrophobicContact CG2-CG 3.76Å; F59-P113 HydrophobicContact CE1-CB 4.19Å; F59-P113 HydrophobicContact CE1-CG 3.67Å; F59-P113 HydrophobicContact CZ-CG 4.18Å; W103-P113 HydrophobicContact CH2-CB 4.38Å; W103-P113 HydrophobicContact CZ2-CB 4.02Å
114	V	93.8	Very high	89.2	Confident	19 Å²	19	68.7 Å²	68.7	12%	0.115	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-83.7	160.2	174.7	-60.6	0	0	0	0	110.5	W103 E106 S107 D110 H112 I116	W103-V114 HydrophobicContact CG-CG2 4.5Å; W103-V114 PolarHBondContact NE1-O 3.23Å; E106-V114 HydrophobicContact CB-CG1 4.49Å; E106-V114 HydrophobicContact CB-CG2 4.02Å; S107-V114 PolarHBondContact OG-N 2.86Å; D110-V114 HydrophobicContact CB-CG1 4.16Å; H112-V114 PolarHBondContact O-N 2.8Å; V114-I116 PolarHBondContact O-N 2.84Å
115	E	93.1	Very high	87.1	Confident	155 Å²	155	74.8 Å²	74.8	72%	0.724	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-57.7	137.6	174.3	-170.7	177.8	178.5	0	0	111.1	L117 H120	E115-L117 HydrophobicContact CG-CD2 4.35Å; E115-L117 PolarHBondContact O-N 2.91Å; E115-H120 PolarHBondContact O-CE1 2.97Å; E115-H120 PolarHBondContact O-ND1 3.17Å; E115-H120 VanDerWaalsContact O-ND1 3.11Å
116	I	92.6	Very high	84.8	Confident	44 Å²	44	74.9 Å²	74.9	23%	0.226	37%	0.367	C	S	.	.			trans	-78.6	109.1	177.9	-61.7	171.6	0	0	0	108.2	H97 L99 V114 H120 K121	H97-I116 HydrophobicContact CB-CD1 3.99Å; H97-I116 VanDerWaalsContact CG-CD1 3.48Å; L99-I116 HydrophobicContact CD1-CD1 4.01Å; L99-I116 HydrophobicContact CD1-CG1 4.15Å; L99-I116 HydrophobicContact CD2-CD1 4.31Å; L99-I116 HydrophobicContact CD2-CG1 4.36Å; L99-I116 HydrophobicContact CD2-CG2 3.6Å; V114-I116 PolarHBondContact O-N 2.84Å; I116-H120 HydrophobicContact CG2-CB 4.41Å; I116-K121 HydrophobicContact CG2-CG 4.26Å
117	L	91.8	Very high	82.6	Confident	59 Å²	59	76.3 Å²	76.3	31%	0.309	38%	0.378	S	S	.	.			trans	-102	166.9	178.4	-60.6	174.4	0	0	0	109.7	E115 R119 H120	E115-L117 HydrophobicContact CG-CD2 4.35Å; E115-L117 PolarHBondContact O-N 2.91Å; L117-R119 HydrophobicContact CB-CG 4.2Å; L117-R119 VanDerWaalsContact CD1-CZ 3.44Å; L117-R119 PolarHBondContact O-N 2.83Å; L117-H120 PolarHBondContact N-ND1 2.9Å; L117-H120 VanDerWaalsContact O-CB 3.23Å; L117-H120 WeakPolarHBondContact O-CB 3.15Å; L117-H120 PolarHBondContact O-N 2.93Å
118	D	85.3	Confident	80.3	Confident	126 Å²	126	81 Å²	81	67%	0.674	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-63	-30.2	-178.1	-67.5	-35.1	0	0	0	113.1	H120 K121	D118-H120 PolarHBondContact O-N 3.36Å; D118-K121 PolarHBondContact O-N 3.41Å; D118-K121 IonicContact OD1-NZ 3.73Å; D118-K121 PolarHBondContact OD1-NZ 2.75Å
119	R	86.9	Confident	78	Confident	148 Å²	148	85.8 Å²	85.8	56%	0.558	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.2	172.6	68.6	167.1	-175.5	-91.1	-1.3	114.3	E106 L117	E106-R119 IonicContact OE1-CZ 3.57Å; E106-R119 IonicContact OE1-NE 2.84Å; E106-R119 PolarHBondContact OE1-NE 2.95Å; E106-R119 IonicContact OE1-NH2 3.5Å; E106-R119 PolarHBondContact OE1-NH2 3.36Å; E106-R119 IonicContact OE2-CZ 3.66Å; E106-R119 IonicContact OE2-NE 2.83Å; E106-R119 IonicContact OE2-NH2 3.61Å; E106-R119 PolarHBondContact OE2-NH2 2.8Å; L117-R119 HydrophobicContact CB-CG 4.2Å; L117-R119 VanDerWaalsContact CD1-CZ 3.44Å; L117-R119 PolarHBondContact O-N 2.83Å
120	H	90.3	Very high	76	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-87.4	-17.6	-178.8	-66.4	151.6	0	0	0	112.5	L99 D100 W103 E106 E115 I116 L117 D118	L99-H120 CarbonylContact C-O 3.53Å; L99-H120 VanDerWaalsContact CA-O 3.27Å; L99-H120 WeakPolarHBondContact CA-O 3.29Å; L99-H120 HydrophobicContact CD2-CB 4.45Å; L99-H120 WeakPolarHBondContact CD2-O 3.42Å; D100-H120 PolarHBondContact N-O 3.24Å; W103-H120 HydrophobicContact CB-CB 3.77Å; W103-H120 AromaticContact CD1-CG 3.72Å; W103-H120 AromaticContact CD1-ND1 3.51Å; W103-H120 HydrophobicContact CG-CB 4.24Å; E106-H120 IonicContact OE1-NE2 2.84Å; E106-H120 PolarHBondContact OE1-NE2 2.94Å; E106-H120 IonicContact OE2-CE1 3.21Å; E106-H120 PolarHBondContact OE2-CE1 3.42Å; E106-H120 IonicContact OE2-NE2 2.72Å; E106-H120 PolarHBondContact OE2-NE2 2.75Å; E115-H120 PolarHBondContact O-CE1 2.97Å; E115-H120 PolarHBondContact O-ND1 3.17Å; E115-H120 VanDerWaalsContact O-ND1 3.11Å; I116-H120 HydrophobicContact CG2-CB 4.41Å; L117-H120 PolarHBondContact N-ND1 2.9Å; L117-H120 VanDerWaalsContact O-CB 3.23Å; L117-H120 WeakPolarHBondContact O-CB 3.15Å; L117-H120 PolarHBondContact O-N 2.93Å; D118-H120 PolarHBondContact O-N 3.36Å
121	K	88.7	Confident	74.4	Confident	99 Å²	99	87.3 Å²	87.3	43%	0.43	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-81.4	145.4	179.2	-63.2	173.8	-173	160.1	0	109	I116 D118 Q123	I116-K121 HydrophobicContact CG2-CG 4.26Å; D118-K121 PolarHBondContact O-N 3.41Å; D118-K121 IonicContact OD1-NZ 3.73Å; D118-K121 PolarHBondContact OD1-NZ 2.75Å; K121-Q123 PolarHBondContact O-N 2.81Å
122	L	84.7	Confident	73.3	Confident	11 Å²	11	87.7 Å²	87.7	6%	0.058	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-60.7	130.8	173.5	-61.1	176.9	0	0	0	109.4	C74 A79 A82 L98 D100 E124	C74-L122 HydrophobicContact CB-CD1 4.11Å; C74-L122 HydrophobicContact CB-CD2 3.96Å; A79-L122 HydrophobicContact CB-CB 3.88Å; A82-L122 HydrophobicContact CB-CD1 3.64Å; L98-L122 HydrophobicContact CB-CD1 4.06Å; D100-L122 HydrophobicContact CB-CD2 3.95Å; L122-E124 PolarHBondContact O-N 3.38Å
123	Q	74.3	Confident	72.8	Confident	133 Å²	133	88.6 Å²	88.6	62%	0.621	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-63.8	130.1	179.2	-66.2	-174.7	-3.7	0	0	110	A79 K121 F125	A79-Q123 PolarHBondContact N-O 3.42Å; K121-Q123 PolarHBondContact O-N 2.81Å; Q123-F125 VanDerWaalsContact C-N 3.28Å; Q123-F125 HydrophobicContact CB-CD2 4.1Å; Q123-F125 HydrophobicContact CB-CE2 3.93Å; Q123-F125 PolarHBondContact O-N 2.89Å; Q123-F125 VanDerWaalsContact O-N 3.15Å; Q123-F125 VanDerWaalsContact OE1-CZ 3.26Å
124	E	60.9	Low	72.6	Confident	134 Å²	134	90.5 Å²	90.5	63%	0.626	48%	0.475	S	S	*	.			trans	-82.6	76.1	169	-68.9	-168.5	156.9	0	0	108.7	A79 R83 L122 A126	A79-E124 HydrophobicContact CB-CG 3.88Å; R83-E124 IonicContact CZ-OE1 2.93Å; R83-E124 VanDerWaalsContact CZ-OE1 3.26Å; R83-E124 IonicContact NH1-OE1 2.92Å; R83-E124 PolarHBondContact NH1-OE1 3.49Å; R83-E124 IonicContact NH2-OE1 3.34Å; R83-E124 PolarHBondContact NH2-OE1 2.94Å; L122-E124 PolarHBondContact O-N 3.38Å; E124-A126 VanDerWaalsContact C-N 3.3Å; E124-A126 PolarHBondContact O-N 2.65Å; E124-A126 VanDerWaalsContact O-N 3.14Å
125	F	51.4	Low	72.6	Confident	129 Å²	129	90.8 Å²	90.8	57%	0.566	48%	0.475	S	S	*	.			trans	-72.9	101.8	151.5	-65.7	-71.8	0	0	0	105.5	Q123 V127	Q123-F125 VanDerWaalsContact C-N 3.28Å; Q123-F125 HydrophobicContact CB-CD2 4.1Å; Q123-F125 HydrophobicContact CB-CE2 3.93Å; Q123-F125 PolarHBondContact O-N 2.89Å; Q123-F125 VanDerWaalsContact O-N 3.15Å; Q123-F125 VanDerWaalsContact OE1-CZ 3.26Å; F125-V127 PolarHBondContact O-N 2.85Å
126	A	45.1	Very low	72.5	Confident	79 Å²	79	89.7 Å²	89.7	65%	0.653	48%	0.478	S	S	*	.			trans	-54	104.3	152.4	0	0	0	0	0	104.8	E124 N128	E124-A126 VanDerWaalsContact C-N 3.3Å; E124-A126 PolarHBondContact O-N 2.65Å; E124-A126 VanDerWaalsContact O-N 3.14Å; A126-N128 PolarHBondContact O-N 3.5Å
127	V	46.8	Very low	72.6	Confident	62 Å²	62	88.6 Å²	88.6	38%	0.376	47%	0.474	S	S	.	.			trans	-64	98.3	161.4	-176.6	0	0	0	0	102.4	F125 D129 V132	F125-V127 PolarHBondContact O-N 2.85Å; V127-D129 PolarHBondContact O-N 3.23Å; V127-V132 HydrophobicContact CG1-CG2 4.35Å
128	N	45.8	Very low	72.6	Confident	100 Å²	100	88.6 Å²	88.6	54%	0.535	48%	0.477	S	S	.	.			trans	-60.2	90.9	162.9	-97.5	-10.1	0	0	0	104.4	A126 S130 E131	A126-N128 PolarHBondContact O-N 3.5Å; N128-S130 PolarHBondContact O-N 2.99Å; N128-E131 PolarHBondContact O-N 3.48Å
129	D	47.9	Very low	72.9	Confident	108 Å²	108	85.9 Å²	85.9	58%	0.578	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-52.8	-19.2	169.7	-99.3	-17.7	0	0	0	110.3	V127 E131	V127-D129 PolarHBondContact O-N 3.23Å; D129-E131 VanDerWaalsContact C-N 3.31Å; D129-E131 PolarHBondContact O-N 3.2Å
130	S	49.8	Very low	73.3	Confident	115 Å²	115	86.5 Å²	86.5	80%	0.804	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-66.1	-16.7	172.8	-51.9	0	0	0	0	116	N128	N128-S130 PolarHBondContact O-N 2.99Å
131	E	57.3	Low	73.5	Confident	160 Å²	160	89.4 Å²	89.4	75%	0.748	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-110.7	-0.9	178.6	-90.8	-174.5	163.7	0	0	114.3	N128 D129 T133	N128-E131 PolarHBondContact O-N 3.48Å; D129-E131 VanDerWaalsContact C-N 3.31Å; D129-E131 PolarHBondContact O-N 3.2Å; E131-T133 PolarHBondContact O-N 2.9Å
132	V	68.7	Low	73.9	Confident	34 Å²	34	90.4 Å²	90.4	21%	0.206	51%	0.513	C	S	.	.			trans	-80.2	95.7	178.9	-173.1	0	0	0	0	109.6	V127 P134 S196 Q197	V127-V132 HydrophobicContact CG1-CG2 4.35Å; V132-P134 VanDerWaalsContact O-CD 3.24Å; V132-P134 WeakPolarHBondContact O-CD 3.24Å; V132-S196 VanDerWaalsContact CG1-OG 3.27Å; V132-S196 WeakPolarHBondContact CG1-OG 3.32Å; V132-Q197 HydrophobicContact CG1-CB 4.44Å; V132-Q197 HydrophobicContact CG1-CG 3.31Å
133	T	81.2	Confident	74.4	Confident	114 Å²	114	95.7 Å²	95.7	70%	0.699	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-66.7	118.5	175.1	53	0	0	0	0	110.5	E131	E131-T133 PolarHBondContact O-N 2.9Å
134	P	88.6	Confident	75.4	Confident	71 Å²	71	90.8 Å²	90.8	46%	0.461	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-63.9	146.2	175.9	-21.1	34.1	0	0	0	111.8	V132	V132-P134 VanDerWaalsContact O-CD 3.24Å; V132-P134 WeakPolarHBondContact O-CD 3.24Å
135	F	92.9	Very high	77	Confident	26 Å²	26	95.6 Å²	95.6	11%	0.114	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-68.6	151.2	169.9	-66.3	-64.3	0	0	0	110.3	L188 P189 S190 V192 Q197 L201	F135-L188 HydrophobicContact CB-CD2 3.66Å; F135-L188 HydrophobicContact CD1-CD2 4.16Å; F135-L188 HydrophobicContact CD2-CD1 3.81Å; F135-L188 HydrophobicContact CD2-CD2 4.13Å; F135-L188 HydrophobicContact CE2-CD1 4.07Å; F135-L188 HydrophobicContact CG-CD1 4.27Å; F135-L188 HydrophobicContact CG-CD2 3.73Å; F135-L188 HydrophobicContact CG-CG 4.49Å; F135-P189 HydrophobicContact CD1-CG 4.33Å; F135-P189 HydrophobicContact CE1-CG 4.16Å; F135-S190 WeakPolarHBondContact CE1-OG 3.31Å; F135-S190 WeakPolarHBondContact CZ-OG 3.42Å; F135-V192 HydrophobicContact CD2-CG2 4.48Å; F135-V192 HydrophobicContact CE2-CG2 3.91Å; F135-Q197 HydrophobicContact CD2-CB 3.71Å; F135-Q197 WeakPolarHBondContact CD2-O 3.46Å; F135-Q197 HydrophobicContact CE2-CB 3.64Å; F135-Q197 HydrophobicContact CE2-CG 4.24Å; F135-Q197 PolarHBondContact N-O 2.94Å; F135-L201 HydrophobicContact CB-CD1 4.16Å; F135-L201 HydrophobicContact CB-CD2 4.01Å; F135-L201 HydrophobicContact CB-CG 4.46Å; F135-L201 WeakPolarHBondContact O-CD2 3.36Å
136	T	92.3	Very high	79.1	Confident	131 Å²	131	92.6 Å²	92.6	80%	0.804	52%	0.521	S	S	*	.			trans	-128.4	122.8	172.1	-60.1	0	0	0	0	108.6
137	V	93.3	Very high	81.5	Confident	21 Å²	21	93.5 Å²	93.5	13%	0.127	52%	0.519	C	S	.	.			trans	-138.2	145.3	172.5	-66.2	0	0	0	0	111.6	V184 L188 L201 P202	V137-V184 HydrophobicContact CG2-CG1 3.71Å; V137-V184 HydrophobicContact CG2-CG2 4.5Å; V137-L188 HydrophobicContact CG1-CD2 3.82Å; V137-L201 HydrophobicContact CG2-CD2 3.77Å; V137-P202 HydrophobicContact CG2-CG 4.24Å
138	P	93.5	Very high	83.8	Confident	59 Å²	59	95.5 Å²	95.5	38%	0.383	53%	0.527	S	S	.	.			trans	-60.4	149.5	170.4	-26	35	0	0	0	113.5	Y140 Q143 R144	P138-Y140 PolarHBondContact O-N 3.19Å; P138-Q143 HydrophobicContact CB-CB 3.64Å; P138-Q143 HydrophobicContact CG-CB 4.09Å; P138-R144 HydrophobicContact CB-CG 4.39Å; P138-R144 WeakPolarHBondContact O-CD 3.35Å; P138-R144 PolarHBondContact O-NH1 3.39Å; P138-R144 VanDerWaalsContact O-NH1 3.08Å
139	S	91	Very high	86.2	Confident	69 Å²	69	97 Å²	97	48%	0.483	53%	0.531	S	S	.	.	S	Bend	trans	-63.3	-40.9	179.3	-59.2	0	0	0	0	113.1	R144 P202	S139-R144 PolarHBondContact O-NH1 2.93Å; S139-P202 WeakPolarHBondContact OG-CB 3.44Å
140	Y	94.9	Very high	88.5	Confident	162 Å²	162	93.9 Å²	93.9	64%	0.635	51%	0.514	S	S	*	.	S	Bend	trans	-89.2	134.8	-174.7	-64.5	-83.6	0	0	0	112	P138 C142 Q143	P138-Y140 PolarHBondContact O-N 3.19Å; Y140-C142 VanDerWaalsContact C-N 3.26Å; Y140-C142 PolarHBondContact O-N 2.81Å; Y140-Q143 PolarHBondContact O-N 3.25Å
141	A	95.4	Very high	90.7	Very high	60 Å²	60	92 Å²	92	50%	0.496	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-60	-34.2	-179.7	0	0	0	0	0	113.3	Q143 R144	A141-Q143 PolarHBondContact O-N 2.9Å; A141-R144 PolarHBondContact O-N 2.82Å
142	C	95.8	Very high	92.6	Very high	120 Å²	120	84.6 Å²	84.6	81%	0.811	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-66.8	-15.4	177	56.4	0	0	0	0	114	Y140	Y140-C142 VanDerWaalsContact C-N 3.26Å; Y140-C142 PolarHBondContact O-N 2.81Å
143	Q	96.4	Very high	94	Very high	123 Å²	123	84.9 Å²	84.9	58%	0.575	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-95.8	4.2	175	-62.9	176.4	-47.4	0	0	112.2	P138 Y140 A141	P138-Q143 HydrophobicContact CB-CB 3.64Å; P138-Q143 HydrophobicContact CG-CB 4.09Å; Y140-Q143 PolarHBondContact O-N 3.25Å; A141-Q143 PolarHBondContact O-N 2.9Å
144	R	94.7	Very high	94.7	Very high	29 Å²	29	84.2 Å²	84.2	11%	0.109	46%	0.459	C	S	.	.	S	Bend	trans	-115.3	141	-178.1	-59.8	-170.8	-62.8	-117.9	6.3	110.7	P138 S139 A141 S146 A187	P138-R144 HydrophobicContact CB-CG 4.39Å; P138-R144 WeakPolarHBondContact O-CD 3.35Å; P138-R144 PolarHBondContact O-NH1 3.39Å; P138-R144 VanDerWaalsContact O-NH1 3.08Å; S139-R144 PolarHBondContact O-NH1 2.93Å; A141-R144 PolarHBondContact O-N 2.82Å; R144-S146 PolarHBondContact O-N 2.7Å; R144-A187 HydrophobicContact CB-CB 4.14Å
145	R	94.5	Very high	95.2	Very high	235 Å²	235	81.2 Å²	81.2	89%	0.887	44%	0.439	S	S	*	.			trans	-86	108.7	163.7	-66.9	-175	-178.4	-138.2	0.7	108.2
146	S	95.5	Very high	95.5	Very high	66 Å²	66	80 Å²	80	46%	0.462	43%	0.434	S	S	.	.			trans	-111.2	99	176	-53.3	0	0	0	0	108.3	R144	R144-S146 PolarHBondContact O-N 2.7Å
147	T	95.3	Very high	95.7	Very high	98 Å²	98	78.5 Å²	78.5	60%	0.601	42%	0.421	S	S	*	.			trans	-77.9	177.9	179.8	80.3	0	0	0	0	110.7	E149	T147-E149 VanDerWaalsContact C-N 3.28Å; T147-E149 PolarHBondContact OG1-N 3.18Å; T147-E149 VanDerWaalsContact OG1-N 3.17Å; T147-E149 PolarHBondContact OG1-O 2.93Å
148	L	95.3	Very high	96	Very high	104 Å²	104	78 Å²	78	55%	0.545	42%	0.419	S	S	.	.	S	Bend	trans	-74.9	-20.8	173	-66.7	176.6	0	0	0	112.7	N150 G323 K324	L148-N150 PolarHBondContact O-N 3.01Å; L148-G323 VanDerWaalsContact CD1-C 3.41Å; L148-G323 VanDerWaalsContact CD1-O 3.25Å; L148-G323 WeakPolarHBondContact CD1-O 3.44Å; L148-K324 HydrophobicContact CD2-CG 3.98Å
149	E	95.1	Very high	96.2	Very high	132 Å²	132	75.1 Å²	75.1	62%	0.617	40%	0.401	S	S	*	.			trans	-75.4	119.3	175	-171.5	174.4	-175.3	0	0	109.4	T147 H151	T147-E149 VanDerWaalsContact C-N 3.28Å; T147-E149 PolarHBondContact OG1-N 3.18Å; T147-E149 VanDerWaalsContact OG1-N 3.17Å; T147-E149 PolarHBondContact OG1-O 2.93Å; E149-H151 IonicContact OE1-CE1 2.79Å; E149-H151 PolarHBondContact OE1-CE1 3.17Å; E149-H151 VanDerWaalsContact OE1-CE1 3.24Å; E149-H151 IonicContact OE1-ND1 3.73Å
150	N	96.2	Very high	96.6	Very high	42 Å²	42	72.8 Å²	72.8	23%	0.225	38%	0.384	C	S	.	.			trans	-121.1	100.5	-176.7	178.1	13.4	0	0	0	110.2	L148 N152 A153 T156	L148-N150 PolarHBondContact O-N 3.01Å; N150-N152 PolarHBondContact O-N 3.47Å; N150-N152 PolarHBondContact OD1-N 3.3Å; N150-A153 WeakPolarHBondContact ND2-CA 3.37Å; N150-A153 PolarHBondContact OD1-N 3.47Å; N150-T156 PolarHBondContact ND2-OG1 3.01Å
151	H	96.8	Very high	96.7	Very high	75 Å²	75	66.5 Å²	66.5	35%	0.347	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-10.7	178.6	-52.3	-70.2	0	0	0	113.8	E149 L188 P189 S190 A191	E149-H151 IonicContact OE1-CE1 2.79Å; E149-H151 PolarHBondContact OE1-CE1 3.17Å; E149-H151 VanDerWaalsContact OE1-CE1 3.24Å; E149-H151 IonicContact OE1-ND1 3.73Å; H151-L188 PolarHBondContact CD2-O 2.95Å; H151-P189 VanDerWaalsContact CD2-C 3.47Å; H151-P189 PolarHBondContact CD2-O 3.4Å; H151-P189 PolarHBondContact NE2-O 3.46Å; H151-S190 VanDerWaalsContact CB-C 3.42Å; H151-A191 HydrophobicContact CB-CB 4.37Å; H151-A191 WeakPolarHBondContact O-CB 3.42Å
152	N	97.8	Very high	96.9	Very high	6 Å²	6	63.8 Å²	63.8	3%	0.032	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	28.5	-174.3	-65.7	-67.9	0	0	0	112.1	N150 V154 L155 T156 L185 S190 A191 V192	N150-N152 PolarHBondContact O-N 3.47Å; N150-N152 PolarHBondContact OD1-N 3.3Å; N152-V154 VanDerWaalsContact C-N 3.32Å; N152-V154 PolarHBondContact O-N 3.04Å; N152-L155 PolarHBondContact O-N 3.01Å; N152-T156 HydrophobicContact CB-CG2 4.17Å; N152-T156 VanDerWaalsContact O-CG2 3.32Å; N152-T156 WeakPolarHBondContact O-CG2 3.3Å; N152-T156 PolarHBondContact O-N 3.07Å; N152-T156 PolarHBondContact O-OG1 3.35Å; N152-L185 HydrophobicContact CB-CB 4.23Å; N152-L185 PolarHBondContact ND2-O 2.81Å; N152-S190 PolarHBondContact ND2-O 2.84Å; N152-A191 WeakPolarHBondContact OD1-CA 3.16Å; N152-V192 WeakPolarHBondContact OD1-CG2 3.34Å; N152-V192 PolarHBondContact OD1-N 3.25Å
153	A	97.4	Very high	97	Very high	39 Å²	39	58 Å²	58	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-46.8	-51.2	-175.8	0	0	0	0	0	113	N150 L155 T156 D157	N150-A153 WeakPolarHBondContact ND2-CA 3.37Å; N150-A153 PolarHBondContact OD1-N 3.47Å; A153-L155 VanDerWaalsContact C-N 3.34Å; A153-L155 PolarHBondContact O-N 2.72Å; A153-T156 WeakPolarHBondContact CA-OG1 3.28Å; A153-T156 PolarHBondContact O-N 3.37Å; A153-T156 VanDerWaalsContact O-N 3.13Å; A153-T156 PolarHBondContact O-OG1 3.1Å; A153-D157 VanDerWaalsContact O-CB 3.28Å; A153-D157 WeakPolarHBondContact O-CB 3.44Å; A153-D157 PolarHBondContact O-N 2.91Å
154	V	96.8	Very high	97	Very high	100 Å²	100	54.8 Å²	54.8	61%	0.606	29%	0.285	S	S	*	.	H	α-helix	trans	-54	-47.9	179.7	-175	0	0	0	0	112.1	N152 A158 I215	N152-V154 VanDerWaalsContact C-N 3.32Å; N152-V154 PolarHBondContact O-N 3.04Å; V154-A158 WeakPolarHBondContact O-CB 3.24Å; V154-A158 PolarHBondContact O-N 3.27Å; V154-I215 HydrophobicContact CG1-CG2 3.76Å
155	L	98.3	Very high	97.1	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-68.6	-44.5	178.7	-58.9	179.9	0	0	0	111.3	N152 A153 D157 L159 L185 V192 I212 I215 L216	N152-L155 PolarHBondContact O-N 3.01Å; A153-L155 VanDerWaalsContact C-N 3.34Å; A153-L155 PolarHBondContact O-N 2.72Å; L155-D157 PolarHBondContact O-N 3.37Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 3.31Å; L155-L185 HydrophobicContact CB-CD1 3.81Å; L155-L185 HydrophobicContact CD1-CD1 4.25Å; L155-V192 HydrophobicContact CD1-CB 3.97Å; L155-V192 HydrophobicContact CD1-CG1 4.48Å; L155-V192 HydrophobicContact CD1-CG2 4.36Å; L155-I212 HydrophobicContact CD1-CG2 3.97Å; L155-I212 HydrophobicContact CD2-CB 4.47Å; L155-I212 HydrophobicContact CD2-CG2 4.01Å; L155-I215 HydrophobicContact CD2-CB 3.79Å; L155-I215 HydrophobicContact CD2-CD1 4.11Å; L155-I215 HydrophobicContact CD2-CG2 3.62Å; L155-L216 HydrophobicContact CD2-CD2 4.49Å
156	T	98.4	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.4	-31.7	-175.1	61.7	0	0	0	0	112.9	N150 N152 A153 S160 L185 K186	N150-T156 PolarHBondContact ND2-OG1 3.01Å; N152-T156 HydrophobicContact CB-CG2 4.17Å; N152-T156 VanDerWaalsContact O-CG2 3.32Å; N152-T156 WeakPolarHBondContact O-CG2 3.3Å; N152-T156 PolarHBondContact O-N 3.07Å; N152-T156 PolarHBondContact O-OG1 3.35Å; A153-T156 WeakPolarHBondContact CA-OG1 3.28Å; A153-T156 PolarHBondContact O-N 3.37Å; A153-T156 VanDerWaalsContact O-N 3.13Å; A153-T156 PolarHBondContact O-OG1 3.1Å; T156-S160 WeakPolarHBondContact O-CB 3.45Å; T156-S160 PolarHBondContact O-N 3Å; T156-S160 PolarHBondContact O-OG 3.2Å; T156-L185 HydrophobicContact CG2-CB 3.65Å; T156-L185 HydrophobicContact CG2-CD1 4.47Å; T156-K186 HydrophobicContact CG2-CG 3.72Å
157	D	98.2	Very high	97.2	Very high	100 Å²	100	43.4 Å²	43.4	54%	0.535	24%	0.237	S	C	.	.	H	α-helix	trans	-73.4	-41.6	178.4	-70.3	-14.3	0	0	0	110.1	A153 L155 S160 L161	A153-D157 VanDerWaalsContact O-CB 3.28Å; A153-D157 WeakPolarHBondContact O-CB 3.44Å; A153-D157 PolarHBondContact O-N 2.91Å; L155-D157 PolarHBondContact O-N 3.37Å; D157-S160 PolarHBondContact O-N 3.26Å; D157-L161 WeakPolarHBondContact O-CB 3.36Å; D157-L161 PolarHBondContact O-N 2.9Å
158	A	98.3	Very high	97.2	Very high	10 Å²	10	39.9 Å²	39.9	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-57.3	-51.9	171.2	0	0	0	0	0	112	V154 S160 L161 L162 I215 V224	V154-A158 WeakPolarHBondContact O-CB 3.24Å; V154-A158 PolarHBondContact O-N 3.27Å; A158-S160 VanDerWaalsContact C-N 3.32Å; A158-S160 PolarHBondContact O-N 2.92Å; A158-L161 PolarHBondContact O-N 2.98Å; A158-L162 WeakPolarHBondContact O-CG 3.48Å; A158-L162 PolarHBondContact O-N 3.08Å; A158-L162 VanDerWaalsContact O-N 3.09Å; A158-I215 HydrophobicContact CB-CD1 3.4Å; A158-V224 HydrophobicContact CB-CG1 4.26Å; A158-V224 HydrophobicContact CB-CG2 3.88Å
159	L	98.6	Very high	96.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-37.3	177.2	-66.1	168.3	0	0	0	111.8	L155 L161 L162 A163 F178 A181 A182 L185 V211 I212	L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 3.31Å; L159-L161 VanDerWaalsContact C-N 3.34Å; L159-L162 PolarHBondContact O-N 3.4Å; L159-A163 WeakPolarHBondContact O-CB 3.36Å; L159-A163 PolarHBondContact O-N 3.47Å; L159-F178 HydrophobicContact CD2-CD1 3.6Å; L159-F178 HydrophobicContact CD2-CE1 3.96Å; L159-F178 WeakPolarHBondContact O-CB 3.26Å; L159-A181 HydrophobicContact CD1-CB 4.09Å; L159-A182 HydrophobicContact CB-CB 4.04Å; L159-A182 HydrophobicContact CD1-CB 4.49Å; L159-L185 HydrophobicContact CD1-CD1 3.63Å; L159-V211 HydrophobicContact CD2-CB 4.31Å; L159-V211 HydrophobicContact CD2-CG1 4.15Å; L159-I212 HydrophobicContact CD1-CD1 4.36Å; L159-I212 HydrophobicContact CD1-CG1 4.32Å
160	S	98.3	Very high	96.7	Very high	20 Å²	20	35.7 Å²	35.7	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-67.5	-34.3	177.8	-62.8	0	0	0	0	112.3	T156 D157 A158 A163 E164	T156-S160 WeakPolarHBondContact O-CB 3.45Å; T156-S160 PolarHBondContact O-N 3Å; T156-S160 PolarHBondContact O-OG 3.2Å; D157-S160 PolarHBondContact O-N 3.26Å; A158-S160 VanDerWaalsContact C-N 3.32Å; A158-S160 PolarHBondContact O-N 2.92Å; S160-A163 WeakPolarHBondContact O-CB 3.48Å; S160-A163 PolarHBondContact O-N 2.81Å; S160-E164 WeakPolarHBondContact O-CB 3.24Å; S160-E164 PolarHBondContact O-N 3.32Å
161	L	98.3	Very high	96.6	Very high	29 Å²	29	37.8 Å²	37.8	15%	0.152	21%	0.208	C	C	.	.	H	α-helix	trans	-67.4	-45.3	174.6	-177.1	150.6	0	0	0	111.2	D157 A158 L159 A163 E164 N165 V224 T227 K228 F233	D157-L161 WeakPolarHBondContact O-CB 3.36Å; D157-L161 PolarHBondContact O-N 2.9Å; A158-L161 PolarHBondContact O-N 2.98Å; L159-L161 VanDerWaalsContact C-N 3.34Å; L161-A163 VanDerWaalsContact C-N 3.3Å; L161-A163 PolarHBondContact O-N 3.41Å; L161-E164 PolarHBondContact O-N 2.88Å; L161-N165 PolarHBondContact O-N 3.02Å; L161-V224 HydrophobicContact CD2-CG1 4.43Å; L161-T227 HydrophobicContact CD2-CG2 3.5Å; L161-T227 VanDerWaalsContact CD2-CG2 3.5Å; L161-K228 HydrophobicContact CD1-CD 4.32Å; L161-K228 HydrophobicContact CD1-CG 3.54Å; L161-K228 HydrophobicContact CD2-CG 4.5Å; L161-F233 HydrophobicContact CD1-CE1 4.47Å; L161-F233 HydrophobicContact CD2-CE1 4.24Å; L161-F233 HydrophobicContact CD2-CZ 4.48Å; L161-F233 HydrophobicContact CG-CE1 4.11Å; L161-F233 HydrophobicContact CG-CZ 4.2Å
162	L	98.3	Very high	96.3	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-36.2	175.4	-63.8	179.1	0	0	0	111.8	A158 L159 N165 A166 F178 V211 E223 V224	A158-L162 WeakPolarHBondContact O-CG 3.48Å; A158-L162 PolarHBondContact O-N 3.08Å; A158-L162 VanDerWaalsContact O-N 3.09Å; L159-L162 PolarHBondContact O-N 3.4Å; L162-N165 PolarHBondContact O-N 2.9Å; L162-A166 WeakPolarHBondContact O-CB 3.16Å; L162-A166 PolarHBondContact O-N 3.34Å; L162-F178 HydrophobicContact CB-CD2 3.74Å; L162-F178 HydrophobicContact CB-CE1 4.48Å; L162-F178 HydrophobicContact CB-CE2 3.59Å; L162-F178 HydrophobicContact CB-CG 4.24Å; L162-F178 HydrophobicContact CB-CZ 4Å; L162-F178 HydrophobicContact CD1-CE1 4.09Å; L162-F178 HydrophobicContact CD1-CE2 4.26Å; L162-F178 HydrophobicContact CD1-CZ 3.81Å; L162-V211 HydrophobicContact CD1-CG1 4.05Å; L162-V211 HydrophobicContact CD1-CG2 3.71Å; L162-E223 HydrophobicContact CD1-CG 4.44Å; L162-E223 HydrophobicContact CD2-CG 3.89Å; L162-V224 HydrophobicContact CD1-CG2 3.89Å; L162-V224 HydrophobicContact CD2-CG2 4.19Å; L162-V224 HydrophobicContact CG-CG2 4Å
163	A	98.2	Very high	96.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-49.2	172.7	0	0	0	0	0	111.6	L159 S160 L161 N165 A166 E167 F178 R179	L159-A163 WeakPolarHBondContact O-CB 3.36Å; L159-A163 PolarHBondContact O-N 3.47Å; S160-A163 WeakPolarHBondContact O-CB 3.48Å; S160-A163 PolarHBondContact O-N 2.81Å; L161-A163 VanDerWaalsContact C-N 3.3Å; L161-A163 PolarHBondContact O-N 3.41Å; A163-N165 VanDerWaalsContact C-N 3.34Å; A163-N165 PolarHBondContact O-N 3.16Å; A163-A166 PolarHBondContact O-N 3.39Å; A163-E167 WeakPolarHBondContact O-CB 3.31Å; A163-E167 VanDerWaalsContact O-CG 3.24Å; A163-E167 WeakPolarHBondContact O-CG 3.39Å; A163-E167 PolarHBondContact O-N 3.31Å; A163-F178 HydrophobicContact CB-CB 3.67Å; A163-R179 HydrophobicContact CB-CG 3.93Å
164	E	97.3	Very high	96	Very high	55 Å²	55	43.6 Å²	43.6	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-59.7	-43.6	178.3	-176	-177.8	-158.7	0	0	111.4	S160 L161 A166 E167 L168 F233 K237	S160-E164 WeakPolarHBondContact O-CB 3.24Å; S160-E164 PolarHBondContact O-N 3.32Å; L161-E164 PolarHBondContact O-N 2.88Å; E164-A166 PolarHBondContact O-N 3.27Å; E164-E167 PolarHBondContact O-N 3.04Å; E164-L168 HydrophobicContact CG-CD1 3.95Å; E164-L168 WeakPolarHBondContact O-CB 3.1Å; E164-L168 WeakPolarHBondContact O-CG 3.45Å; E164-L168 PolarHBondContact O-N 3.17Å; E164-F233 HydrophobicContact CG-CE2 4.26Å; E164-F233 HydrophobicContact CG-CZ 4.37Å; E164-K237 VanDerWaalsContact CD-NZ 3.29Å; E164-K237 WeakPolarHBondContact OE1-CE 3.46Å; E164-K237 IonicContact OE1-NZ 3.91Å; E164-K237 PolarHBondContact OE1-NZ 2.89Å; E164-K237 VanDerWaalsContact OE1-NZ 3.08Å; E164-K237 IonicContact OE2-NZ 2.73Å; E164-K237 PolarHBondContact OE2-NZ 3.02Å
165	N	97.3	Very high	96	Very high	31 Å²	31	38.8 Å²	38.8	17%	0.166	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-42.2	176.4	-179.3	60.9	0	0	0	112.7	L161 L162 A163 L168 S169 T227 F233	L161-N165 PolarHBondContact O-N 3.02Å; L162-N165 PolarHBondContact O-N 2.9Å; A163-N165 VanDerWaalsContact C-N 3.34Å; A163-N165 PolarHBondContact O-N 3.16Å; N165-L168 PolarHBondContact O-N 3.22Å; N165-S169 VanDerWaalsContact O-CB 3.28Å; N165-S169 WeakPolarHBondContact O-CB 3.42Å; N165-S169 PolarHBondContact O-N 2.89Å; N165-S169 VanDerWaalsContact O-N 3.11Å; N165-S169 PolarHBondContact O-OG 3.3Å; N165-T227 HydrophobicContact CB-CG2 3.61Å; N165-F233 VanDerWaalsContact CA-CE2 3.44Å; N165-F233 HydrophobicContact CB-CD2 3.68Å; N165-F233 HydrophobicContact CB-CE2 3.53Å; N165-F233 HydrophobicContact CB-CG 4.48Å; N165-F233 HydrophobicContact CB-CZ 4.2Å; N165-F233 WeakPolarHBondContact OD1-CD2 3.32Å
166	A	96.7	Very high	95.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-47.1	177.3	0	0	0	0	0	111.9	L162 A163 E164 L168 S169 D170 E171 R174	L162-A166 WeakPolarHBondContact O-CB 3.16Å; L162-A166 PolarHBondContact O-N 3.34Å; A163-A166 PolarHBondContact O-N 3.39Å; E164-A166 PolarHBondContact O-N 3.27Å; A166-L168 VanDerWaalsContact C-N 3.31Å; A166-L168 PolarHBondContact O-N 3.13Å; A166-S169 CarbonylContact O-C 3.58Å; A166-S169 PolarHBondContact O-N 3.22Å; A166-D170 PolarHBondContact O-N 3.39Å; A166-E171 HydrophobicContact CB-CB 4.03Å; A166-E171 PolarHBondContact O-N 2.8Å; A166-R174 HydrophobicContact CB-CB 4.06Å; A166-R174 HydrophobicContact CB-CG 4.05Å
167	E	94.9	Very high	95.9	Very high	59 Å²	59	43.8 Å²	43.8	28%	0.276	25%	0.25	S	S	.	.	H	α-helix	trans	-58.6	-41.7	176.3	-71.2	163.8	-172.2	0	0	111.4	A163 E164 S169 R179	A163-E167 WeakPolarHBondContact O-CB 3.31Å; A163-E167 VanDerWaalsContact O-CG 3.24Å; A163-E167 WeakPolarHBondContact O-CG 3.39Å; A163-E167 PolarHBondContact O-N 3.31Å; E164-E167 PolarHBondContact O-N 3.04Å; E167-S169 PolarHBondContact O-N 2.97Å; E167-R179 VanDerWaalsContact OE1-CG 3.31Å; E167-R179 WeakPolarHBondContact OE1-CG 3.24Å; E167-R179 IonicContact OE1-CZ 3.06Å; E167-R179 IonicContact OE1-NE 3.59Å; E167-R179 PolarHBondContact OE1-NE 2.86Å; E167-R179 IonicContact OE1-NH2 2.84Å; E167-R179 IonicContact OE2-CZ 3.63Å; E167-R179 IonicContact OE2-NE 3.24Å; E167-R179 IonicContact OE2-NH2 3.82Å; E167-R179 PolarHBondContact OE2-NH2 2.83Å
168	L	93.9	Very high	95.9	Very high	23 Å²	23	39.2 Å²	39.2	12%	0.12	23%	0.226	C	C	.	.	H	α-helix	trans	-72.6	-15.9	177.1	-68.3	173.3	0	0	0	113.4	E164 N165 A166 F233 L236 K237 T240	E164-L168 HydrophobicContact CG-CD1 3.95Å; E164-L168 WeakPolarHBondContact O-CB 3.1Å; E164-L168 WeakPolarHBondContact O-CG 3.45Å; E164-L168 PolarHBondContact O-N 3.17Å; N165-L168 PolarHBondContact O-N 3.22Å; A166-L168 VanDerWaalsContact C-N 3.31Å; A166-L168 PolarHBondContact O-N 3.13Å; L168-F233 HydrophobicContact CD1-CD2 4.45Å; L168-F233 HydrophobicContact CD1-CE2 4.08Å; L168-L236 HydrophobicContact CB-CB 4.36Å; L168-L236 HydrophobicContact CB-CD1 4.1Å; L168-L236 HydrophobicContact CD1-CB 4.11Å; L168-K237 HydrophobicContact CD1-CG 4.2Å; L168-T240 HydrophobicContact CD2-CG2 3.65Å
169	S	90.8	Very high	95.9	Very high	36 Å²	36	43.7 Å²	43.7	25%	0.252	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	15.2	-179	-56.6	0	0	0	0	113.7	N165 A166 E167 E171	N165-S169 VanDerWaalsContact O-CB 3.28Å; N165-S169 WeakPolarHBondContact O-CB 3.42Å; N165-S169 PolarHBondContact O-N 2.89Å; N165-S169 VanDerWaalsContact O-N 3.11Å; N165-S169 PolarHBondContact O-OG 3.3Å; A166-S169 CarbonylContact O-C 3.58Å; A166-S169 PolarHBondContact O-N 3.22Å; E167-S169 PolarHBondContact O-N 2.97Å; S169-E171 PolarHBondContact O-N 2.78Å
170	D	90.6	Very high	95.9	Very high	113 Å²	113	50.9 Å²	50.9	60%	0.604	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	21.7	-178.9	-146.3	41.7	0	0	0	113.2	A166 D172	A166-D170 PolarHBondContact O-N 3.39Å; D170-D172 PolarHBondContact O-N 3.5Å
171	E	92.8	Very high	95.9	Very high	86 Å²	86	50 Å²	50	40%	0.402	26%	0.261	S	S	.	.			trans	-98.8	49.8	174.9	-62	-169.1	124.5	0	0	111.2	A166 S169 G173 R174 G175	A166-E171 HydrophobicContact CB-CB 4.03Å; A166-E171 PolarHBondContact O-N 2.8Å; S169-E171 PolarHBondContact O-N 2.78Å; E171-G173 PolarHBondContact O-N 3.43Å; E171-G173 VanDerWaalsContact O-N 3.09Å; E171-R174 HydrophobicContact CB-CB 4.2Å; E171-R174 WeakPolarHBondContact O-CB 3.27Å; E171-R174 PolarHBondContact O-N 2.99Å; E171-R174 IonicContact OE2-NH1 3.98Å; E171-R174 PolarHBondContact OE2-NH1 3.06Å; E171-G175 PolarHBondContact O-N 2.83Å
172	D	90.5	Very high	95.9	Very high	94 Å²	94	48.6 Å²	48.6	50%	0.503	25%	0.254	S	S	.	.	H	α-helix	trans	-52.3	-38.8	-171.4	-73.5	-24.9	0	0	0	113.7	D170 R174 G175 V176	D170-D172 PolarHBondContact O-N 3.5Å; D172-R174 VanDerWaalsContact C-N 3.32Å; D172-R174 PolarHBondContact O-N 3.23Å; D172-G175 PolarHBondContact O-N 3.45Å; D172-V176 WeakPolarHBondContact O-CB 3.48Å; D172-V176 VanDerWaalsContact O-CG2 3.3Å; D172-V176 WeakPolarHBondContact O-CG2 3.34Å; D172-V176 PolarHBondContact O-N 3.15Å
173	G	94.7	Very high	95.9	Very high	63 Å²	63	50 Å²	50	65%	0.649	27%	0.266	S	S	*	.	H	α-helix	trans	-60.5	-40.2	177.6	0	0	0	0	0	113	E171 A177	E171-G173 PolarHBondContact O-N 3.43Å; E171-G173 VanDerWaalsContact O-N 3.09Å; G173-A177 PolarHBondContact O-N 2.94Å; G173-A177 VanDerWaalsContact O-N 3.12Å
174	R	95.6	Very high	95.8	Very high	84 Å²	84	50 Å²	50	32%	0.317	27%	0.266	S	S	.	.	H	α-helix	trans	-71.4	-41.4	175.4	-177.3	179.6	-177.3	172.9	-4.7	111	A166 E171 D172 V176 A177 F178 H207 E223	A166-R174 HydrophobicContact CB-CB 4.06Å; A166-R174 HydrophobicContact CB-CG 4.05Å; E171-R174 HydrophobicContact CB-CB 4.2Å; E171-R174 WeakPolarHBondContact O-CB 3.27Å; E171-R174 PolarHBondContact O-N 2.99Å; E171-R174 IonicContact OE2-NH1 3.98Å; E171-R174 PolarHBondContact OE2-NH1 3.06Å; D172-R174 VanDerWaalsContact C-N 3.32Å; D172-R174 PolarHBondContact O-N 3.23Å; R174-V176 PolarHBondContact O-N 2.86Å; R174-A177 PolarHBondContact O-N 3.4Å; R174-F178 HydrophobicContact CG-CD2 3.93Å; R174-F178 HydrophobicContact CG-CE2 3.67Å; R174-F178 WeakPolarHBondContact O-CD2 3.25Å; R174-F178 PolarHBondContact O-N 2.95Å; R174-F178 VanDerWaalsContact O-N 3.08Å; R174-H207 PolarHBondContact NH2-CE1 3.08Å; R174-E223 IonicContact CZ-OE1 3.26Å; R174-E223 IonicContact NH2-OE1 2.83Å; R174-E223 PolarHBondContact NH2-OE1 3.5Å
175	G	96.8	Very high	95.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-53.3	-53.2	172.8	0	0	0	0	0	112	E171 D172 A177 F178 R179	E171-G175 PolarHBondContact O-N 2.83Å; D172-G175 PolarHBondContact O-N 3.45Å; G175-A177 VanDerWaalsContact C-N 3.33Å; G175-A177 PolarHBondContact O-N 3.38Å; G175-F178 PolarHBondContact O-N 3.49Å; G175-R179 WeakPolarHBondContact O-CG 3.34Å; G175-R179 PolarHBondContact O-N 3.41Å
176	V	96.6	Very high	95.9	Very high	66 Å²	66	49.7 Å²	49.7	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-59.3	-41.6	177.9	170.9	0	0	0	0	112	D172 R174 R179 R180	D172-V176 WeakPolarHBondContact O-CB 3.48Å; D172-V176 VanDerWaalsContact O-CG2 3.3Å; D172-V176 WeakPolarHBondContact O-CG2 3.34Å; D172-V176 PolarHBondContact O-N 3.15Å; R174-V176 PolarHBondContact O-N 2.86Å; V176-R179 PolarHBondContact O-N 2.66Å; V176-R180 HydrophobicContact CG1-CG 4.36Å; V176-R180 WeakPolarHBondContact O-CB 3.41Å; V176-R180 VanDerWaalsContact O-CG 3.3Å; V176-R180 WeakPolarHBondContact O-CG 3.33Å; V176-R180 PolarHBondContact O-N 3Å
177	A	97.6	Very high	95.9	Very high	46 Å²	46	50.5 Å²	50.5	38%	0.38	27%	0.269	S	S	.	.	H	α-helix	trans	-60.1	-49.1	177.7	0	0	0	0	0	111.6	G173 R174 G175 R180 A181	G173-A177 PolarHBondContact O-N 2.94Å; G173-A177 VanDerWaalsContact O-N 3.12Å; R174-A177 PolarHBondContact O-N 3.4Å; G175-A177 VanDerWaalsContact C-N 3.33Å; G175-A177 PolarHBondContact O-N 3.38Å; A177-R180 PolarHBondContact O-N 3.02Å; A177-A181 PolarHBondContact O-N 2.95Å
178	F	98.4	Very high	96	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-39	177.2	-74.2	-50.3	0	0	0	113.1	L159 L162 A163 R174 G175 R180 A181 A182	L159-F178 HydrophobicContact CD2-CD1 3.6Å; L159-F178 HydrophobicContact CD2-CE1 3.96Å; L159-F178 WeakPolarHBondContact O-CB 3.26Å; L162-F178 HydrophobicContact CB-CD2 3.74Å; L162-F178 HydrophobicContact CB-CE1 4.48Å; L162-F178 HydrophobicContact CB-CE2 3.59Å; L162-F178 HydrophobicContact CB-CG 4.24Å; L162-F178 HydrophobicContact CB-CZ 4Å; L162-F178 HydrophobicContact CD1-CE1 4.09Å; L162-F178 HydrophobicContact CD1-CE2 4.26Å; L162-F178 HydrophobicContact CD1-CZ 3.81Å; A163-F178 HydrophobicContact CB-CB 3.67Å; R174-F178 HydrophobicContact CG-CD2 3.93Å; R174-F178 HydrophobicContact CG-CE2 3.67Å; R174-F178 WeakPolarHBondContact O-CD2 3.25Å; R174-F178 PolarHBondContact O-N 2.95Å; R174-F178 VanDerWaalsContact O-N 3.08Å; G175-F178 PolarHBondContact O-N 3.49Å; F178-R180 VanDerWaalsContact C-N 3.33Å; F178-R180 PolarHBondContact O-N 3.3Å; F178-A181 PolarHBondContact O-N 3.11Å; F178-A182 WeakPolarHBondContact O-CB 3.49Å; F178-A182 PolarHBondContact O-N 3.27Å
179	R	98	Very high	96	Very high	105 Å²	105	51.5 Å²	51.5	40%	0.396	28%	0.282	S	S	.	.	H	α-helix	trans	-58.4	-44.5	173.4	-71.8	-64.6	-173.3	-171.5	0.1	111.6	A163 E167 G175 V176 A182 A183	A163-R179 HydrophobicContact CB-CG 3.93Å; E167-R179 VanDerWaalsContact OE1-CG 3.31Å; E167-R179 WeakPolarHBondContact OE1-CG 3.24Å; E167-R179 IonicContact OE1-CZ 3.06Å; E167-R179 IonicContact OE1-NE 3.59Å; E167-R179 PolarHBondContact OE1-NE 2.86Å; E167-R179 IonicContact OE1-NH2 2.84Å; E167-R179 IonicContact OE2-CZ 3.63Å; E167-R179 IonicContact OE2-NE 3.24Å; E167-R179 IonicContact OE2-NH2 3.82Å; E167-R179 PolarHBondContact OE2-NH2 2.83Å; G175-R179 WeakPolarHBondContact O-CG 3.34Å; G175-R179 PolarHBondContact O-N 3.41Å; V176-R179 PolarHBondContact O-N 2.66Å; R179-A182 PolarHBondContact O-N 3.33Å; R179-A183 VanDerWaalsContact O-CB 3.28Å; R179-A183 WeakPolarHBondContact O-CB 3.31Å; R179-A183 PolarHBondContact O-N 3.24Å
180	R	97.9	Very high	96.2	Very high	151 Å²	151	52.1 Å²	52.1	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-66.9	-42.8	178.9	-72.6	178	177.4	-173.9	0.4	111.7	V176 A177 F178 A183 V184 C203	V176-R180 HydrophobicContact CG1-CG 4.36Å; V176-R180 WeakPolarHBondContact O-CB 3.41Å; V176-R180 VanDerWaalsContact O-CG 3.3Å; V176-R180 WeakPolarHBondContact O-CG 3.33Å; V176-R180 PolarHBondContact O-N 3Å; A177-R180 PolarHBondContact O-N 3.02Å; F178-R180 VanDerWaalsContact C-N 3.33Å; F178-R180 PolarHBondContact O-N 3.3Å; R180-A183 PolarHBondContact O-N 3.23Å; R180-V184 PolarHBondContact O-N 3.12Å; R180-C203 HydrophobicContact CB-CB 3.73Å
181	A	98.2	Very high	96.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-50	173.8	0	0	0	0	0	111.5	L159 A177 F178 A183 V184 L185 L204	L159-A181 HydrophobicContact CD1-CB 4.09Å; A177-A181 PolarHBondContact O-N 2.95Å; F178-A181 PolarHBondContact O-N 3.11Å; A181-A183 VanDerWaalsContact C-N 3.31Å; A181-A183 PolarHBondContact O-N 3.21Å; A181-V184 PolarHBondContact O-N 3.31Å; A181-L185 WeakPolarHBondContact O-CG 3.38Å; A181-L185 PolarHBondContact O-N 2.89Å; A181-L185 VanDerWaalsContact O-N 3.1Å; A181-L204 HydrophobicContact CB-CD2 3.7Å
182	A	98.4	Very high	96.5	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-39.3	176.3	0	0	0	0	0	112.2	L159 F178 R179 V184 L185 K186	L159-A182 HydrophobicContact CB-CB 4.04Å; L159-A182 HydrophobicContact CD1-CB 4.49Å; F178-A182 WeakPolarHBondContact O-CB 3.49Å; F178-A182 PolarHBondContact O-N 3.27Å; R179-A182 PolarHBondContact O-N 3.33Å; A182-V184 VanDerWaalsContact C-N 3.33Å; A182-V184 PolarHBondContact O-N 2.78Å; A182-L185 PolarHBondContact O-N 3.35Å; A182-K186 VanDerWaalsContact O-CG 3.3Å; A182-K186 WeakPolarHBondContact O-CG 3.19Å; A182-K186 PolarHBondContact O-N 3.44Å
183	A	98	Very high	96.5	Very high	31 Å²	31	46.2 Å²	46.2	26%	0.256	27%	0.268	S	S	.	.	H	α-helix	trans	-68	-29.7	178.1	0	0	0	0	0	113.5	R179 R180 A181	R179-A183 VanDerWaalsContact O-CB 3.28Å; R179-A183 WeakPolarHBondContact O-CB 3.31Å; R179-A183 PolarHBondContact O-N 3.24Å; R180-A183 PolarHBondContact O-N 3.23Å; A181-A183 VanDerWaalsContact C-N 3.31Å; A181-A183 PolarHBondContact O-N 3.21Å
184	V	97.8	Very high	96.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.5	-48.8	171.4	161.4	0	0	0	0	110.2	V137 R180 A181 A182 K186 A187 L201 P202 C203	V137-V184 HydrophobicContact CG2-CG1 3.71Å; V137-V184 HydrophobicContact CG2-CG2 4.5Å; R180-V184 PolarHBondContact O-N 3.12Å; A181-V184 PolarHBondContact O-N 3.31Å; A182-V184 VanDerWaalsContact C-N 3.33Å; A182-V184 PolarHBondContact O-N 2.78Å; V184-K186 VanDerWaalsContact C-N 3.32Å; V184-K186 PolarHBondContact O-N 3.04Å; V184-A187 PolarHBondContact O-N 3.48Å; V184-A187 VanDerWaalsContact O-N 3.07Å; V184-L201 HydrophobicContact CG1-CB 4.48Å; V184-L201 HydrophobicContact CG1-CD1 4.19Å; V184-P202 HydrophobicContact CG2-CG 4.35Å; V184-C203 HydrophobicContact CG2-CB 4.25Å
185	L	98	Very high	96.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-34.3	-179.2	-65.3	-178.2	0	0	0	113.4	N152 L155 T156 L159 A181 A182 A187 L188 V192 L198 I212	N152-L185 HydrophobicContact CB-CB 4.23Å; N152-L185 PolarHBondContact ND2-O 2.81Å; L155-L185 HydrophobicContact CB-CD1 3.81Å; L155-L185 HydrophobicContact CD1-CD1 4.25Å; T156-L185 HydrophobicContact CG2-CB 3.65Å; T156-L185 HydrophobicContact CG2-CD1 4.47Å; L159-L185 HydrophobicContact CD1-CD1 3.63Å; A181-L185 WeakPolarHBondContact O-CG 3.38Å; A181-L185 PolarHBondContact O-N 2.89Å; A181-L185 VanDerWaalsContact O-N 3.1Å; A182-L185 PolarHBondContact O-N 3.35Å; L185-A187 PolarHBondContact O-N 2.98Å; L185-L188 HydrophobicContact CD2-CD1 3.72Å; L185-L188 WeakPolarHBondContact O-CB 3.3Å; L185-L188 PolarHBondContact O-N 3.32Å; L185-V192 HydrophobicContact CD2-CG2 4.25Å; L185-L198 HydrophobicContact CD2-CD2 3.93Å; L185-I212 HydrophobicContact CD1-CD1 3.92Å; L185-I212 HydrophobicContact CD1-CG1 4.27Å
186	K	97.9	Very high	95.7	Very high	80 Å²	80	45.3 Å²	45.3	35%	0.348	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.3	174.1	-75.8	175.7	-175.4	178	0	113.8	T156 A182 V184	T156-K186 HydrophobicContact CG2-CG 3.72Å; A182-K186 VanDerWaalsContact O-CG 3.3Å; A182-K186 WeakPolarHBondContact O-CG 3.19Å; A182-K186 PolarHBondContact O-N 3.44Å; V184-K186 VanDerWaalsContact C-N 3.32Å; V184-K186 PolarHBondContact O-N 3.04Å
187	A	97.1	Very high	95.6	Very high	18 Å²	18	43.4 Å²	43.4	15%	0.149	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-4.1	-179.4	0	0	0	0	0	112.9	R144 V184 L185	R144-A187 HydrophobicContact CB-CB 4.14Å; V184-A187 PolarHBondContact O-N 3.48Å; V184-A187 VanDerWaalsContact O-N 3.07Å; L185-A187 PolarHBondContact O-N 2.98Å
188	L	96.6	Very high	95.6	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	23%	0.227	C	C	.	.			trans	-72.5	141.6	179.5	-62.8	-178.1	0	0	0	110.6	F135 V137 H151 L185 S190 V192 L198 L201	F135-L188 HydrophobicContact CB-CD2 3.66Å; F135-L188 HydrophobicContact CD1-CD2 4.16Å; F135-L188 HydrophobicContact CD2-CD1 3.81Å; F135-L188 HydrophobicContact CD2-CD2 4.13Å; F135-L188 HydrophobicContact CE2-CD1 4.07Å; F135-L188 HydrophobicContact CG-CD1 4.27Å; F135-L188 HydrophobicContact CG-CD2 3.73Å; F135-L188 HydrophobicContact CG-CG 4.49Å; V137-L188 HydrophobicContact CG1-CD2 3.82Å; H151-L188 PolarHBondContact CD2-O 2.95Å; L185-L188 HydrophobicContact CD2-CD1 3.72Å; L185-L188 WeakPolarHBondContact O-CB 3.3Å; L185-L188 PolarHBondContact O-N 3.32Å; L188-S190 PolarHBondContact O-N 2.9Å; L188-V192 HydrophobicContact CD1-CG2 3.54Å; L188-L198 HydrophobicContact CD1-CD2 4.45Å; L188-L201 HydrophobicContact CD1-CD1 4.45Å; L188-L201 HydrophobicContact CD2-CD1 4.24Å
189	P	94.4	Very high	95.3	Very high	98 Å²	98	45.8 Å²	45.8	64%	0.636	25%	0.253	S	S	*	.	S	Bend	trans	-76.5	-7.2	-175.5	32.2	-37.4	0	0	0	113.9	F135 H151	F135-P189 HydrophobicContact CD1-CG 4.33Å; F135-P189 HydrophobicContact CE1-CG 4.16Å; H151-P189 VanDerWaalsContact CD2-C 3.47Å; H151-P189 PolarHBondContact CD2-O 3.4Å; H151-P189 PolarHBondContact NE2-O 3.46Å
190	S	94.6	Very high	94.9	Very high	50 Å²	50	44.5 Å²	44.5	35%	0.35	27%	0.272	S	S	.	.	S	Bend	trans	-155.4	170.7	-179.3	65.8	0	0	0	0	111.3	F135 H151 N152 L188	F135-S190 WeakPolarHBondContact CE1-OG 3.31Å; F135-S190 WeakPolarHBondContact CZ-OG 3.42Å; H151-S190 VanDerWaalsContact CB-C 3.42Å; N152-S190 PolarHBondContact ND2-O 2.84Å; L188-S190 PolarHBondContact O-N 2.9Å
191	A	95.2	Very high	94.8	Very high	49 Å²	49	37.9 Å²	37.9	41%	0.405	25%	0.249	S	C	.	.			trans	-67.3	139.8	176.3	0	0	0	0	0	110.8	H151 N152	H151-A191 HydrophobicContact CB-CB 4.37Å; H151-A191 WeakPolarHBondContact O-CB 3.42Å; N152-A191 WeakPolarHBondContact OD1-CA 3.16Å
192	V	95.1	Very high	94.6	Very high	9 Å²	9	39.1 Å²	39.1	6%	0.055	26%	0.256	C	S	.	.			trans	-78.3	125.2	171.4	178.9	0	0	0	0	108.2	F135 N152 L155 L185 L188 L198 L216	F135-V192 HydrophobicContact CD2-CG2 4.48Å; F135-V192 HydrophobicContact CE2-CG2 3.91Å; N152-V192 WeakPolarHBondContact OD1-CG2 3.34Å; N152-V192 PolarHBondContact OD1-N 3.25Å; L155-V192 HydrophobicContact CD1-CB 3.97Å; L155-V192 HydrophobicContact CD1-CG1 4.48Å; L155-V192 HydrophobicContact CD1-CG2 4.36Å; L185-V192 HydrophobicContact CD2-CG2 4.25Å; L188-V192 HydrophobicContact CD1-CG2 3.54Å; V192-L198 HydrophobicContact CB-CD2 4.48Å; V192-L198 HydrophobicContact CG1-CD1 4.11Å; V192-L198 HydrophobicContact CG1-CD2 3.86Å; V192-L198 HydrophobicContact CG1-CG 3.97Å; V192-L198 HydrophobicContact CG2-CD2 3.73Å; V192-L216 HydrophobicContact CG1-CD1 4.03Å; V192-L216 WeakPolarHBondContact O-CD2 3.37Å
193	T	88.8	Confident	94.5	Very high	110 Å²	110	41.5 Å²	41.5	68%	0.675	27%	0.272	S	S	*	.			trans	-117.4	-20.7	179.1	59.1	0	0	0	0	112.4	Q197	T193-Q197 PolarHBondContact OG1-OE1 3.36Å
194	N	89.1	Confident	94.4	Very high	45 Å²	45	40.9 Å²	40.9	24%	0.241	27%	0.265	C	S	.	.			trans	-138.8	142.9	-179.1	-169.6	-39.3	0	0	0	111.2	S196 Q197	N194-S196 VanDerWaalsContact CG-OG 3.27Å; N194-S196 PolarHBondContact O-N 3.32Å; N194-S196 PolarHBondContact OD1-N 3.35Å; N194-S196 PolarHBondContact OD1-OG 2.84Å; N194-Q197 HydrophobicContact CB-CG 4.35Å; N194-Q197 WeakPolarHBondContact O-CB 3.48Å; N194-Q197 PolarHBondContact O-N 2.98Å; N194-Q197 VanDerWaalsContact O-N 3.17Å; N194-Q197 PolarHBondContact O-OE1 3.17Å
195	M	92.9	Very high	94.2	Very high	53 Å²	53	42.8 Å²	42.8	26%	0.261	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-59	-32.2	175.1	-69.1	-58.9	-62.8	0	0	113.4	Q197 L198 L209 I212 K213 L216	M195-Q197 PolarHBondContact O-N 3.49Å; M195-L198 HydrophobicContact CE-CD1 4.29Å; M195-L198 WeakPolarHBondContact O-CB 3.48Å; M195-L198 PolarHBondContact O-N 3.28Å; M195-L198 HydrophobicContact SD-CD1 4.18Å; M195-L209 HydrophobicContact CE-CB 4.13Å; M195-L209 HydrophobicContact CE-CD2 3.78Å; M195-L209 WeakPolarHBondContact CE-O 3.44Å; M195-I212 HydrophobicContact SD-CG2 4Å; M195-K213 HydrophobicContact CE-CB 4.03Å; M195-K213 HydrophobicContact CG-CB 4.34Å; M195-K213 HydrophobicContact CG-CG 4.28Å; M195-K213 HydrophobicContact SD-CB 3.79Å; M195-K213 HydrophobicContact SD-CG 4.36Å; M195-L216 HydrophobicContact CG-CD1 4.33Å; M195-L216 HydrophobicContact SD-CD1 3.8Å
196	S	90.2	Very high	94.1	Very high	31 Å²	31	45 Å²	45	22%	0.217	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-61.8	-27.6	178.2	58.2	0	0	0	0	112.4	V132 N194 L198 T199	V132-S196 VanDerWaalsContact CG1-OG 3.27Å; V132-S196 WeakPolarHBondContact CG1-OG 3.32Å; N194-S196 VanDerWaalsContact CG-OG 3.27Å; N194-S196 PolarHBondContact O-N 3.32Å; N194-S196 PolarHBondContact OD1-N 3.35Å; N194-S196 PolarHBondContact OD1-OG 2.84Å; S196-L198 PolarHBondContact O-N 3.24Å; S196-T199 WeakPolarHBondContact O-CB 3.46Å; S196-T199 PolarHBondContact O-N 3.12Å; S196-T199 PolarHBondContact O-OG1 3.29Å
197	Q	94.3	Very high	94	Very high	25 Å²	25	44 Å²	44	12%	0.117	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-64.6	-22	175.6	-62.3	174.7	-51	0	0	113.4	V132 F135 T193 N194 M195	V132-Q197 HydrophobicContact CG1-CB 4.44Å; V132-Q197 HydrophobicContact CG1-CG 3.31Å; F135-Q197 HydrophobicContact CD2-CB 3.71Å; F135-Q197 WeakPolarHBondContact CD2-O 3.46Å; F135-Q197 HydrophobicContact CE2-CB 3.64Å; F135-Q197 HydrophobicContact CE2-CG 4.24Å; F135-Q197 PolarHBondContact N-O 2.94Å; T193-Q197 PolarHBondContact OG1-OE1 3.36Å; N194-Q197 HydrophobicContact CB-CG 4.35Å; N194-Q197 WeakPolarHBondContact O-CB 3.48Å; N194-Q197 PolarHBondContact O-N 2.98Å; N194-Q197 VanDerWaalsContact O-N 3.17Å; N194-Q197 PolarHBondContact O-OE1 3.17Å; M195-Q197 PolarHBondContact O-N 3.49Å
198	L	95.8	Very high	94	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.031	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-92.6	-4	-176.9	-56.1	179.2	0	0	0	113	L185 L188 V192 M195 S196 G200 L201 L204 L209 I212	L185-L198 HydrophobicContact CD2-CD2 3.93Å; L188-L198 HydrophobicContact CD1-CD2 4.45Å; V192-L198 HydrophobicContact CB-CD2 4.48Å; V192-L198 HydrophobicContact CG1-CD1 4.11Å; V192-L198 HydrophobicContact CG1-CD2 3.86Å; V192-L198 HydrophobicContact CG1-CG 3.97Å; V192-L198 HydrophobicContact CG2-CD2 3.73Å; M195-L198 HydrophobicContact CE-CD1 4.29Å; M195-L198 WeakPolarHBondContact O-CB 3.48Å; M195-L198 PolarHBondContact O-N 3.28Å; M195-L198 HydrophobicContact SD-CD1 4.18Å; S196-L198 PolarHBondContact O-N 3.24Å; L198-G200 PolarHBondContact O-N 2.88Å; L198-L201 HydrophobicContact CB-CD1 4.43Å; L198-L201 HydrophobicContact CD2-CD1 3.76Å; L198-L201 WeakPolarHBondContact O-CB 3.31Å; L198-L201 PolarHBondContact O-N 2.82Å; L198-L201 VanDerWaalsContact O-N 3.12Å; L198-L204 HydrophobicContact CB-CD1 3.9Å; L198-L204 HydrophobicContact CD1-CD1 4.31Å; L198-L204 HydrophobicContact CD2-CD1 4.09Å; L198-L204 HydrophobicContact CG-CD1 4.34Å; L198-L209 HydrophobicContact CB-CD2 4.28Å; L198-L209 HydrophobicContact CD1-CD2 4.18Å; L198-I212 HydrophobicContact CD1-CB 4.5Å; L198-I212 HydrophobicContact CD1-CD1 4.15Å; L198-I212 HydrophobicContact CD1-CG2 3.65Å
199	T	92.6	Very high	94.1	Very high	95 Å²	95	45.5 Å²	45.5	58%	0.583	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	127.1	-178.1	-54.2	0	0	0	0	110.5	S196 L201	S196-T199 WeakPolarHBondContact O-CB 3.46Å; S196-T199 PolarHBondContact O-N 3.12Å; S196-T199 PolarHBondContact O-OG1 3.29Å; T199-L201 PolarHBondContact O-N 2.87Å
200	G	90	Very high	94.2	Very high	77 Å²	77	47.6 Å²	47.6	79%	0.794	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	-2	178.4	0	0	0	0	0	115.1	L198	L198-G200 PolarHBondContact O-N 2.88Å
201	L	95.8	Very high	94.3	Very high	13 Å²	13	45.2 Å²	45.2	7%	0.068	29%	0.288	C	S	.	.			trans	-67.1	137.6	176.1	-70.4	-171.9	0	0	0	111.7	F135 V137 V184 L188 L198 T199 L204	F135-L201 HydrophobicContact CB-CD1 4.16Å; F135-L201 HydrophobicContact CB-CD2 4.01Å; F135-L201 HydrophobicContact CB-CG 4.46Å; F135-L201 WeakPolarHBondContact O-CD2 3.36Å; V137-L201 HydrophobicContact CG2-CD2 3.77Å; V184-L201 HydrophobicContact CG1-CB 4.48Å; V184-L201 HydrophobicContact CG1-CD1 4.19Å; L188-L201 HydrophobicContact CD1-CD1 4.45Å; L188-L201 HydrophobicContact CD2-CD1 4.24Å; L198-L201 HydrophobicContact CB-CD1 4.43Å; L198-L201 HydrophobicContact CD2-CD1 3.76Å; L198-L201 WeakPolarHBondContact O-CB 3.31Å; L198-L201 PolarHBondContact O-N 2.82Å; L198-L201 VanDerWaalsContact O-N 3.12Å; T199-L201 PolarHBondContact O-N 2.87Å; L201-L204 HydrophobicContact CB-CD1 3.76Å; L201-L204 HydrophobicContact CB-CG 4.23Å; L201-L204 HydrophobicContact CD1-CD1 3.96Å; L201-L204 HydrophobicContact CG-CD1 4.47Å
202	P	94.8	Very high	94.4	Very high	25 Å²	25	42.9 Å²	42.9	16%	0.162	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	158.3	179.1	30.3	-35.1	0	0	0	111	V137 S139 V184 L204	V137-P202 HydrophobicContact CG2-CG 4.24Å; S139-P202 WeakPolarHBondContact OG-CB 3.44Å; V184-P202 HydrophobicContact CG2-CG 4.35Å; P202-L204 PolarHBondContact O-N 2.73Å
203	C	95.4	Very high	94.3	Very high	51 Å²	51	47 Å²	47	35%	0.345	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	3.1	174.4	-50.6	0	0	0	0	116.3	R180 V184 G205	R180-C203 HydrophobicContact CB-CB 3.73Å; V184-C203 HydrophobicContact CG2-CB 4.25Å; C203-G205 PolarHBondContact O-N 3.28Å
204	L	96.1	Very high	94.4	Very high	19 Å²	19	44 Å²	44	10%	0.099	27%	0.266	C	S	.	.			trans	-91.8	83.8	172.2	-62.1	-172.2	0	0	0	110.2	A181 L198 L201 P202 L209 I212	A181-L204 HydrophobicContact CB-CD2 3.7Å; L198-L204 HydrophobicContact CB-CD1 3.9Å; L198-L204 HydrophobicContact CD1-CD1 4.31Å; L198-L204 HydrophobicContact CD2-CD1 4.09Å; L198-L204 HydrophobicContact CG-CD1 4.34Å; L201-L204 HydrophobicContact CB-CD1 3.76Å; L201-L204 HydrophobicContact CB-CG 4.23Å; L201-L204 HydrophobicContact CD1-CD1 3.96Å; L201-L204 HydrophobicContact CG-CD1 4.47Å; P202-L204 PolarHBondContact O-N 2.73Å; L204-L209 HydrophobicContact CB-CD2 4.03Å; L204-L209 HydrophobicContact CB-CG 4.14Å; L204-L209 HydrophobicContact CD1-CD2 4.21Å; L204-I212 HydrophobicContact CD2-CD1 4.09Å
205	G	93.4	Very high	94.6	Very high	39 Å²	39	42.5 Å²	42.5	40%	0.402	26%	0.258	S	S	.	.			trans	-71.6	165.5	173.6	0	0	0	0	0	112.5	C203 H207 S208 L209	C203-G205 PolarHBondContact O-N 3.28Å; G205-H207 PolarHBondContact O-N 3.08Å; G205-H207 VanDerWaalsContact O-N 3.08Å; G205-S208 PolarHBondContact O-N 3.13Å; G205-L209 PolarHBondContact O-N 2.83Å
206	G	95.1	Very high	94.3	Very high	48 Å²	48	42 Å²	42	50%	0.495	26%	0.256	S	S	.	.	H	α-helix	trans	-54.5	-32.2	-178	0	0	0	0	0	114.3	R210	G206-R210 WeakPolarHBondContact O-CG 3.4Å; G206-R210 PolarHBondContact O-N 3.02Å; G206-R210 VanDerWaalsContact O-N 3.07Å
207	H	96.6	Very high	94	Very high	57 Å²	57	43.1 Å²	43.1	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-69.3	-50.5	174.8	-158.4	153.6	0	0	0	112.3	R174 G205 L209 R210 V211 E223	R174-H207 PolarHBondContact NH2-CE1 3.08Å; G205-H207 PolarHBondContact O-N 3.08Å; G205-H207 VanDerWaalsContact O-N 3.08Å; H207-L209 VanDerWaalsContact C-N 3.26Å; H207-L209 PolarHBondContact O-N 2.76Å; H207-R210 VanDerWaalsContact CG-NH2 3.33Å; H207-R210 WeakPolarHBondContact O-CB 3.45Å; H207-R210 PolarHBondContact O-N 2.88Å; H207-R210 VanDerWaalsContact O-N 3.11Å; H207-V211 PolarHBondContact O-N 3.32Å; H207-V211 VanDerWaalsContact O-N 3.08Å; H207-E223 IonicContact CD2-OE2 3.66Å; H207-E223 IonicContact CE1-OE1 2.72Å; H207-E223 IonicContact CE1-OE2 3.65Å; H207-E223 IonicContact NE2-OE1 2.91Å; H207-E223 PolarHBondContact NE2-OE1 3.4Å; H207-E223 IonicContact NE2-OE2 2.72Å; H207-E223 PolarHBondContact NE2-OE2 3.38Å
208	S	97.6	Very high	93.6	Very high	4 Å²	4	44.6 Å²	44.6	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-58.7	-40.8	176.6	-51.1	0	0	0	0	111.5	G205 R210 V211 I212	G205-S208 PolarHBondContact O-N 3.13Å; S208-R210 PolarHBondContact O-N 3.37Å; S208-V211 PolarHBondContact O-N 2.9Å; S208-I212 WeakPolarHBondContact O-CD1 3.3Å; S208-I212 VanDerWaalsContact O-CG1 3.23Å; S208-I212 WeakPolarHBondContact O-CG1 3.49Å; S208-I212 PolarHBondContact O-N 3.17Å
209	L	97.5	Very high	93	Very high	51 Å²	51	46.4 Å²	46.4	27%	0.267	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-38.2	175.8	-71.6	170.1	0	0	0	112.7	M195 L198 L204 G205 H207 I212 K213	M195-L209 HydrophobicContact CE-CB 4.13Å; M195-L209 HydrophobicContact CE-CD2 3.78Å; M195-L209 WeakPolarHBondContact CE-O 3.44Å; L198-L209 HydrophobicContact CB-CD2 4.28Å; L198-L209 HydrophobicContact CD1-CD2 4.18Å; L204-L209 HydrophobicContact CB-CD2 4.03Å; L204-L209 HydrophobicContact CB-CG 4.14Å; L204-L209 HydrophobicContact CD1-CD2 4.21Å; G205-L209 PolarHBondContact O-N 2.83Å; H207-L209 VanDerWaalsContact C-N 3.26Å; H207-L209 PolarHBondContact O-N 2.76Å; L209-I212 PolarHBondContact O-N 3.05Å; L209-K213 VanDerWaalsContact O-CB 3.23Å; L209-K213 WeakPolarHBondContact O-CB 3.4Å; L209-K213 PolarHBondContact O-N 3.09Å
210	R	96.6	Very high	92.7	Very high	143 Å²	143	45.3 Å²	45.3	54%	0.54	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-47	173.2	-75.9	-171.8	-52.9	-94.5	4.2	111.8	G206 H207 S208 I212 K213 D214	G206-R210 WeakPolarHBondContact O-CG 3.4Å; G206-R210 PolarHBondContact O-N 3.02Å; G206-R210 VanDerWaalsContact O-N 3.07Å; H207-R210 VanDerWaalsContact CG-NH2 3.33Å; H207-R210 WeakPolarHBondContact O-CB 3.45Å; H207-R210 PolarHBondContact O-N 2.88Å; H207-R210 VanDerWaalsContact O-N 3.11Å; S208-R210 PolarHBondContact O-N 3.37Å; R210-I212 VanDerWaalsContact C-N 3.33Å; R210-I212 PolarHBondContact O-N 3.42Å; R210-K213 PolarHBondContact O-N 3.28Å; R210-D214 VanDerWaalsContact O-CG 3.26Å; R210-D214 PolarHBondContact O-N 3.43Å
211	V	97.2	Very high	92.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-44.5	177.9	174.7	0	0	0	0	110.9	L159 L162 H207 S208 D214 I215 V224	L159-V211 HydrophobicContact CD2-CB 4.31Å; L159-V211 HydrophobicContact CD2-CG1 4.15Å; L162-V211 HydrophobicContact CD1-CG1 4.05Å; L162-V211 HydrophobicContact CD1-CG2 3.71Å; H207-V211 PolarHBondContact O-N 3.32Å; H207-V211 VanDerWaalsContact O-N 3.08Å; S208-V211 PolarHBondContact O-N 2.9Å; V211-D214 PolarHBondContact O-N 2.87Å; V211-I215 HydrophobicContact CG1-CD1 3.96Å; V211-I215 WeakPolarHBondContact O-CD1 3.48Å; V211-I215 VanDerWaalsContact O-CG1 3.3Å; V211-I215 WeakPolarHBondContact O-CG1 3.28Å; V211-I215 PolarHBondContact O-N 2.95Å; V211-I215 VanDerWaalsContact O-N 3.16Å; V211-V224 HydrophobicContact CG1-CG2 4.12Å
212	I	97.1	Very high	92.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-46.2	177.3	-66.1	160.8	0	0	0	110.5	L155 L159 L185 M195 L198 L204 S208 L209 R210 D214 I215 L216	L155-I212 HydrophobicContact CD1-CG2 3.97Å; L155-I212 HydrophobicContact CD2-CB 4.47Å; L155-I212 HydrophobicContact CD2-CG2 4.01Å; L159-I212 HydrophobicContact CD1-CD1 4.36Å; L159-I212 HydrophobicContact CD1-CG1 4.32Å; L185-I212 HydrophobicContact CD1-CD1 3.92Å; L185-I212 HydrophobicContact CD1-CG1 4.27Å; M195-I212 HydrophobicContact SD-CG2 4Å; L198-I212 HydrophobicContact CD1-CB 4.5Å; L198-I212 HydrophobicContact CD1-CD1 4.15Å; L198-I212 HydrophobicContact CD1-CG2 3.65Å; L204-I212 HydrophobicContact CD2-CD1 4.09Å; S208-I212 WeakPolarHBondContact O-CD1 3.3Å; S208-I212 VanDerWaalsContact O-CG1 3.23Å; S208-I212 WeakPolarHBondContact O-CG1 3.49Å; S208-I212 PolarHBondContact O-N 3.17Å; L209-I212 PolarHBondContact O-N 3.05Å; R210-I212 VanDerWaalsContact C-N 3.33Å; R210-I212 PolarHBondContact O-N 3.42Å; I212-D214 PolarHBondContact O-N 3.3Å; I212-I215 PolarHBondContact O-N 2.96Å; I212-L216 HydrophobicContact CG2-CD1 3.89Å; I212-L216 HydrophobicContact CG2-CG 4.21Å; I212-L216 WeakPolarHBondContact O-CG 3.3Å; I212-L216 PolarHBondContact O-N 3.48Å
213	K	93.3	Very high	92.7	Very high	95 Å²	95	46.5 Å²	46.5	41%	0.413	27%	0.273	S	S	.	.	H	α-helix	trans	-58	-48.5	177.8	-175.7	180	178.9	-178.6	0	111.5	M195 L209 R210 I215 L216 E217	M195-K213 HydrophobicContact CE-CB 4.03Å; M195-K213 HydrophobicContact CG-CB 4.34Å; M195-K213 HydrophobicContact CG-CG 4.28Å; M195-K213 HydrophobicContact SD-CB 3.79Å; M195-K213 HydrophobicContact SD-CG 4.36Å; L209-K213 VanDerWaalsContact O-CB 3.23Å; L209-K213 WeakPolarHBondContact O-CB 3.4Å; L209-K213 PolarHBondContact O-N 3.09Å; R210-K213 PolarHBondContact O-N 3.28Å; K213-I215 VanDerWaalsContact C-N 3.26Å; K213-I215 PolarHBondContact O-N 3.46Å; K213-L216 PolarHBondContact O-N 2.84Å; K213-E217 VanDerWaalsContact CE-CD 3.42Å; K213-E217 WeakPolarHBondContact CE-OE1 3.27Å; K213-E217 HydrophobicContact CG-CG 4.18Å; K213-E217 IonicContact NZ-OE1 3.17Å; K213-E217 VanDerWaalsContact O-CB 3.3Å; K213-E217 WeakPolarHBondContact O-CB 3.4Å; K213-E217 VanDerWaalsContact O-CG 3.32Å; K213-E217 WeakPolarHBondContact O-CG 3.42Å; K213-E217 PolarHBondContact O-N 2.86Å
214	D	90.8	Very high	92.8	Very high	47 Å²	47	44.3 Å²	44.3	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-55.9	-44.9	178.4	-69.5	-13.1	0	0	0	110.9	R210 V211 I212 E217 N218 T220 S221	R210-D214 VanDerWaalsContact O-CG 3.26Å; R210-D214 PolarHBondContact O-N 3.43Å; V211-D214 PolarHBondContact O-N 2.87Å; I212-D214 PolarHBondContact O-N 3.3Å; D214-E217 PolarHBondContact O-N 3.12Å; D214-N218 WeakPolarHBondContact O-CA 3.24Å; D214-N218 VanDerWaalsContact O-CB 3.24Å; D214-N218 WeakPolarHBondContact O-CB 3.21Å; D214-N218 PolarHBondContact O-N 2.94Å; D214-N218 PolarHBondContact O-ND2 3.47Å; D214-T220 CarbonylContact C-O 3.55Å; D214-T220 VanDerWaalsContact C-O 3.23Å; D214-T220 VanDerWaalsContact O-O 3.06Å; D214-S221 PolarHBondContact OD2-OG 3.47Å
215	I	92.8	Very high	92.8	Very high	14 Å²	14	46.5 Å²	46.5	7%	0.072	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-42.1	-179.5	-64.4	164.2	0	0	0	111.5	V154 L155 A158 V211 I212 K213 E217 G219	V154-I215 HydrophobicContact CG1-CG2 3.76Å; L155-I215 HydrophobicContact CD2-CB 3.79Å; L155-I215 HydrophobicContact CD2-CD1 4.11Å; L155-I215 HydrophobicContact CD2-CG2 3.62Å; A158-I215 HydrophobicContact CB-CD1 3.4Å; V211-I215 HydrophobicContact CG1-CD1 3.96Å; V211-I215 WeakPolarHBondContact O-CD1 3.48Å; V211-I215 VanDerWaalsContact O-CG1 3.3Å; V211-I215 WeakPolarHBondContact O-CG1 3.28Å; V211-I215 PolarHBondContact O-N 2.95Å; V211-I215 VanDerWaalsContact O-N 3.16Å; I212-I215 PolarHBondContact O-N 2.96Å; K213-I215 VanDerWaalsContact C-N 3.26Å; K213-I215 PolarHBondContact O-N 3.46Å; I215-E217 VanDerWaalsContact C-N 3.3Å; I215-E217 PolarHBondContact O-N 2.95Å; I215-G219 CarbonylContact O-C 3.43Å; I215-G219 WeakPolarHBondContact O-CA 3.29Å; I215-G219 PolarHBondContact O-N 3.31Å
216	L	87.4	Confident	93	Very high	43 Å²	43	48.2 Å²	48.2	23%	0.225	27%	0.273	C	S	.	.	H	α-helix	trans	-65.1	-36.4	177.4	-68.3	178.7	0	0	0	112	L155 V192 M195 I212 K213	L155-L216 HydrophobicContact CD2-CD2 4.49Å; V192-L216 HydrophobicContact CG1-CD1 4.03Å; V192-L216 WeakPolarHBondContact O-CD2 3.37Å; M195-L216 HydrophobicContact CG-CD1 4.33Å; M195-L216 HydrophobicContact SD-CD1 3.8Å; I212-L216 HydrophobicContact CG2-CD1 3.89Å; I212-L216 HydrophobicContact CG2-CG 4.21Å; I212-L216 WeakPolarHBondContact O-CG 3.3Å; I212-L216 PolarHBondContact O-N 3.48Å; K213-L216 PolarHBondContact O-N 2.84Å
217	E	84.4	Confident	93.1	Very high	54 Å²	54	46.7 Å²	46.7	25%	0.252	25%	0.254	S	S	.	.	H	α-helix	trans	-86.2	-37.2	-175.5	-72.4	-170.9	172.2	0	0	113.8	R40 K41 K213 D214 I215	R40-E217 IonicContact CZ-OE2 2.78Å; R40-E217 VanDerWaalsContact NH2-CB 3.32Å; R40-E217 IonicContact NH2-OE1 2.72Å; R40-E217 IonicContact NH2-OE2 3.6Å; R40-E217 PolarHBondContact NH2-OE2 3.43Å; K41-E217 VanDerWaalsContact CG-O 3.32Å; K41-E217 WeakPolarHBondContact CG-O 3.24Å; K213-E217 VanDerWaalsContact CE-CD 3.42Å; K213-E217 WeakPolarHBondContact CE-OE1 3.27Å; K213-E217 HydrophobicContact CG-CG 4.18Å; K213-E217 IonicContact NZ-OE1 3.17Å; K213-E217 VanDerWaalsContact O-CB 3.3Å; K213-E217 WeakPolarHBondContact O-CB 3.4Å; K213-E217 VanDerWaalsContact O-CG 3.32Å; K213-E217 WeakPolarHBondContact O-CG 3.42Å; K213-E217 PolarHBondContact O-N 2.86Å; D214-E217 PolarHBondContact O-N 3.12Å; I215-E217 VanDerWaalsContact C-N 3.3Å; I215-E217 PolarHBondContact O-N 2.95Å
218	N	84.5	Confident	93.1	Very high	55 Å²	55	48.4 Å²	48.4	29%	0.294	26%	0.261	S	S	.	.	H	α-helix	trans	-119.6	-0.1	-169.7	-49.1	-48.4	0	0	0	113	R40 D214 T220	R40-N218 CarbonylContact O-C 3.45Å; R40-N218 VanDerWaalsContact O-CA 3.28Å; R40-N218 WeakPolarHBondContact O-CA 3.4Å; D214-N218 WeakPolarHBondContact O-CA 3.24Å; D214-N218 VanDerWaalsContact O-CB 3.24Å; D214-N218 WeakPolarHBondContact O-CB 3.21Å; D214-N218 PolarHBondContact O-N 2.94Å; D214-N218 PolarHBondContact O-ND2 3.47Å; N218-T220 PolarHBondContact O-N 3.34Å
219	G	83.2	Confident	93	Very high	45 Å²	45	54.7 Å²	54.7	46%	0.464	29%	0.29	S	S	.	.	S	Bend	trans	74.2	-16.8	-174.1	0	0	0	0	0	114.6	I215	I215-G219 CarbonylContact O-C 3.43Å; I215-G219 WeakPolarHBondContact O-CA 3.29Å; I215-G219 PolarHBondContact O-N 3.31Å
220	T	87.8	Confident	93	Very high	72 Å²	72	54.2 Å²	54.2	44%	0.442	29%	0.291	S	S	.	.	S	Bend	trans	-144.5	166.8	-179.9	70.8	0	0	0	0	111.3	D214 N218	D214-T220 CarbonylContact C-O 3.55Å; D214-T220 VanDerWaalsContact C-O 3.23Å; D214-T220 VanDerWaalsContact O-O 3.06Å; N218-T220 PolarHBondContact O-N 3.34Å
221	S	94.6	Very high	93	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.014	29%	0.294	C	S	.	.			trans	-116.1	130.7	168.7	173.6	0	0	0	0	109.5	D214 E223 V224 E225	D214-S221 PolarHBondContact OD2-OG 3.47Å; S221-E223 VanDerWaalsContact C-N 3.25Å; S221-E223 PolarHBondContact O-N 3.49Å; S221-V224 WeakPolarHBondContact O-CB 3.37Å; S221-V224 PolarHBondContact O-N 3.08Å; S221-E225 PolarHBondContact O-N 3.24Å
222	S	90.5	Very high	92.9	Very high	92 Å²	92	59 Å²	59	64%	0.643	31%	0.314	S	S	*	.	H	α-helix	trans	-60.2	-35.9	-179.5	57	0	0	0	0	112.5	V224 E225 S226	S222-V224 VanDerWaalsContact C-N 3.34Å; S222-E225 PolarHBondContact O-N 3Å; S222-S226 VanDerWaalsContact O-CB 3.24Å; S222-S226 WeakPolarHBondContact O-CB 3.43Å; S222-S226 PolarHBondContact O-N 3.01Å
223	E	95.6	Very high	92.9	Very high	46 Å²	46	59.3 Å²	59.3	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-41.6	174.4	-175.8	-176.8	164.8	0	0	111.6	L162 R174 H207 S221 T227	L162-E223 HydrophobicContact CD1-CG 4.44Å; L162-E223 HydrophobicContact CD2-CG 3.89Å; R174-E223 IonicContact CZ-OE1 3.26Å; R174-E223 IonicContact NH2-OE1 2.83Å; R174-E223 PolarHBondContact NH2-OE1 3.5Å; H207-E223 IonicContact CD2-OE2 3.66Å; H207-E223 IonicContact CE1-OE1 2.72Å; H207-E223 IonicContact CE1-OE2 3.65Å; H207-E223 IonicContact NE2-OE1 2.91Å; H207-E223 PolarHBondContact NE2-OE1 3.4Å; H207-E223 IonicContact NE2-OE2 2.72Å; H207-E223 PolarHBondContact NE2-OE2 3.38Å; S221-E223 VanDerWaalsContact C-N 3.25Å; S221-E223 PolarHBondContact O-N 3.49Å; E223-T227 WeakPolarHBondContact O-CB 3.39Å; E223-T227 PolarHBondContact O-N 2.9Å; E223-T227 PolarHBondContact O-OG1 3.4Å
224	V	97.2	Very high	93.2	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.03	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-46.4	179.2	175	0	0	0	0	110.3	A158 L161 L162 V211 S221 S222 T227 K228	A158-V224 HydrophobicContact CB-CG1 4.26Å; A158-V224 HydrophobicContact CB-CG2 3.88Å; L161-V224 HydrophobicContact CD2-CG1 4.43Å; L162-V224 HydrophobicContact CD1-CG2 3.89Å; L162-V224 HydrophobicContact CD2-CG2 4.19Å; L162-V224 HydrophobicContact CG-CG2 4Å; V211-V224 HydrophobicContact CG1-CG2 4.12Å; S221-V224 WeakPolarHBondContact O-CB 3.37Å; S221-V224 PolarHBondContact O-N 3.08Å; S222-V224 VanDerWaalsContact C-N 3.34Å; V224-T227 PolarHBondContact O-N 3.35Å; V224-K228 WeakPolarHBondContact O-CG 3.34Å; V224-K228 PolarHBondContact O-N 3.25Å
225	E	96.3	Very high	93.5	Very high	64 Å²	64	56.8 Å²	56.8	30%	0.299	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-45.2	178	-63.3	-48.9	126.3	0	0	111.7	S221 S222 T227 K228 E229	S221-E225 PolarHBondContact O-N 3.24Å; S222-E225 PolarHBondContact O-N 3Å; E225-T227 VanDerWaalsContact C-N 3.26Å; E225-T227 PolarHBondContact O-N 3.07Å; E225-K228 WeakPolarHBondContact O-CB 3.39Å; E225-K228 PolarHBondContact O-N 3.08Å; E225-K228 VanDerWaalsContact O-N 3.11Å; E225-K228 IonicContact OE1-NZ 3.16Å; E225-K228 PolarHBondContact OE1-NZ 3.39Å; E225-K228 IonicContact OE2-NZ 3.01Å; E225-E229 WeakPolarHBondContact O-CG 3.37Å; E225-E229 PolarHBondContact O-N 3.23Å
226	S	96.8	Very high	93.7	Very high	76 Å²	76	56.1 Å²	56.1	53%	0.531	30%	0.3	S	S	.	.	H	α-helix	trans	-59.1	-38	174.5	-177.9	0	0	0	0	112.3	S222 E229 S230	S222-S226 VanDerWaalsContact O-CB 3.24Å; S222-S226 WeakPolarHBondContact O-CB 3.43Å; S222-S226 PolarHBondContact O-N 3.01Å; S226-E229 PolarHBondContact O-N 2.93Å; S226-S230 PolarHBondContact O-N 3.5Å
227	T	97.3	Very high	94.1	Very high	15 Å²	15	58.1 Å²	58.1	9%	0.092	31%	0.307	C	S	.	.	H	α-helix	trans	-67.2	-41.2	176.1	-57.6	0	0	0	0	111.7	L161 N165 E223 V224 E225 E229 S230 F233	L161-T227 HydrophobicContact CD2-CG2 3.5Å; L161-T227 VanDerWaalsContact CD2-CG2 3.5Å; N165-T227 HydrophobicContact CB-CG2 3.61Å; E223-T227 WeakPolarHBondContact O-CB 3.39Å; E223-T227 PolarHBondContact O-N 2.9Å; E223-T227 PolarHBondContact O-OG1 3.4Å; V224-T227 PolarHBondContact O-N 3.35Å; E225-T227 VanDerWaalsContact C-N 3.26Å; E225-T227 PolarHBondContact O-N 3.07Å; T227-E229 VanDerWaalsContact C-N 3.29Å; T227-E229 PolarHBondContact O-N 3.09Å; T227-S230 WeakPolarHBondContact O-CB 3.43Å; T227-S230 PolarHBondContact O-N 3.15Å; T227-F233 HydrophobicContact CG2-CD1 3.94Å; T227-F233 HydrophobicContact CG2-CD2 4.47Å; T227-F233 HydrophobicContact CG2-CE1 4.15Å; T227-F233 HydrophobicContact CG2-CG 4.09Å; T227-F233 HydrophobicContact CG2-CZ 4.5Å; T227-F233 VanDerWaalsContact O-CD1 3.22Å; T227-F233 WeakPolarHBondContact O-CD1 3.28Å
228	K	96.1	Very high	94.7	Very high	94 Å²	94	57.6 Å²	57.6	41%	0.409	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-38.2	174.8	-72.7	169.7	-177.8	169.8	0	112.1	L161 V224 E225 K234	L161-K228 HydrophobicContact CD1-CD 4.32Å; L161-K228 HydrophobicContact CD1-CG 3.54Å; L161-K228 HydrophobicContact CD2-CG 4.5Å; V224-K228 WeakPolarHBondContact O-CG 3.34Å; V224-K228 PolarHBondContact O-N 3.25Å; E225-K228 WeakPolarHBondContact O-CB 3.39Å; E225-K228 PolarHBondContact O-N 3.08Å; E225-K228 VanDerWaalsContact O-N 3.11Å; E225-K228 IonicContact OE1-NZ 3.16Å; E225-K228 PolarHBondContact OE1-NZ 3.39Å; E225-K228 IonicContact OE2-NZ 3.01Å; K228-K234 WeakPolarHBondContact O-CE 3.44Å
229	E	96.5	Very high	95.4	Very high	135 Å²	135	55 Å²	55	63%	0.631	29%	0.293	S	S	*	.	H	α-helix	trans	-78.8	-19.4	-178.7	-69.4	178.8	168.7	0	0	113.3	E225 S226 T227 E231 K234	E225-E229 WeakPolarHBondContact O-CG 3.37Å; E225-E229 PolarHBondContact O-N 3.23Å; S226-E229 PolarHBondContact O-N 2.93Å; T227-E229 VanDerWaalsContact C-N 3.29Å; T227-E229 PolarHBondContact O-N 3.09Å; E229-E231 PolarHBondContact O-N 3.45Å; E229-K234 WeakPolarHBondContact O-CE 3.48Å; E229-K234 PolarHBondContact O-NZ 3.11Å
230	S	97.4	Very high	96	Very high	42 Å²	42	54.7 Å²	54.7	29%	0.294	28%	0.282	S	S	.	.			trans	-57.7	117.3	-179.6	174.7	0	0	0	0	113.2	S226 T227 R232 F233 K234	S226-S230 PolarHBondContact O-N 3.5Å; T227-S230 WeakPolarHBondContact O-CB 3.43Å; T227-S230 PolarHBondContact O-N 3.15Å; S230-R232 VanDerWaalsContact C-N 3.25Å; S230-R232 PolarHBondContact O-N 3.14Å; S230-F233 PolarHBondContact O-N 3.36Å; S230-F233 VanDerWaalsContact O-N 3.15Å; S230-F233 PolarHBondContact OG-N 3.26Å; S230-K234 WeakPolarHBondContact O-CG 3.39Å; S230-K234 PolarHBondContact O-N 3.42Å
231	E	96.7	Very high	96.4	Very high	129 Å²	129	52.9 Å²	52.9	60%	0.603	28%	0.278	S	S	*	.	H	α-helix	trans	-60.5	-35.5	174.9	-66.4	-54.4	121.1	0	0	112.3	E229 K234 A235	E229-E231 PolarHBondContact O-N 3.45Å; E231-K234 IonicContact OE1-NZ 3.03Å; E231-K234 PolarHBondContact OE1-NZ 3.32Å; E231-A235 WeakPolarHBondContact O-CB 3.27Å; E231-A235 PolarHBondContact O-N 2.99Å
232	R	95.6	Very high	96.6	Very high	113 Å²	113	53 Å²	53	43%	0.426	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-46.4	174.8	-179.3	-176.9	172.9	101.6	9.1	110.8	S230 A235 L236 D251	S230-R232 VanDerWaalsContact C-N 3.25Å; S230-R232 PolarHBondContact O-N 3.14Å; R232-A235 PolarHBondContact O-N 3.05Å; R232-L236 HydrophobicContact CG-CD1 4.06Å; R232-L236 WeakPolarHBondContact O-CB 3.19Å; R232-L236 WeakPolarHBondContact O-CG 3.31Å; R232-L236 PolarHBondContact O-N 2.9Å; R232-D251 IonicContact CZ-OD1 3.5Å; R232-D251 IonicContact NH1-OD1 3.65Å; R232-D251 IonicContact NH2-OD1 2.76Å; R232-D251 PolarHBondContact NH2-OD1 3.47Å
233	F	97	Very high	96.9	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-66.4	-43.2	-179.7	-179	-120	0	0	0	111.6	L161 E164 N165 L168 T227 S230 A235 L236 K237	L161-F233 HydrophobicContact CD1-CE1 4.47Å; L161-F233 HydrophobicContact CD2-CE1 4.24Å; L161-F233 HydrophobicContact CD2-CZ 4.48Å; L161-F233 HydrophobicContact CG-CE1 4.11Å; L161-F233 HydrophobicContact CG-CZ 4.2Å; E164-F233 HydrophobicContact CG-CE2 4.26Å; E164-F233 HydrophobicContact CG-CZ 4.37Å; N165-F233 VanDerWaalsContact CA-CE2 3.44Å; N165-F233 HydrophobicContact CB-CD2 3.68Å; N165-F233 HydrophobicContact CB-CE2 3.53Å; N165-F233 HydrophobicContact CB-CG 4.48Å; N165-F233 HydrophobicContact CB-CZ 4.2Å; N165-F233 WeakPolarHBondContact OD1-CD2 3.32Å; L168-F233 HydrophobicContact CD1-CD2 4.45Å; L168-F233 HydrophobicContact CD1-CE2 4.08Å; T227-F233 HydrophobicContact CG2-CD1 3.94Å; T227-F233 HydrophobicContact CG2-CD2 4.47Å; T227-F233 HydrophobicContact CG2-CE1 4.15Å; T227-F233 HydrophobicContact CG2-CG 4.09Å; T227-F233 HydrophobicContact CG2-CZ 4.5Å; T227-F233 VanDerWaalsContact O-CD1 3.22Å; T227-F233 WeakPolarHBondContact O-CD1 3.28Å; S230-F233 PolarHBondContact O-N 3.36Å; S230-F233 VanDerWaalsContact O-N 3.15Å; S230-F233 PolarHBondContact OG-N 3.26Å; F233-A235 PolarHBondContact O-N 3.03Å; F233-L236 PolarHBondContact O-N 2.78Å; F233-K237 HydrophobicContact CD1-CD 4.36Å; F233-K237 HydrophobicContact CD2-CG 4.37Å; F233-K237 HydrophobicContact CE1-CD 3.7Å; F233-K237 HydrophobicContact CE1-CG 4.31Å; F233-K237 HydrophobicContact CE2-CD 4.1Å; F233-K237 HydrophobicContact CE2-CG 3.99Å; F233-K237 HydrophobicContact CZ-CD 3.57Å; F233-K237 HydrophobicContact CZ-CG 3.99Å; F233-K237 WeakPolarHBondContact O-CG 3.31Å; F233-K237 PolarHBondContact O-N 2.72Å
234	K	97.8	Very high	96.8	Very high	87 Å²	87	49.8 Å²	49.8	38%	0.378	26%	0.263	S	S	.	.	H	α-helix	trans	-57.5	-47.3	174.2	-68.1	173	-165	164	0	111.6	K228 E229 S230 E231 K237 V238	K228-K234 WeakPolarHBondContact O-CE 3.44Å; E229-K234 WeakPolarHBondContact O-CE 3.48Å; E229-K234 PolarHBondContact O-NZ 3.11Å; S230-K234 WeakPolarHBondContact O-CG 3.39Å; S230-K234 PolarHBondContact O-N 3.42Å; E231-K234 IonicContact OE1-NZ 3.03Å; E231-K234 PolarHBondContact OE1-NZ 3.32Å; K234-K237 PolarHBondContact O-N 3.46Å; K234-V238 WeakPolarHBondContact O-CG2 3.49Å; K234-V238 PolarHBondContact O-N 2.93Å
235	A	97.9	Very high	96.8	Very high	3 Å²	3	50.1 Å²	50.1	3%	0.025	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-45.4	177.3	0	0	0	0	0	111.9	E231 R232 F233 K237 V238 L239 I254 H259	E231-A235 WeakPolarHBondContact O-CB 3.27Å; E231-A235 PolarHBondContact O-N 2.99Å; R232-A235 PolarHBondContact O-N 3.05Å; F233-A235 PolarHBondContact O-N 3.03Å; A235-K237 PolarHBondContact O-N 3.41Å; A235-V238 PolarHBondContact O-N 3.23Å; A235-L239 WeakPolarHBondContact O-CB 3.49Å; A235-L239 VanDerWaalsContact O-CG 3.28Å; A235-L239 WeakPolarHBondContact O-CG 3.42Å; A235-L239 PolarHBondContact O-N 3.18Å; A235-I254 HydrophobicContact CB-CD1 3.74Å; A235-I254 HydrophobicContact CB-CG1 3.94Å; A235-H259 WeakPolarHBondContact CA-O 3.32Å; A235-H259 HydrophobicContact CB-CB 3.98Å
236	L	97.2	Very high	96.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57	-49.5	175.9	-76.6	167	0	0	0	110.9	L168 R232 F233 V238 L239 T240 A250 I254	L168-L236 HydrophobicContact CB-CB 4.36Å; L168-L236 HydrophobicContact CB-CD1 4.1Å; L168-L236 HydrophobicContact CD1-CB 4.11Å; R232-L236 HydrophobicContact CG-CD1 4.06Å; R232-L236 WeakPolarHBondContact O-CB 3.19Å; R232-L236 WeakPolarHBondContact O-CG 3.31Å; R232-L236 PolarHBondContact O-N 2.9Å; F233-L236 PolarHBondContact O-N 2.78Å; L236-V238 PolarHBondContact O-N 3.23Å; L236-L239 PolarHBondContact O-N 3.16Å; L236-T240 WeakPolarHBondContact O-CB 3.45Å; L236-T240 WeakPolarHBondContact O-CG2 3.35Å; L236-T240 PolarHBondContact O-N 3.32Å; L236-T240 PolarHBondContact O-OG1 3.35Å; L236-A250 HydrophobicContact CD2-CB 4.03Å; L236-I254 HydrophobicContact CB-CD1 4.41Å; L236-I254 HydrophobicContact CD2-CD1 3.62Å; L236-I254 HydrophobicContact CG-CD1 3.6Å
237	K	96.3	Very high	96.7	Very high	85 Å²	85	47.1 Å²	47.1	37%	0.37	26%	0.258	S	S	.	.	H	α-helix	trans	-60.6	-42.3	178.5	-73.3	-161.7	71.5	146.2	0	113.2	E164 L168 F233 K234 A235 G241	E164-K237 VanDerWaalsContact CD-NZ 3.29Å; E164-K237 WeakPolarHBondContact OE1-CE 3.46Å; E164-K237 IonicContact OE1-NZ 3.91Å; E164-K237 PolarHBondContact OE1-NZ 2.89Å; E164-K237 VanDerWaalsContact OE1-NZ 3.08Å; E164-K237 IonicContact OE2-NZ 2.73Å; E164-K237 PolarHBondContact OE2-NZ 3.02Å; L168-K237 HydrophobicContact CD1-CG 4.2Å; F233-K237 HydrophobicContact CD1-CD 4.36Å; F233-K237 HydrophobicContact CD2-CG 4.37Å; F233-K237 HydrophobicContact CE1-CD 3.7Å; F233-K237 HydrophobicContact CE1-CG 4.31Å; F233-K237 HydrophobicContact CE2-CD 4.1Å; F233-K237 HydrophobicContact CE2-CG 3.99Å; F233-K237 HydrophobicContact CZ-CD 3.57Å; F233-K237 HydrophobicContact CZ-CG 3.99Å; F233-K237 WeakPolarHBondContact O-CG 3.31Å; F233-K237 PolarHBondContact O-N 2.72Å; K234-K237 PolarHBondContact O-N 3.46Å; A235-K237 PolarHBondContact O-N 3.41Å; K237-G241 PolarHBondContact O-N 2.77Å; K237-G241 VanDerWaalsContact O-N 3.08Å
238	V	97.1	Very high	96.6	Very high	43 Å²	43	54 Å²	54	26%	0.261	29%	0.287	S	S	.	.	H	α-helix	trans	-64	-48	179.3	169.3	0	0	0	0	110.3	K234 A235 L236 G241 L261 Y282	K234-V238 WeakPolarHBondContact O-CG2 3.49Å; K234-V238 PolarHBondContact O-N 2.93Å; A235-V238 PolarHBondContact O-N 3.23Å; L236-V238 PolarHBondContact O-N 3.23Å; V238-G241 PolarHBondContact O-N 3.45Å; V238-L261 HydrophobicContact CG1-CD2 3.83Å; V238-L261 HydrophobicContact CG1-CG 3.92Å; V238-Y282 WeakPolarHBondContact O-CE2 3.13Å; V238-Y282 PolarHBondContact O-OH 3.28Å
239	L	97.9	Very high	96.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-73.7	-40.6	-174.9	-64.9	174.2	0	0	0	112.8	A235 L236 G241 I242 V245 A250 W253 I254 I258	A235-L239 WeakPolarHBondContact O-CB 3.49Å; A235-L239 VanDerWaalsContact O-CG 3.28Å; A235-L239 WeakPolarHBondContact O-CG 3.42Å; A235-L239 PolarHBondContact O-N 3.18Å; L236-L239 PolarHBondContact O-N 3.16Å; L239-G241 PolarHBondContact O-N 3.28Å; L239-I242 HydrophobicContact CD2-CD1 4.2Å; L239-I242 VanDerWaalsContact O-CB 3.29Å; L239-I242 WeakPolarHBondContact O-CB 3.31Å; L239-I242 WeakPolarHBondContact O-CG1 3.3Å; L239-I242 PolarHBondContact O-N 2.92Å; L239-I242 VanDerWaalsContact O-N 3.13Å; L239-V245 WeakPolarHBondContact O-CB 3.48Å; L239-V245 VanDerWaalsContact O-CG1 3.3Å; L239-V245 WeakPolarHBondContact O-CG1 3.32Å; L239-A250 HydrophobicContact CB-CB 3.75Å; L239-A250 HydrophobicContact CD1-CB 4.38Å; L239-W253 HydrophobicContact CD1-CB 4.26Å; L239-W253 HydrophobicContact CD1-CE3 4.47Å; L239-W253 HydrophobicContact CD2-CE3 4.18Å; L239-I254 HydrophobicContact CD1-CD1 4.22Å; L239-I254 HydrophobicContact CD1-CG1 3.75Å; L239-I258 WeakPolarHBondContact CD1-O 3.4Å; L239-I258 HydrophobicContact CD2-CG2 4.31Å
240	T	97.1	Very high	96.7	Very high	38 Å²	38	44.7 Å²	44.7	23%	0.233	25%	0.246	C	C	.	.	H	α-helix	trans	-74	-14.5	174.4	60.9	0	0	0	0	113.2	L168 L236 I242 A250	L168-T240 HydrophobicContact CD2-CG2 3.65Å; L236-T240 WeakPolarHBondContact O-CB 3.45Å; L236-T240 WeakPolarHBondContact O-CG2 3.35Å; L236-T240 PolarHBondContact O-N 3.32Å; L236-T240 PolarHBondContact O-OG1 3.35Å; T240-I242 PolarHBondContact O-N 3.31Å; T240-A250 HydrophobicContact CG2-CB 3.65Å
241	G	96.3	Very high	96.6	Very high	35 Å²	35	44.2 Å²	44.2	36%	0.361	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.7	166.6	0	0	0	0	0	113.6	K237 V238 L239 F243 Y282	K237-G241 PolarHBondContact O-N 2.77Å; K237-G241 VanDerWaalsContact O-N 3.08Å; V238-G241 PolarHBondContact O-N 3.45Å; L239-G241 PolarHBondContact O-N 3.28Å; G241-F243 PolarHBondContact O-N 3.45Å; G241-Y282 VanDerWaalsContact C-CE2 3.46Å
242	I	97.8	Very high	96.6	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.015	23%	0.232	C	C	.	.	S	Bend	trans	-75.8	120.7	175.7	-55.9	168.4	0	0	0	108.3	L239 T240 G244 V245 W253 L261 L264 L279 Y282	L239-I242 HydrophobicContact CD2-CD1 4.2Å; L239-I242 VanDerWaalsContact O-CB 3.29Å; L239-I242 WeakPolarHBondContact O-CB 3.31Å; L239-I242 WeakPolarHBondContact O-CG1 3.3Å; L239-I242 PolarHBondContact O-N 2.92Å; L239-I242 VanDerWaalsContact O-N 3.13Å; T240-I242 PolarHBondContact O-N 3.31Å; I242-G244 PolarHBondContact O-N 3.01Å; I242-V245 HydrophobicContact CB-CB 4.12Å; I242-V245 HydrophobicContact CB-CG2 3.67Å; I242-V245 HydrophobicContact CD1-CG2 4.44Å; I242-V245 HydrophobicContact CG2-CG2 3.7Å; I242-V245 WeakPolarHBondContact O-CB 3.46Å; I242-V245 PolarHBondContact O-N 3.43Å; I242-W253 HydrophobicContact CD1-CZ3 4.35Å; I242-L261 HydrophobicContact CD1-CD2 3.62Å; I242-L261 HydrophobicContact CG1-CD2 3.68Å; I242-L264 HydrophobicContact CD1-CD2 3.45Å; I242-L264 VanDerWaalsContact CD1-CD2 3.45Å; I242-L279 HydrophobicContact CD1-CD1 4.31Å; I242-L279 HydrophobicContact CG2-CB 4.26Å; I242-Y282 HydrophobicContact CB-CD2 4.41Å; I242-Y282 HydrophobicContact CG1-CD2 3.76Å; I242-Y282 HydrophobicContact CG1-CE2 3.82Å
243	F	96.3	Very high	96.7	Very high	33 Å²	33	38 Å²	38	15%	0.145	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	128.6	176.1	173.9	-99.3	0	0	0	111	G241 A274 Q275 I285 Y361 L390 I392	G241-F243 PolarHBondContact O-N 3.45Å; F243-A274 HydrophobicContact CD1-CB 4.26Å; F243-A274 HydrophobicContact CE1-CB 3.92Å; F243-A274 CarbonylContact O-C 3.57Å; F243-Q275 WeakPolarHBondContact O-CA 3.37Å; F243-I285 HydrophobicContact CB-CD1 4.34Å; F243-Y361 AromaticContact CE1-CD1 3.59Å; F243-Y361 HydrophobicContact CE1-CD1 3.59Å; F243-Y361 AromaticContact CE1-CE1 3.36Å; F243-Y361 HydrophobicContact CE1-CE1 3.36Å; F243-Y361 HydrophobicContact CE1-CE2 4.39Å; F243-Y361 HydrophobicContact CE1-CG 4.23Å; F243-Y361 AromaticContact CE1-CZ 3.78Å; F243-Y361 AromaticContact CZ-CD1 3.99Å; F243-Y361 HydrophobicContact CZ-CD1 3.99Å; F243-Y361 AromaticContact CZ-CE1 3.57Å; F243-Y361 HydrophobicContact CZ-CE1 3.57Å; F243-L390 HydrophobicContact CZ-CB 4.42Å; F243-I392 HydrophobicContact CD1-CD1 3.86Å; F243-I392 HydrophobicContact CE1-CD1 4.21Å; F243-I392 HydrophobicContact CG-CD1 4.38Å
244	G	95.1	Very high	96.8	Very high	38 Å²	38	38.6 Å²	38.6	39%	0.392	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	4.4	-175.5	0	0	0	0	0	115.5	I242 Q275	I242-G244 PolarHBondContact O-N 3.01Å; G244-Q275 VanDerWaalsContact O-CG 3.31Å; G244-Q275 WeakPolarHBondContact O-CG 3.49Å; G244-Q275 PolarHBondContact O-NE2 3.37Å
245	V	97.3	Very high	96.7	Very high	12 Å²	12	43.3 Å²	43.3	7%	0.073	23%	0.23	C	C	.	.			trans	-111	118.4	175.4	-178.2	0	0	0	0	110.2	L239 I242 T249 A250 W253 Q275	L239-V245 WeakPolarHBondContact O-CB 3.48Å; L239-V245 VanDerWaalsContact O-CG1 3.3Å; L239-V245 WeakPolarHBondContact O-CG1 3.32Å; I242-V245 HydrophobicContact CB-CB 4.12Å; I242-V245 HydrophobicContact CB-CG2 3.67Å; I242-V245 HydrophobicContact CD1-CG2 4.44Å; I242-V245 HydrophobicContact CG2-CG2 3.7Å; I242-V245 WeakPolarHBondContact O-CB 3.46Å; I242-V245 PolarHBondContact O-N 3.43Å; V245-T249 HydrophobicContact CG1-CG2 4.09Å; V245-A250 HydrophobicContact CG1-CB 4.21Å; V245-W253 HydrophobicContact CB-CZ3 4.21Å; V245-W253 HydrophobicContact CG1-CE3 4.14Å; V245-W253 HydrophobicContact CG1-CH2 4.21Å; V245-W253 HydrophobicContact CG1-CZ3 3.55Å; V245-W253 HydrophobicContact CG2-CH2 3.55Å; V245-W253 HydrophobicContact CG2-CZ3 3.52Å; V245-Q275 HydrophobicContact CG2-CB 4.5Å; V245-Q275 HydrophobicContact CG2-CG 3.83Å
246	G	95.4	Very high	96.7	Very high	40 Å²	40	47.8 Å²	47.8	41%	0.412	25%	0.251	S	S	.	.			trans	-96.9	172.9	172	0	0	0	0	0	112.7	K248 T249 A250	G246-K248 VanDerWaalsContact C-N 3.31Å; G246-K248 PolarHBondContact O-N 2.66Å; G246-T249 PolarHBondContact O-N 2.97Å; G246-A250 PolarHBondContact O-N 3.35Å
247	S	94.3	Very high	96.7	Very high	38 Å²	38	49.7 Å²	49.7	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-51.7	-44.5	-179.3	54.7	0	0	0	0	113.2	T249 A250 D251	S247-T249 PolarHBondContact O-N 3.36Å; S247-A250 PolarHBondContact O-N 3.46Å; S247-D251 WeakPolarHBondContact O-CB 3.35Å; S247-D251 PolarHBondContact O-N 3.43Å
248	K	95.2	Very high	96.8	Very high	160 Å²	160	46 Å²	46	70%	0.696	26%	0.255	S	S	*	.	H	α-helix	trans	-61.6	-40	178.6	-65.2	-175	178.1	-178.5	0	113.4	G246 R252	G246-K248 VanDerWaalsContact C-N 3.31Å; G246-K248 PolarHBondContact O-N 2.66Å; K248-R252 WeakPolarHBondContact O-CB 3.4Å; K248-R252 PolarHBondContact O-N 3.45Å; K248-R252 VanDerWaalsContact O-N 3.16Å
249	T	96.9	Very high	96.8	Very high	32 Å²	32	47.9 Å²	47.9	20%	0.196	26%	0.26	C	S	.	.	H	α-helix	trans	-71	-42.8	177.4	-56.8	0	0	0	0	110.7	V245 G246 S247 R252 W253	V245-T249 HydrophobicContact CG1-CG2 4.09Å; G246-T249 PolarHBondContact O-N 2.97Å; S247-T249 PolarHBondContact O-N 3.36Å; T249-R252 PolarHBondContact O-N 2.91Å; T249-W253 HydrophobicContact CG2-CD2 3.97Å; T249-W253 HydrophobicContact CG2-CE3 4.12Å; T249-W253 HydrophobicContact CG2-CH2 3.82Å; T249-W253 HydrophobicContact CG2-CZ2 3.62Å; T249-W253 HydrophobicContact CG2-CZ3 4.07Å; T249-W253 PolarHBondContact O-N 3.47Å
250	A	97.5	Very high	96.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-46	176.7	0	0	0	0	0	112	L236 L239 T240 V245 G246 S247 R252 W253 I254	L236-A250 HydrophobicContact CD2-CB 4.03Å; L239-A250 HydrophobicContact CB-CB 3.75Å; L239-A250 HydrophobicContact CD1-CB 4.38Å; T240-A250 HydrophobicContact CG2-CB 3.65Å; V245-A250 HydrophobicContact CG1-CB 4.21Å; G246-A250 PolarHBondContact O-N 3.35Å; S247-A250 PolarHBondContact O-N 3.46Å; A250-R252 VanDerWaalsContact C-N 3.34Å; A250-R252 PolarHBondContact O-N 2.88Å; A250-W253 PolarHBondContact O-N 3.24Å; A250-I254 VanDerWaalsContact O-CG1 3.3Å; A250-I254 WeakPolarHBondContact O-CG1 3.29Å; A250-I254 PolarHBondContact O-N 2.86Å
251	D	96.4	Very high	96.8	Very high	32 Å²	32	50.1 Å²	50.1	17%	0.171	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-41.8	176.7	177.3	83.4	0	0	0	112.1	R232 S247 I254 R255	R232-D251 IonicContact CZ-OD1 3.5Å; R232-D251 IonicContact NH1-OD1 3.65Å; R232-D251 IonicContact NH2-OD1 2.76Å; R232-D251 PolarHBondContact NH2-OD1 3.47Å; S247-D251 WeakPolarHBondContact O-CB 3.35Å; S247-D251 PolarHBondContact O-N 3.43Å; D251-I254 PolarHBondContact O-N 3.08Å; D251-R255 PolarHBondContact O-N 2.72Å; D251-R255 IonicContact OD2-CZ 3.85Å; D251-R255 IonicContact OD2-NE 2.67Å; D251-R255 PolarHBondContact OD2-NE 2.94Å; D251-R255 IonicContact OD2-NH2 2.71Å; D251-R255 PolarHBondContact OD2-NH2 3.48Å
252	R	96.9	Very high	96.9	Very high	111 Å²	111	53.1 Å²	53.1	42%	0.419	28%	0.276	S	S	.	.	H	α-helix	trans	-58.5	-49	174.1	-178.3	-174.8	65	179.2	3.6	111.3	K248 T249 A250 I254 R255 E256	K248-R252 WeakPolarHBondContact O-CB 3.4Å; K248-R252 PolarHBondContact O-N 3.45Å; K248-R252 VanDerWaalsContact O-N 3.16Å; T249-R252 PolarHBondContact O-N 2.91Å; A250-R252 VanDerWaalsContact C-N 3.34Å; A250-R252 PolarHBondContact O-N 2.88Å; R252-I254 VanDerWaalsContact C-N 3.33Å; R252-I254 PolarHBondContact O-N 3.07Å; R252-R255 WeakPolarHBondContact O-CB 3.45Å; R252-R255 PolarHBondContact O-N 3.21Å; R252-E256 WeakPolarHBondContact CG-OE1 3.29Å; R252-E256 WeakPolarHBondContact O-CG 3.37Å; R252-E256 PolarHBondContact O-N 2.91Å; R252-E256 VanDerWaalsContact O-N 3.13Å
253	W	97.9	Very high	96.9	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-37.3	178.8	-72	-25.8	0	0	0	113	L239 I242 V245 T249 A250 R255 E256 G257 I258 L264 L271	L239-W253 HydrophobicContact CD1-CB 4.26Å; L239-W253 HydrophobicContact CD1-CE3 4.47Å; L239-W253 HydrophobicContact CD2-CE3 4.18Å; I242-W253 HydrophobicContact CD1-CZ3 4.35Å; V245-W253 HydrophobicContact CB-CZ3 4.21Å; V245-W253 HydrophobicContact CG1-CE3 4.14Å; V245-W253 HydrophobicContact CG1-CH2 4.21Å; V245-W253 HydrophobicContact CG1-CZ3 3.55Å; V245-W253 HydrophobicContact CG2-CH2 3.55Å; V245-W253 HydrophobicContact CG2-CZ3 3.52Å; T249-W253 HydrophobicContact CG2-CD2 3.97Å; T249-W253 HydrophobicContact CG2-CE3 4.12Å; T249-W253 HydrophobicContact CG2-CH2 3.82Å; T249-W253 HydrophobicContact CG2-CZ2 3.62Å; T249-W253 HydrophobicContact CG2-CZ3 4.07Å; T249-W253 PolarHBondContact O-N 3.47Å; A250-W253 PolarHBondContact O-N 3.24Å; W253-R255 VanDerWaalsContact C-N 3.32Å; W253-R255 PolarHBondContact O-N 3.43Å; W253-E256 CarbonylContact O-C 3.58Å; W253-E256 WeakPolarHBondContact O-CA 3.38Å; W253-E256 WeakPolarHBondContact O-CB 3.12Å; W253-E256 PolarHBondContact O-N 3.22Å; W253-G257 PolarHBondContact O-N 3.47Å; W253-I258 CarbonylContact C-O 3.55Å; W253-I258 HydrophobicContact CB-CB 4.09Å; W253-I258 HydrophobicContact CB-CD1 4.27Å; W253-I258 HydrophobicContact CB-CG2 4.44Å; W253-I258 HydrophobicContact CG-CD1 4.32Å; W253-I258 WeakPolarHBondContact O-CB 3.3Å; W253-I258 PolarHBondContact O-N 3.18Å; W253-L264 HydrophobicContact CD2-CD1 3.93Å; W253-L264 HydrophobicContact CE3-CD1 4.06Å; W253-L264 HydrophobicContact CE3-CD2 4.26Å; W253-L264 HydrophobicContact CH2-CD1 4.01Å; W253-L264 HydrophobicContact CH2-CD2 3.87Å; W253-L264 HydrophobicContact CZ2-CD1 3.9Å; W253-L264 HydrophobicContact CZ3-CD1 4.08Å; W253-L264 HydrophobicContact CZ3-CD2 3.69Å; W253-L271 HydrophobicContact CH2-CD2 3.89Å; W253-L271 HydrophobicContact CZ2-CD2 3.61Å
254	I	97.5	Very high	97	Very high	19 Å²	19	55.1 Å²	55.1	10%	0.097	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-40.9	174.2	-70.4	167.1	0	0	0	111	A235 L236 L239 A250 D251 R252 E256 G257 I258	A235-I254 HydrophobicContact CB-CD1 3.74Å; A235-I254 HydrophobicContact CB-CG1 3.94Å; L236-I254 HydrophobicContact CB-CD1 4.41Å; L236-I254 HydrophobicContact CD2-CD1 3.62Å; L236-I254 HydrophobicContact CG-CD1 3.6Å; L239-I254 HydrophobicContact CD1-CD1 4.22Å; L239-I254 HydrophobicContact CD1-CG1 3.75Å; A250-I254 VanDerWaalsContact O-CG1 3.3Å; A250-I254 WeakPolarHBondContact O-CG1 3.29Å; A250-I254 PolarHBondContact O-N 2.86Å; D251-I254 PolarHBondContact O-N 3.08Å; R252-I254 VanDerWaalsContact C-N 3.33Å; R252-I254 PolarHBondContact O-N 3.07Å; I254-E256 PolarHBondContact O-N 3.11Å; I254-G257 PolarHBondContact O-N 3.06Å; I254-I258 WeakPolarHBondContact CA-O 3.35Å
255	R	96.8	Very high	97	Very high	185 Å²	185	58.8 Å²	58.8	70%	0.698	29%	0.287	S	S	*	.	H	α-helix	trans	-64.7	-24.5	173.7	-75.8	-173.5	-80.9	154.1	-7.1	113.1	D251 R252 W253 G257	D251-R255 PolarHBondContact O-N 2.72Å; D251-R255 IonicContact OD2-CZ 3.85Å; D251-R255 IonicContact OD2-NE 2.67Å; D251-R255 PolarHBondContact OD2-NE 2.94Å; D251-R255 IonicContact OD2-NH2 2.71Å; D251-R255 PolarHBondContact OD2-NH2 3.48Å; R252-R255 WeakPolarHBondContact O-CB 3.45Å; R252-R255 PolarHBondContact O-N 3.21Å; W253-R255 VanDerWaalsContact C-N 3.32Å; W253-R255 PolarHBondContact O-N 3.43Å; R255-G257 VanDerWaalsContact C-N 3.3Å
256	E	97.3	Very high	97	Very high	97 Å²	97	63.7 Å²	63.7	45%	0.453	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	4.6	174.2	-66	165.8	-173.6	0	0	112.8	R252 W253 I254 Q269	R252-E256 WeakPolarHBondContact CG-OE1 3.29Å; R252-E256 WeakPolarHBondContact O-CG 3.37Å; R252-E256 PolarHBondContact O-N 2.91Å; R252-E256 VanDerWaalsContact O-N 3.13Å; W253-E256 CarbonylContact O-C 3.58Å; W253-E256 WeakPolarHBondContact O-CA 3.38Å; W253-E256 WeakPolarHBondContact O-CB 3.12Å; W253-E256 PolarHBondContact O-N 3.22Å; I254-E256 PolarHBondContact O-N 3.11Å; E256-Q269 PolarHBondContact OE2-NE2 2.65Å
257	G	97.4	Very high	97	Very high	40 Å²	40	64 Å²	64	41%	0.412	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	13.8	177.8	0	0	0	0	0	114.8	W253 I254 R255 H259	W253-G257 PolarHBondContact O-N 3.47Å; I254-G257 PolarHBondContact O-N 3.06Å; R255-G257 VanDerWaalsContact C-N 3.3Å; G257-H259 PolarHBondContact O-CD2 3.03Å
258	I	98.3	Very high	96.9	Very high	8 Å²	8	65.4 Å²	65.4	4%	0.041	33%	0.33	C	S	.	.			trans	-97.5	114.2	177.3	-57.4	165.6	0	0	0	108.7	L239 W253 I254 Q263 L264 S267 Q269	L239-I258 WeakPolarHBondContact CD1-O 3.4Å; L239-I258 HydrophobicContact CD2-CG2 4.31Å; W253-I258 CarbonylContact C-O 3.55Å; W253-I258 HydrophobicContact CB-CB 4.09Å; W253-I258 HydrophobicContact CB-CD1 4.27Å; W253-I258 HydrophobicContact CB-CG2 4.44Å; W253-I258 HydrophobicContact CG-CD1 4.32Å; W253-I258 WeakPolarHBondContact O-CB 3.3Å; W253-I258 PolarHBondContact O-N 3.18Å; I254-I258 WeakPolarHBondContact CA-O 3.35Å; I258-Q263 HydrophobicContact CG2-CB 4.08Å; I258-L264 HydrophobicContact CD1-CD1 4.28Å; I258-L264 HydrophobicContact CG2-CB 3.83Å; I258-L264 HydrophobicContact CG2-CD1 4.3Å; I258-S267 VanDerWaalsContact CD1-CB 3.49Å; I258-Q269 HydrophobicContact CD1-CG 3.93Å
259	H	97.6	Very high	96.8	Very high	82 Å²	82	60.7 Å²	60.7	38%	0.38	31%	0.31	S	S	.	.			trans	-118	-11.8	-176	-57.6	-72.6	0	0	0	113.6	A235 G257	A235-H259 WeakPolarHBondContact CA-O 3.32Å; A235-H259 HydrophobicContact CB-CB 3.98Å; G257-H259 PolarHBondContact O-CD2 3.03Å
260	N	97.8	Very high	96.8	Very high	63 Å²	63	65.8 Å²	65.8	34%	0.337	34%	0.342	S	S	.	.	S	Bend	trans	-148	173.6	-178.9	64.1	57.9	0	0	0	112.6	Q262 Q263 L264	N260-Q262 VanDerWaalsContact C-N 3.34Å; N260-Q262 PolarHBondContact O-N 3.31Å; N260-Q262 PolarHBondContact OD1-N 3.39Å; N260-Q262 VanDerWaalsContact OD1-N 3.11Å; N260-Q263 VanDerWaalsContact ND2-CD 3.31Å; N260-Q263 PolarHBondContact ND2-OE1 2.79Å; N260-Q263 PolarHBondContact O-N 3.41Å; N260-Q263 WeakPolarHBondContact OD1-CG 3.36Å; N260-Q263 PolarHBondContact OD1-N 3.01Å; N260-L264 PolarHBondContact O-N 3.3Å
261	L	97.5	Very high	96.7	Very high	23 Å²	23	66.9 Å²	66.9	12%	0.12	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-37.1	-176.2	-54.2	-178.5	0	0	0	113.2	V238 I242 L264 R265 L279 Y282	V238-L261 HydrophobicContact CG1-CD2 3.83Å; V238-L261 HydrophobicContact CG1-CG 3.92Å; I242-L261 HydrophobicContact CD1-CD2 3.62Å; I242-L261 HydrophobicContact CG1-CD2 3.68Å; L261-L264 PolarHBondContact O-N 3.11Å; L261-R265 WeakPolarHBondContact O-CG 3.42Å; L261-R265 PolarHBondContact O-N 2.91Å; L261-L279 HydrophobicContact CB-CD1 4.22Å; L261-L279 HydrophobicContact CD2-CD1 4.08Å; L261-Y282 HydrophobicContact CD1-CD1 3.39Å; L261-Y282 HydrophobicContact CD1-CD2 4.12Å; L261-Y282 HydrophobicContact CD1-CE1 3.6Å; L261-Y282 HydrophobicContact CD1-CE2 4.27Å; L261-Y282 HydrophobicContact CD1-CG 3.66Å; L261-Y282 HydrophobicContact CD2-CD2 4Å; L261-Y282 HydrophobicContact CD2-CE2 3.9Å; L261-Y282 HydrophobicContact CD2-CG 4.37Å
262	Q	97.4	Very high	96.8	Very high	98 Å²	98	69.1 Å²	69.1	46%	0.458	36%	0.359	S	S	.	.	H	α-helix	trans	-67.9	-47.6	-178.6	-174.1	56.2	43.5	0	0	110.3	N260 L264 R265 D266	N260-Q262 VanDerWaalsContact C-N 3.34Å; N260-Q262 PolarHBondContact O-N 3.31Å; N260-Q262 PolarHBondContact OD1-N 3.39Å; N260-Q262 VanDerWaalsContact OD1-N 3.11Å; Q262-L264 PolarHBondContact O-N 3.16Å; Q262-R265 WeakPolarHBondContact O-CB 3.3Å; Q262-R265 PolarHBondContact O-N 3.44Å; Q262-D266 VanDerWaalsContact NE2-CG 3.27Å; Q262-D266 PolarHBondContact NE2-OD1 3.28Å; Q262-D266 PolarHBondContact NE2-OD2 3.05Å; Q262-D266 VanDerWaalsContact O-CG 3.26Å; Q262-D266 PolarHBondContact O-N 2.82Å
263	Q	98.1	Very high	96.8	Very high	73 Å²	73	70.7 Å²	70.7	34%	0.341	37%	0.365	S	S	.	.	H	α-helix	trans	-57.8	-37.8	173.6	-71.1	170.6	-19.7	0	0	111.8	I258 N260 D266 S267	I258-Q263 HydrophobicContact CG2-CB 4.08Å; N260-Q263 VanDerWaalsContact ND2-CD 3.31Å; N260-Q263 PolarHBondContact ND2-OE1 2.79Å; N260-Q263 PolarHBondContact O-N 3.41Å; N260-Q263 WeakPolarHBondContact OD1-CG 3.36Å; N260-Q263 PolarHBondContact OD1-N 3.01Å; Q263-D266 PolarHBondContact O-N 2.93Å; Q263-S267 VanDerWaalsContact O-CB 3.24Å; Q263-S267 WeakPolarHBondContact O-CB 3.23Å; Q263-S267 PolarHBondContact O-N 3.48Å
264	L	97.9	Very high	96.7	Very high	4 Å²	4	71.1 Å²	71.1	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-64.8	-43	174.9	-177.2	62.6	0	0	0	111.8	I242 W253 I258 N260 L261 Q262 D266 S267 Q269 L271 L279	I242-L264 HydrophobicContact CD1-CD2 3.45Å; I242-L264 VanDerWaalsContact CD1-CD2 3.45Å; W253-L264 HydrophobicContact CD2-CD1 3.93Å; W253-L264 HydrophobicContact CE3-CD1 4.06Å; W253-L264 HydrophobicContact CE3-CD2 4.26Å; W253-L264 HydrophobicContact CH2-CD1 4.01Å; W253-L264 HydrophobicContact CH2-CD2 3.87Å; W253-L264 HydrophobicContact CZ2-CD1 3.9Å; W253-L264 HydrophobicContact CZ3-CD1 4.08Å; W253-L264 HydrophobicContact CZ3-CD2 3.69Å; I258-L264 HydrophobicContact CD1-CD1 4.28Å; I258-L264 HydrophobicContact CG2-CB 3.83Å; I258-L264 HydrophobicContact CG2-CD1 4.3Å; N260-L264 PolarHBondContact O-N 3.3Å; L261-L264 PolarHBondContact O-N 3.11Å; Q262-L264 PolarHBondContact O-N 3.16Å; L264-D266 VanDerWaalsContact C-N 3.3Å; L264-D266 PolarHBondContact O-N 3.23Å; L264-S267 PolarHBondContact O-N 3.05Å; L264-S267 PolarHBondContact O-OG 3.21Å; L264-Q269 HydrophobicContact CD1-CB 4.21Å; L264-Q269 HydrophobicContact CD1-CG 4.25Å; L264-L271 HydrophobicContact CD1-CD2 4.24Å; L264-L279 HydrophobicContact CD2-CD1 4.31Å; L264-L279 HydrophobicContact CD2-CD2 4.12Å; L264-L279 HydrophobicContact CG-CD2 4.33Å
265	R	96.1	Very high	96.7	Very high	115 Å²	115	70.9 Å²	70.9	43%	0.434	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-40.2	176	-71.3	175.6	-174.9	123.9	1.9	111.9	L261 Q262 L279	L261-R265 WeakPolarHBondContact O-CG 3.42Å; L261-R265 PolarHBondContact O-N 2.91Å; Q262-R265 WeakPolarHBondContact O-CB 3.3Å; Q262-R265 PolarHBondContact O-N 3.44Å; R265-L279 HydrophobicContact CG-CD1 4.42Å; R265-L279 HydrophobicContact CG-CD2 3.87Å; R265-L279 HydrophobicContact CG-CG 4.35Å; R265-L279 PolarHBondContact NH2-O 3.03Å
266	D	96.9	Very high	96.8	Very high	116 Å²	116	67.1 Å²	67.1	62%	0.62	36%	0.358	S	S	*	.	H	α-helix	trans	-82.2	-15.5	-176.8	-59.1	-25.1	0	0	0	113	Q262 Q263 L264 G268	Q262-D266 VanDerWaalsContact NE2-CG 3.27Å; Q262-D266 PolarHBondContact NE2-OD1 3.28Å; Q262-D266 PolarHBondContact NE2-OD2 3.05Å; Q262-D266 VanDerWaalsContact O-CG 3.26Å; Q262-D266 PolarHBondContact O-N 2.82Å; Q263-D266 PolarHBondContact O-N 2.93Å; L264-D266 VanDerWaalsContact C-N 3.3Å; L264-D266 PolarHBondContact O-N 3.23Å; D266-G268 VanDerWaalsContact C-N 3.31Å; D266-G268 PolarHBondContact O-N 2.87Å
267	S	95	Very high	96.8	Very high	46 Å²	46	62.9 Å²	62.9	32%	0.322	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.5	-173.9	67.7	0	0	0	0	115.6	I258 Q263 L264 Q269	I258-S267 VanDerWaalsContact CD1-CB 3.49Å; Q263-S267 VanDerWaalsContact O-CB 3.24Å; Q263-S267 WeakPolarHBondContact O-CB 3.23Å; Q263-S267 PolarHBondContact O-N 3.48Å; L264-S267 PolarHBondContact O-N 3.05Å; L264-S267 PolarHBondContact O-OG 3.21Å; S267-Q269 PolarHBondContact O-N 3.22Å; S267-Q269 WeakPolarHBondContact OG-CB 3.49Å; S267-Q269 WeakPolarHBondContact OG-CG 3.36Å; S267-Q269 PolarHBondContact OG-N 2.66Å
268	G	92.6	Very high	96.8	Very high	68 Å²	68	61 Å²	61	70%	0.701	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	13	-173.2	0	0	0	0	0	114.8	D266 T270	D266-G268 VanDerWaalsContact C-N 3.31Å; D266-G268 PolarHBondContact O-N 2.87Å; G268-T270 PolarHBondContact O-N 3.08Å
269	Q	94	Very high	96.7	Very high	61 Å²	61	61.2 Å²	61.2	29%	0.285	32%	0.321	S	S	.	.			trans	-58.1	134.9	177	-73.4	-78.7	-31.7	0	0	111.8	E256 I258 L264 S267 L271	E256-Q269 PolarHBondContact OE2-NE2 2.65Å; I258-Q269 HydrophobicContact CD1-CG 3.93Å; L264-Q269 HydrophobicContact CD1-CB 4.21Å; L264-Q269 HydrophobicContact CD1-CG 4.25Å; S267-Q269 PolarHBondContact O-N 3.22Å; S267-Q269 WeakPolarHBondContact OG-CB 3.49Å; S267-Q269 WeakPolarHBondContact OG-CG 3.36Å; S267-Q269 PolarHBondContact OG-N 2.66Å; Q269-L271 HydrophobicContact CB-CD2 4.2Å; Q269-L271 PolarHBondContact O-N 2.67Å; Q269-L271 VanDerWaalsContact O-N 3.12Å
270	T	94.9	Very high	96.7	Very high	139 Å²	139	64 Å²	64	85%	0.853	33%	0.334	S	S	*	.			trans	-77.6	101.3	173.7	-57.6	0	0	0	0	109.7	G268	G268-T270 PolarHBondContact O-N 3.08Å
271	L	97.1	Very high	96.7	Very high	23 Å²	23	61.4 Å²	61.4	12%	0.12	32%	0.32	C	S	.	.			trans	-84.2	139.7	178.8	-56.9	-174.9	0	0	0	110.9	W253 L264 Q269 Q275 Q276 L279	W253-L271 HydrophobicContact CH2-CD2 3.89Å; W253-L271 HydrophobicContact CZ2-CD2 3.61Å; L264-L271 HydrophobicContact CD1-CD2 4.24Å; Q269-L271 HydrophobicContact CB-CD2 4.2Å; Q269-L271 PolarHBondContact O-N 2.67Å; Q269-L271 VanDerWaalsContact O-N 3.12Å; L271-Q275 HydrophobicContact CB-CB 3.94Å; L271-Q275 HydrophobicContact CD2-CB 4.36Å; L271-Q276 HydrophobicContact CB-CG 3.65Å; L271-Q276 PolarHBondContact O-NE2 3.01Å; L271-L279 HydrophobicContact CD1-CB 4.47Å; L271-L279 HydrophobicContact CD1-CD2 3.54Å
272	N	96.8	Very high	96.7	Very high	79 Å²	79	61 Å²	61	42%	0.422	32%	0.317	S	S	.	.			trans	-74.7	166.8	169.6	72.7	50	0	0	0	111.4	A274 Q275 Q276	N272-A274 PolarHBondContact O-N 2.76Å; N272-A274 VanDerWaalsContact O-N 3.11Å; N272-A274 WeakPolarHBondContact OD1-CA 3.49Å; N272-A274 VanDerWaalsContact OD1-CB 3.31Å; N272-A274 WeakPolarHBondContact OD1-CB 3.22Å; N272-A274 PolarHBondContact OD1-N 3.33Å; N272-Q275 PolarHBondContact ND2-NE2 2.79Å; N272-Q275 PolarHBondContact ND2-OE1 2.74Å; N272-Q275 WeakPolarHBondContact O-CB 3.48Å; N272-Q275 PolarHBondContact O-N 3.15Å; N272-Q275 WeakPolarHBondContact OD1-CG 3.41Å; N272-Q275 PolarHBondContact OD1-N 2.9Å; N272-Q276 WeakPolarHBondContact O-CG 3.42Å; N272-Q276 PolarHBondContact O-N 2.97Å
273	R	97	Very high	96.6	Very high	144 Å²	144	61.2 Å²	61.2	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-53.2	-36.9	-177.1	-171.2	-175.9	175.4	-168.4	-1	113.9	A277 Y361	R273-A277 WeakPolarHBondContact O-CB 3.45Å; R273-A277 PolarHBondContact O-N 3.44Å; R273-A277 VanDerWaalsContact O-N 3.15Å; R273-Y361 HydrophobicContact CB-CE2 4.38Å; R273-Y361 HydrophobicContact CG-CD2 4.1Å; R273-Y361 HydrophobicContact CG-CE2 3.98Å
274	A	96.6	Very high	96.6	Very high	11 Å²	11	58.7 Å²	58.7	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-68.5	-47	178.2	0	0	0	0	0	110.8	F243 N272 Q276 A277 G278 Y361	F243-A274 HydrophobicContact CD1-CB 4.26Å; F243-A274 HydrophobicContact CE1-CB 3.92Å; F243-A274 CarbonylContact O-C 3.57Å; N272-A274 PolarHBondContact O-N 2.76Å; N272-A274 VanDerWaalsContact O-N 3.11Å; N272-A274 WeakPolarHBondContact OD1-CA 3.49Å; N272-A274 VanDerWaalsContact OD1-CB 3.31Å; N272-A274 WeakPolarHBondContact OD1-CB 3.22Å; N272-A274 PolarHBondContact OD1-N 3.33Å; A274-Q276 VanDerWaalsContact C-N 3.35Å; A274-Q276 PolarHBondContact O-N 3.24Å; A274-A277 PolarHBondContact O-N 3.24Å; A274-G278 PolarHBondContact O-N 3.05Å; A274-Y361 VanDerWaalsContact CA-CE2 3.49Å; A274-Y361 HydrophobicContact CB-CE2 3.93Å; A274-Y361 WeakPolarHBondContact CB-OH 3.49Å
275	Q	97.8	Very high	96.4	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.065	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-38.9	178.6	-66.4	168.6	-19.7	0	0	112.2	F243 G244 V245 L271 N272 G278 L279	F243-Q275 WeakPolarHBondContact O-CA 3.37Å; G244-Q275 VanDerWaalsContact O-CG 3.31Å; G244-Q275 WeakPolarHBondContact O-CG 3.49Å; G244-Q275 PolarHBondContact O-NE2 3.37Å; V245-Q275 HydrophobicContact CG2-CB 4.5Å; V245-Q275 HydrophobicContact CG2-CG 3.83Å; L271-Q275 HydrophobicContact CB-CB 3.94Å; L271-Q275 HydrophobicContact CD2-CB 4.36Å; N272-Q275 PolarHBondContact ND2-NE2 2.79Å; N272-Q275 PolarHBondContact ND2-OE1 2.74Å; N272-Q275 WeakPolarHBondContact O-CB 3.48Å; N272-Q275 PolarHBondContact O-N 3.15Å; N272-Q275 WeakPolarHBondContact OD1-CG 3.41Å; N272-Q275 PolarHBondContact OD1-N 2.9Å; Q275-G278 PolarHBondContact O-N 2.77Å; Q275-L279 VanDerWaalsContact O-CB 3.29Å; Q275-L279 WeakPolarHBondContact O-CB 3.46Å; Q275-L279 PolarHBondContact O-N 2.73Å
276	Q	97.8	Very high	96.4	Very high	105 Å²	105	60.2 Å²	60.2	49%	0.491	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-55.2	173.9	-69.4	173.7	3.4	0	0	110.7	L271 N272 A274 G278 L279 E280	L271-Q276 HydrophobicContact CB-CG 3.65Å; L271-Q276 PolarHBondContact O-NE2 3.01Å; N272-Q276 WeakPolarHBondContact O-CG 3.42Å; N272-Q276 PolarHBondContact O-N 2.97Å; A274-Q276 VanDerWaalsContact C-N 3.35Å; A274-Q276 PolarHBondContact O-N 3.24Å; Q276-G278 VanDerWaalsContact C-N 3.28Å; Q276-G278 PolarHBondContact O-N 3.23Å; Q276-L279 PolarHBondContact O-N 2.93Å; Q276-L279 VanDerWaalsContact O-N 3.16Å; Q276-E280 WeakPolarHBondContact O-CB 3.24Å; Q276-E280 PolarHBondContact O-N 3.45Å
277	A	97.4	Very high	96.3	Very high	8 Å²	8	59.3 Å²	59.3	7%	0.066	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-37.2	178.7	0	0	0	0	0	112.3	R273 A274 H281 Y361 I392	R273-A277 WeakPolarHBondContact O-CB 3.45Å; R273-A277 PolarHBondContact O-N 3.44Å; R273-A277 VanDerWaalsContact O-N 3.15Å; A274-A277 PolarHBondContact O-N 3.24Å; A277-H281 WeakPolarHBondContact O-CB 3.45Å; A277-H281 PolarHBondContact O-CD2 3.29Å; A277-H281 PolarHBondContact O-N 2.92Å; A277-Y361 HydrophobicContact CB-CD2 3.93Å; A277-Y361 HydrophobicContact CB-CG 4.17Å; A277-I392 HydrophobicContact CB-CD1 3.95Å
278	G	97.3	Very high	96.4	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.2	-35.8	176	0	0	0	0	0	113.7	A274 Q275 Q276 Y282	A274-G278 PolarHBondContact O-N 3.05Å; Q275-G278 PolarHBondContact O-N 2.77Å; Q276-G278 VanDerWaalsContact C-N 3.28Å; Q276-G278 PolarHBondContact O-N 3.23Å; G278-Y282 VanDerWaalsContact O-CA 3.29Å; G278-Y282 WeakPolarHBondContact O-CA 3.42Å; G278-Y282 WeakPolarHBondContact O-CB 3.48Å; G278-Y282 PolarHBondContact O-N 3.47Å; G278-Y282 VanDerWaalsContact O-N 3.17Å
279	L	97.8	Very high	96.6	Very high	14 Å²	14	57.7 Å²	57.7	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-78.5	-35.5	177.5	-177.4	60.3	0	0	0	112.1	I242 L261 L264 R265 L271 Q275 Q276	I242-L279 HydrophobicContact CD1-CD1 4.31Å; I242-L279 HydrophobicContact CG2-CB 4.26Å; L261-L279 HydrophobicContact CB-CD1 4.22Å; L261-L279 HydrophobicContact CD2-CD1 4.08Å; L264-L279 HydrophobicContact CD2-CD1 4.31Å; L264-L279 HydrophobicContact CD2-CD2 4.12Å; L264-L279 HydrophobicContact CG-CD2 4.33Å; R265-L279 HydrophobicContact CG-CD1 4.42Å; R265-L279 HydrophobicContact CG-CD2 3.87Å; R265-L279 HydrophobicContact CG-CG 4.35Å; R265-L279 PolarHBondContact NH2-O 3.03Å; L271-L279 HydrophobicContact CD1-CB 4.47Å; L271-L279 HydrophobicContact CD1-CD2 3.54Å; Q275-L279 VanDerWaalsContact O-CB 3.29Å; Q275-L279 WeakPolarHBondContact O-CB 3.46Å; Q275-L279 PolarHBondContact O-N 2.73Å; Q276-L279 PolarHBondContact O-N 2.93Å; Q276-L279 VanDerWaalsContact O-N 3.16Å
280	E	97.1	Very high	96.8	Very high	140 Å²	140	56.8 Å²	56.8	65%	0.654	29%	0.289	S	S	*	.	H	α-helix	trans	-67.2	-39.8	176.8	-172	-176.9	164.3	0	0	111.9	Q276	Q276-E280 WeakPolarHBondContact O-CB 3.24Å; Q276-E280 PolarHBondContact O-N 3.45Å
281	H	97.3	Very high	96.9	Very high	9 Å²	9	53.3 Å²	53.3	4%	0.042	27%	0.265	C	S	.	.	S	Bend	trans	-109	19.8	-175.4	-57	-37.1	0	0	0	113.7	A277 D283 D284 I285 A422	A277-H281 WeakPolarHBondContact O-CB 3.45Å; A277-H281 PolarHBondContact O-CD2 3.29Å; A277-H281 PolarHBondContact O-N 2.92Å; H281-D283 PolarHBondContact O-N 2.94Å; H281-D284 PolarHBondContact O-N 3.44Å; H281-I285 HydrophobicContact CB-CD1 3.91Å; H281-I285 HydrophobicContact CB-CG1 4.32Å; H281-I285 VanDerWaalsContact O-CG1 3.31Å; H281-I285 WeakPolarHBondContact O-CG1 3.11Å; H281-I285 PolarHBondContact O-N 3.38Å; H281-A422 HydrophobicContact CB-CB 3.63Å
282	Y	97.7	Very high	96.9	Very high	14 Å²	14	55 Å²	55	6%	0.055	28%	0.281	C	S	.	.	H	α-helix	trans	-53.7	-49.4	-173.1	-177.2	-88.7	0	0	0	113.1	V238 G241 I242 L261 G278 D284 I285 K286	V238-Y282 WeakPolarHBondContact O-CE2 3.13Å; V238-Y282 PolarHBondContact O-OH 3.28Å; G241-Y282 VanDerWaalsContact C-CE2 3.46Å; I242-Y282 HydrophobicContact CB-CD2 4.41Å; I242-Y282 HydrophobicContact CG1-CD2 3.76Å; I242-Y282 HydrophobicContact CG1-CE2 3.82Å; L261-Y282 HydrophobicContact CD1-CD1 3.39Å; L261-Y282 HydrophobicContact CD1-CD2 4.12Å; L261-Y282 HydrophobicContact CD1-CE1 3.6Å; L261-Y282 HydrophobicContact CD1-CE2 4.27Å; L261-Y282 HydrophobicContact CD1-CG 3.66Å; L261-Y282 HydrophobicContact CD2-CD2 4Å; L261-Y282 HydrophobicContact CD2-CE2 3.9Å; L261-Y282 HydrophobicContact CD2-CG 4.37Å; G278-Y282 VanDerWaalsContact O-CA 3.29Å; G278-Y282 WeakPolarHBondContact O-CA 3.42Å; G278-Y282 WeakPolarHBondContact O-CB 3.48Å; G278-Y282 PolarHBondContact O-N 3.47Å; G278-Y282 VanDerWaalsContact O-N 3.17Å; Y282-D284 VanDerWaalsContact C-N 3.33Å; Y282-D284 PolarHBondContact O-N 3.4Å; Y282-I285 PolarHBondContact O-N 3.44Å; Y282-K286 HydrophobicContact CD1-CD 4.45Å; Y282-K286 HydrophobicContact CE1-CB 4.36Å; Y282-K286 HydrophobicContact CE1-CD 3.64Å; Y282-K286 VanDerWaalsContact O-CB 3.27Å; Y282-K286 WeakPolarHBondContact O-CB 3.37Å; Y282-K286 PolarHBondContact O-N 3.15Å
283	D	96	Very high	96.9	Very high	102 Å²	102	52.4 Å²	52.4	55%	0.545	27%	0.267	S	S	.	.	H	α-helix	trans	-65.5	-37.3	-173.6	-65.3	-41.9	0	0	0	112.1	H281 Q287	H281-D283 PolarHBondContact O-N 2.94Å; D283-Q287 WeakPolarHBondContact O-CG 3.38Å; D283-Q287 PolarHBondContact O-N 3.3Å
284	D	96.5	Very high	96.9	Very high	20 Å²	20	45.5 Å²	45.5	11%	0.107	24%	0.241	C	C	.	.	H	α-helix	trans	-71	-41.5	176.1	-65.9	-12.4	0	0	0	111.8	H281 Y282 K286 Q287 R418 R421 A422	H281-D284 PolarHBondContact O-N 3.44Å; Y282-D284 VanDerWaalsContact C-N 3.33Å; Y282-D284 PolarHBondContact O-N 3.4Å; D284-K286 VanDerWaalsContact C-N 3.33Å; D284-Q287 PolarHBondContact O-N 2.72Å; D284-R418 IonicContact OD1-NH1 2.76Å; D284-R418 IonicContact OD2-CZ 3.98Å; D284-R418 IonicContact OD2-NH1 2.74Å; D284-R418 PolarHBondContact OD2-NH1 2.83Å; D284-R418 IonicContact OD2-NH2 3.96Å; D284-R418 PolarHBondContact OD2-NH2 3.47Å; D284-R421 HydrophobicContact CB-CB 4.26Å; D284-R421 PolarHBondContact O-NH2 3.39Å; D284-A422 HydrophobicContact CB-CB 3.79Å; D284-A422 WeakPolarHBondContact CB-O 3.44Å; D284-A422 PolarHBondContact OD2-N 2.93Å
285	I	95.7	Very high	96.9	Very high	15 Å²	15	48 Å²	48	8%	0.077	25%	0.25	C	S	.	.	H	α-helix	trans	-69.2	-34	-179.2	-69.2	169.3	0	0	0	111.2	F243 H281 Y282 Q287 I392 R424	F243-I285 HydrophobicContact CB-CD1 4.34Å; H281-I285 HydrophobicContact CB-CD1 3.91Å; H281-I285 HydrophobicContact CB-CG1 4.32Å; H281-I285 VanDerWaalsContact O-CG1 3.31Å; H281-I285 WeakPolarHBondContact O-CG1 3.11Å; H281-I285 PolarHBondContact O-N 3.38Å; Y282-I285 PolarHBondContact O-N 3.44Å; I285-Q287 VanDerWaalsContact C-N 3.32Å; I285-I392 HydrophobicContact CD1-CD1 3.83Å; I285-I392 HydrophobicContact CD1-CG1 4.38Å; I285-I392 HydrophobicContact CD1-CG2 4.46Å; I285-R424 HydrophobicContact CD1-CG 4.41Å; I285-R424 HydrophobicContact CG1-CG 4.24Å; I285-R424 HydrophobicContact CG2-CG 3.94Å
286	K	95.2	Very high	96.8	Very high	137 Å²	137	48.1 Å²	48.1	60%	0.596	25%	0.254	S	S	*	.	H	α-helix	trans	-68.9	-31.1	177.8	-179.6	176.3	174.4	-175.1	0	112.2	Y282 D284	Y282-K286 HydrophobicContact CD1-CD 4.45Å; Y282-K286 HydrophobicContact CE1-CB 4.36Å; Y282-K286 HydrophobicContact CE1-CD 3.64Å; Y282-K286 VanDerWaalsContact O-CB 3.27Å; Y282-K286 WeakPolarHBondContact O-CB 3.37Å; Y282-K286 PolarHBondContact O-N 3.15Å; D284-K286 VanDerWaalsContact C-N 3.33Å
287	Q	95.6	Very high	96.8	Very high	97 Å²	97	43.1 Å²	43.1	45%	0.453	23%	0.231	S	C	.	.	S	Bend	trans	-67.7	133.5	177.5	-76.4	176.2	36.4	0	0	110.7	D283 D284 I285 R421	D283-Q287 WeakPolarHBondContact O-CG 3.38Å; D283-Q287 PolarHBondContact O-N 3.3Å; D284-Q287 PolarHBondContact O-N 2.72Å; I285-Q287 VanDerWaalsContact C-N 3.32Å; Q287-R421 PolarHBondContact O-NH2 3.19Å
288	P	97	Very high	96.8	Very high	77 Å²	77	47.9 Å²	47.9	50%	0.5	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-54.9	144.6	174.2	-24.8	34.1	0	0	0	112.2	G327 R421	P288-G327 WeakPolarHBondContact CA-O 3.44Å; P288-R421 PolarHBondContact O-NH1 3.17Å
289	V	97.1	Very high	96.8	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.1	171	-173	0	0	0	0	107.7	E293 F320 T326 G327 V330 V423	V289-E293 HydrophobicContact CG1-CB 3.78Å; V289-F320 HydrophobicContact CB-CZ 4.25Å; V289-F320 HydrophobicContact CG1-CZ 4.23Å; V289-F320 WeakPolarHBondContact O-CZ 3.33Å; V289-T326 CarbonylContact O-C 3.58Å; V289-T326 WeakPolarHBondContact O-CA 3.44Å; V289-G327 PolarHBondContact N-O 3.26Å; V289-G327 PolarHBondContact O-N 2.94Å; V289-V330 HydrophobicContact CG1-CG2 3.78Å; V289-V423 HydrophobicContact CG1-CG1 4.12Å; V289-V423 HydrophobicContact CG2-CG1 3.69Å
290	S	97.3	Very high	96.8	Very high	41 Å²	41	49 Å²	49	29%	0.287	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	159.9	175.1	64	0	0	0	0	112.2	A292 E293 A294 L325	S290-A292 PolarHBondContact O-N 3.32Å; S290-E293 WeakPolarHBondContact CB-OE2 3.24Å; S290-E293 PolarHBondContact N-OE2 3.33Å; S290-E293 PolarHBondContact O-N 2.88Å; S290-E293 VanDerWaalsContact OG-CG 3.31Å; S290-E293 WeakPolarHBondContact OG-CG 3.41Å; S290-E293 PolarHBondContact OG-N 3.01Å; S290-E293 PolarHBondContact OG-OE2 3.15Å; S290-A294 PolarHBondContact O-N 3.11Å; S290-L325 CarbonylContact C-O 3.56Å
291	L	96.8	Very high	96.7	Very high	67 Å²	67	42.3 Å²	42.3	35%	0.351	23%	0.229	S	C	.	.	H	α-helix	trans	-57.9	-36.9	172.9	-179.9	62	0	0	0	112	A294 E295 F320 L325	L291-A294 PolarHBondContact O-N 3.21Å; L291-E295 HydrophobicContact CD1-CG 4.21Å; L291-E295 HydrophobicContact CG-CG 4.39Å; L291-E295 WeakPolarHBondContact O-CB 3.5Å; L291-E295 VanDerWaalsContact O-CG 3.31Å; L291-E295 WeakPolarHBondContact O-CG 3.28Å; L291-E295 PolarHBondContact O-N 2.84Å; L291-F320 HydrophobicContact CB-CD1 4.4Å; L291-F320 HydrophobicContact CB-CE1 4.31Å; L291-F320 HydrophobicContact CD1-CD1 3.86Å; L291-L325 HydrophobicContact CD2-CD2 4.22Å; L291-L325 PolarHBondContact N-O 3.42Å
292	A	96.3	Very high	96.7	Very high	57 Å²	57	42.9 Å²	42.9	47%	0.471	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-42.5	176.9	0	0	0	0	0	112.2	S290 E295 A296	S290-A292 PolarHBondContact O-N 3.32Å; A292-E295 PolarHBondContact O-N 3.05Å; A292-A296 WeakPolarHBondContact O-CB 3.46Å; A292-A296 PolarHBondContact O-N 3.01Å
293	E	96.9	Very high	96.7	Very high	25 Å²	25	48.7 Å²	48.7	12%	0.117	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-41.4	173.5	-71.7	164.7	128.6	0	0	111.6	V289 S290 E295 A296 I297 L395 T400 R421	V289-E293 HydrophobicContact CG1-CB 3.78Å; S290-E293 WeakPolarHBondContact CB-OE2 3.24Å; S290-E293 PolarHBondContact N-OE2 3.33Å; S290-E293 PolarHBondContact O-N 2.88Å; S290-E293 VanDerWaalsContact OG-CG 3.31Å; S290-E293 WeakPolarHBondContact OG-CG 3.41Å; S290-E293 PolarHBondContact OG-N 3.01Å; S290-E293 PolarHBondContact OG-OE2 3.15Å; E293-E295 VanDerWaalsContact C-N 3.34Å; E293-E295 PolarHBondContact O-N 2.98Å; E293-A296 PolarHBondContact O-N 3.34Å; E293-I297 VanDerWaalsContact O-CG1 3.3Å; E293-I297 WeakPolarHBondContact O-CG1 3.3Å; E293-I297 PolarHBondContact O-N 3.28Å; E293-L395 HydrophobicContact CB-CD2 3.78Å; E293-L395 HydrophobicContact CG-CD2 3.77Å; E293-T400 HydrophobicContact CG-CG2 3.75Å; E293-R421 WeakPolarHBondContact OE1-CD 3.41Å; E293-R421 IonicContact OE1-CZ 3.44Å; E293-R421 IonicContact OE1-NE 2.67Å; E293-R421 IonicContact OE1-NH1 3.14Å; E293-R421 PolarHBondContact OE1-NH1 2.99Å; E293-R421 IonicContact OE2-NH1 2.79Å
294	A	97.6	Very high	96.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-42	176.2	0	0	0	0	0	112.2	S290 L291 I297 R298 F320 V330	S290-A294 PolarHBondContact O-N 3.11Å; L291-A294 PolarHBondContact O-N 3.21Å; A294-I297 PolarHBondContact O-N 3.48Å; A294-R298 WeakPolarHBondContact O-CB 3.42Å; A294-R298 PolarHBondContact O-N 3.29Å; A294-F320 HydrophobicContact CB-CD1 4.2Å; A294-F320 HydrophobicContact CB-CD2 3.94Å; A294-F320 HydrophobicContact CB-CE1 4.02Å; A294-F320 HydrophobicContact CB-CE2 3.71Å; A294-F320 HydrophobicContact CB-CG 4.18Å; A294-F320 HydrophobicContact CB-CZ 3.76Å; A294-V330 HydrophobicContact CB-CG1 3.95Å; A294-V330 HydrophobicContact CB-CG2 3.91Å
295	E	96.7	Very high	96.7	Very high	62 Å²	62	43.1 Å²	43.1	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-68.2	-39.4	176.6	-75.5	-63	160.8	0	0	112.8	L291 A292 E293 I297 R298 G299	L291-E295 HydrophobicContact CD1-CG 4.21Å; L291-E295 HydrophobicContact CG-CG 4.39Å; L291-E295 WeakPolarHBondContact O-CB 3.5Å; L291-E295 VanDerWaalsContact O-CG 3.31Å; L291-E295 WeakPolarHBondContact O-CG 3.28Å; L291-E295 PolarHBondContact O-N 2.84Å; A292-E295 PolarHBondContact O-N 3.05Å; E293-E295 VanDerWaalsContact C-N 3.34Å; E293-E295 PolarHBondContact O-N 2.98Å; E295-I297 VanDerWaalsContact C-N 3.35Å; E295-I297 PolarHBondContact O-N 3.32Å; E295-R298 VanDerWaalsContact CD-CZ 3.44Å; E295-R298 VanDerWaalsContact CD-NH1 3.32Å; E295-R298 WeakPolarHBondContact O-CB 3.22Å; E295-R298 PolarHBondContact O-N 3.03Å; E295-R298 IonicContact OE1-CZ 3.67Å; E295-R298 IonicContact OE1-NE 3.69Å; E295-R298 IonicContact OE1-NH1 3.48Å; E295-R298 PolarHBondContact OE1-NH1 3.37Å; E295-R298 IonicContact OE1-NH2 3.92Å; E295-R298 IonicContact OE2-CZ 3.05Å; E295-R298 IonicContact OE2-NE 3.75Å; E295-R298 PolarHBondContact OE2-NE 2.98Å; E295-R298 IonicContact OE2-NH1 3.21Å; E295-R298 PolarHBondContact OE2-NH1 3.15Å; E295-R298 IonicContact OE2-NH2 2.94Å; E295-R298 PolarHBondContact OE2-NH2 2.94Å; E295-G299 PolarHBondContact O-N 3.42Å
296	A	96.8	Very high	96.8	Very high	17 Å²	17	45 Å²	45	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-45.9	172.2	0	0	0	0	0	111.6	A292 E293 G299 I300 L395 Q399 T400	A292-A296 WeakPolarHBondContact O-CB 3.46Å; A292-A296 PolarHBondContact O-N 3.01Å; E293-A296 PolarHBondContact O-N 3.34Å; A296-G299 PolarHBondContact O-N 3.41Å; A296-I300 WeakPolarHBondContact O-CG1 3.42Å; A296-I300 PolarHBondContact O-N 3.33Å; A296-I300 VanDerWaalsContact O-N 3.12Å; A296-L395 HydrophobicContact CB-CD1 4.37Å; A296-Q399 WeakPolarHBondContact CB-O 3.48Å; A296-T400 HydrophobicContact CB-CG2 4.47Å
297	I	97.6	Very high	96.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-42.1	175.6	-66.4	168.4	0	0	0	110.3	E293 A294 E295 G299 I300 V301 V330 F332 F393 L395 V423 V425	E293-I297 VanDerWaalsContact O-CG1 3.3Å; E293-I297 WeakPolarHBondContact O-CG1 3.3Å; E293-I297 PolarHBondContact O-N 3.28Å; A294-I297 PolarHBondContact O-N 3.48Å; E295-I297 VanDerWaalsContact C-N 3.35Å; E295-I297 PolarHBondContact O-N 3.32Å; I297-G299 VanDerWaalsContact C-N 3.26Å; I297-G299 PolarHBondContact O-N 3.06Å; I297-I300 WeakPolarHBondContact O-CB 3.23Å; I297-I300 PolarHBondContact O-N 3.31Å; I297-V301 HydrophobicContact CG2-CG2 4.02Å; I297-V301 WeakPolarHBondContact O-CG2 3.47Å; I297-V301 PolarHBondContact O-N 3.42Å; I297-V330 HydrophobicContact CD1-CG2 3.96Å; I297-F332 HydrophobicContact CG2-CE2 3.64Å; I297-F332 HydrophobicContact CG2-CZ 4.01Å; I297-F393 HydrophobicContact CG2-CD1 4.22Å; I297-F393 HydrophobicContact CG2-CE1 4.23Å; I297-L395 HydrophobicContact CD1-CD2 4.16Å; I297-L395 HydrophobicContact CG1-CD1 3.96Å; I297-L395 HydrophobicContact CG1-CD2 4.26Å; I297-V423 HydrophobicContact CD1-CB 3.93Å; I297-V423 HydrophobicContact CD1-CG1 3.56Å; I297-V423 HydrophobicContact CD1-CG2 4.29Å; I297-V425 HydrophobicContact CD1-CG2 4.04Å; I297-V425 HydrophobicContact CG2-CG1 4.09Å; I297-V425 HydrophobicContact CG2-CG2 3.94Å
298	R	97.3	Very high	96.8	Very high	109 Å²	109	38.9 Å²	38.9	41%	0.411	23%	0.231	S	C	.	.	H	α-helix	trans	-55.4	-43.1	174.8	-171.9	-177.8	82.3	-176.2	8.5	111.3	A294 E295 I300 G302 F332	A294-R298 WeakPolarHBondContact O-CB 3.42Å; A294-R298 PolarHBondContact O-N 3.29Å; E295-R298 VanDerWaalsContact CD-CZ 3.44Å; E295-R298 VanDerWaalsContact CD-NH1 3.32Å; E295-R298 WeakPolarHBondContact O-CB 3.22Å; E295-R298 PolarHBondContact O-N 3.03Å; E295-R298 IonicContact OE1-CZ 3.67Å; E295-R298 IonicContact OE1-NE 3.69Å; E295-R298 IonicContact OE1-NH1 3.48Å; E295-R298 PolarHBondContact OE1-NH1 3.37Å; E295-R298 IonicContact OE1-NH2 3.92Å; E295-R298 IonicContact OE2-CZ 3.05Å; E295-R298 IonicContact OE2-NE 3.75Å; E295-R298 PolarHBondContact OE2-NE 2.98Å; E295-R298 IonicContact OE2-NH1 3.21Å; E295-R298 PolarHBondContact OE2-NH1 3.15Å; E295-R298 IonicContact OE2-NH2 2.94Å; E295-R298 PolarHBondContact OE2-NH2 2.94Å; R298-I300 PolarHBondContact O-N 3.33Å; R298-G302 WeakPolarHBondContact O-CA 3.3Å; R298-G302 PolarHBondContact O-N 2.72Å; R298-F332 HydrophobicContact CB-CE1 3.74Å; R298-F332 HydrophobicContact CB-CZ 3.87Å; R298-F332 HydrophobicContact CG-CE1 3.8Å; R298-F332 HydrophobicContact CG-CZ 4.42Å
299	G	96.8	Very high	96.7	Very high	32 Å²	32	36 Å²	36	33%	0.33	21%	0.212	S	C	.	.	H	α-helix	trans	-63.2	-38.3	175.5	0	0	0	0	0	113.5	E295 A296 I297 R303	E295-G299 PolarHBondContact O-N 3.42Å; A296-G299 PolarHBondContact O-N 3.41Å; I297-G299 VanDerWaalsContact C-N 3.26Å; I297-G299 PolarHBondContact O-N 3.06Å; G299-R303 WeakPolarHBondContact O-CG 3.32Å; G299-R303 PolarHBondContact O-N 2.94Å; G299-R303 PolarHBondContact O-NH1 2.93Å
300	I	96.8	Very high	96.6	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-52.3	176.4	-65.7	163.9	0	0	0	110.9	A296 I297 R298 G302 R303 A304 L353 L358 L395	A296-I300 WeakPolarHBondContact O-CG1 3.42Å; A296-I300 PolarHBondContact O-N 3.33Å; A296-I300 VanDerWaalsContact O-N 3.12Å; I297-I300 WeakPolarHBondContact O-CB 3.23Å; I297-I300 PolarHBondContact O-N 3.31Å; R298-I300 PolarHBondContact O-N 3.33Å; I300-G302 VanDerWaalsContact C-N 3.31Å; I300-G302 PolarHBondContact O-N 2.94Å; I300-R303 PolarHBondContact O-N 3.27Å; I300-A304 PolarHBondContact O-N 2.72Å; I300-A304 VanDerWaalsContact O-N 3.16Å; I300-L353 HydrophobicContact CG2-CD2 4.28Å; I300-L358 HydrophobicContact CG2-CD1 3.74Å; I300-L395 HydrophobicContact CD1-CD1 4.23Å
301	V	97	Very high	96.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-37	-179	-173.7	0	0	0	0	110.2	I297 R303 A304 V305 I314 F332 L349 F393 M427	I297-V301 HydrophobicContact CG2-CG2 4.02Å; I297-V301 WeakPolarHBondContact O-CG2 3.47Å; I297-V301 PolarHBondContact O-N 3.42Å; V301-R303 PolarHBondContact O-N 3.34Å; V301-A304 CarbonylContact O-C 3.4Å; V301-A304 WeakPolarHBondContact O-CA 3.49Å; V301-A304 WeakPolarHBondContact O-CB 3.18Å; V301-A304 PolarHBondContact O-N 3.23Å; V301-A304 VanDerWaalsContact O-N 3.08Å; V301-V305 HydrophobicContact CG1-CG2 4.22Å; V301-V305 WeakPolarHBondContact O-CG2 3.34Å; V301-V305 PolarHBondContact O-N 2.76Å; V301-I314 HydrophobicContact CB-CD1 3.73Å; V301-I314 HydrophobicContact CG1-CD1 3.41Å; V301-I314 VanDerWaalsContact CG1-CD1 3.41Å; V301-F332 HydrophobicContact CG2-CD2 4.29Å; V301-F332 HydrophobicContact CG2-CE2 4.02Å; V301-L349 HydrophobicContact CG1-CD1 4.39Å; V301-L349 HydrophobicContact CG1-CD2 4.38Å; V301-F393 HydrophobicContact CG2-CE1 3.74Å; V301-F393 HydrophobicContact CG2-CZ 3.7Å; V301-M427 HydrophobicContact CG1-SD 4.01Å
302	G	97	Very high	96.4	Very high	20 Å²	20	42.8 Å²	42.8	21%	0.206	25%	0.25	C	C	.	.	H	α-helix	trans	-59.2	-42.8	174.6	0	0	0	0	0	113.3	R298 I300 A304 V305 A306	R298-G302 WeakPolarHBondContact O-CA 3.3Å; R298-G302 PolarHBondContact O-N 2.72Å; I300-G302 VanDerWaalsContact C-N 3.31Å; I300-G302 PolarHBondContact O-N 2.94Å; G302-A304 VanDerWaalsContact C-N 3.3Å; G302-A304 PolarHBondContact O-N 3.04Å; G302-V305 PolarHBondContact O-N 3.02Å; G302-A306 WeakPolarHBondContact O-CB 3.41Å; G302-A306 PolarHBondContact O-N 3.18Å
303	R	96.9	Very high	96.2	Very high	137 Å²	137	45.1 Å²	45.1	52%	0.517	25%	0.251	S	S	.	.	H	α-helix	trans	-63.3	-37.8	172.7	-74	-171.4	-61.6	-86.8	3.8	112.4	G299 I300 V301 S307 W352	G299-R303 WeakPolarHBondContact O-CG 3.32Å; G299-R303 PolarHBondContact O-N 2.94Å; G299-R303 PolarHBondContact O-NH1 2.93Å; I300-R303 PolarHBondContact O-N 3.27Å; V301-R303 PolarHBondContact O-N 3.34Å; R303-S307 WeakPolarHBondContact O-CB 3.49Å; R303-S307 PolarHBondContact O-N 2.93Å; R303-S307 PolarHBondContact O-OG 3.44Å; R303-W352 HydrophobicContact CB-CH2 4.4Å
304	A	96.7	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-46.1	178.3	0	0	0	0	0	111.1	I300 V301 G302 S307 V308 L349 W352 L353	I300-A304 PolarHBondContact O-N 2.72Å; I300-A304 VanDerWaalsContact O-N 3.16Å; V301-A304 CarbonylContact O-C 3.4Å; V301-A304 WeakPolarHBondContact O-CA 3.49Å; V301-A304 WeakPolarHBondContact O-CB 3.18Å; V301-A304 PolarHBondContact O-N 3.23Å; V301-A304 VanDerWaalsContact O-N 3.08Å; G302-A304 VanDerWaalsContact C-N 3.3Å; G302-A304 PolarHBondContact O-N 3.04Å; A304-S307 WeakPolarHBondContact O-CB 3.41Å; A304-S307 PolarHBondContact O-N 2.92Å; A304-V308 WeakPolarHBondContact O-CG1 3.28Å; A304-V308 PolarHBondContact O-N 3.45Å; A304-L349 HydrophobicContact CB-CD1 3.31Å; A304-W352 HydrophobicContact CB-CD2 3.67Å; A304-W352 HydrophobicContact CB-CE3 3.24Å; A304-W352 HydrophobicContact CB-CG 4.34Å; A304-W352 HydrophobicContact CB-CH2 4.1Å; A304-W352 HydrophobicContact CB-CZ2 4.43Å; A304-W352 HydrophobicContact CB-CZ3 3.5Å; A304-W352 VanDerWaalsContact CB-CZ3 3.5Å; A304-L353 HydrophobicContact CB-CD2 4.11Å; A304-L353 HydrophobicContact CB-CG 4.36Å
305	V	96.7	Very high	96	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.03	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-52.2	174.8	172.2	0	0	0	0	110.6	V301 G302 S307 V308 S309 A312 I314 I334 L349	V301-V305 HydrophobicContact CG1-CG2 4.22Å; V301-V305 WeakPolarHBondContact O-CG2 3.34Å; V301-V305 PolarHBondContact O-N 2.76Å; G302-V305 PolarHBondContact O-N 3.02Å; V305-S307 PolarHBondContact O-N 3.13Å; V305-V308 VanDerWaalsContact O-CG2 3.27Å; V305-V308 WeakPolarHBondContact O-CG2 3.47Å; V305-V308 PolarHBondContact O-N 3.17Å; V305-S309 CarbonylContact O-C 3.48Å; V305-S309 PolarHBondContact O-N 3.5Å; V305-S309 VanDerWaalsContact O-O 3.06Å; V305-A312 HydrophobicContact CG1-CB 3.52Å; V305-I314 HydrophobicContact CG2-CD1 4.42Å; V305-I334 HydrophobicContact CG1-CG2 4.49Å; V305-I334 HydrophobicContact CG2-CD1 3.95Å; V305-I334 HydrophobicContact CG2-CG1 4.37Å; V305-I334 HydrophobicContact CG2-CG2 4.37Å; V305-L349 HydrophobicContact CG2-CD1 4.16Å; V305-L349 HydrophobicContact CG2-CD2 4.38Å
306	A	96.5	Very high	96	Very high	53 Å²	53	46.9 Å²	46.9	44%	0.438	26%	0.264	S	S	.	.	H	α-helix	trans	-60.8	-29.8	178.7	0	0	0	0	0	113.4	G302	G302-A306 WeakPolarHBondContact O-CB 3.41Å; G302-A306 PolarHBondContact O-N 3.18Å
307	S	96.4	Very high	96	Very high	73 Å²	73	47.7 Å²	47.7	51%	0.51	27%	0.268	S	S	.	.	H	α-helix	trans	-73	-30.2	176.1	-60	0	0	0	0	113.1	R303 A304 V305 W352	R303-S307 WeakPolarHBondContact O-CB 3.49Å; R303-S307 PolarHBondContact O-N 2.93Å; R303-S307 PolarHBondContact O-OG 3.44Å; A304-S307 WeakPolarHBondContact O-CB 3.41Å; A304-S307 PolarHBondContact O-N 2.92Å; V305-S307 PolarHBondContact O-N 3.13Å; S307-W352 VanDerWaalsContact CB-NE1 3.3Å; S307-W352 PolarHBondContact OG-NE1 2.92Å
308	V	95.2	Very high	95.9	Very high	34 Å²	34	48.5 Å²	48.5	21%	0.206	28%	0.277	C	S	.	.	H	α-helix	trans	-97.2	-29.7	-175.8	-58.8	0	0	0	0	113.1	A304 V305 L345 K348 W352	A304-V308 WeakPolarHBondContact O-CG1 3.28Å; A304-V308 PolarHBondContact O-N 3.45Å; V305-V308 VanDerWaalsContact O-CG2 3.27Å; V305-V308 WeakPolarHBondContact O-CG2 3.47Å; V305-V308 PolarHBondContact O-N 3.17Å; V308-L345 HydrophobicContact CG2-CD2 4.36Å; V308-K348 HydrophobicContact CB-CB 3.93Å; V308-K348 HydrophobicContact CG1-CB 3.84Å; V308-W352 HydrophobicContact CG1-CB 4.33Å
309	S	95.1	Very high	95.8	Very high	15 Å²	15	44 Å²	44	11%	0.105	26%	0.264	C	S	.	.			trans	-154.1	106	171.2	177.6	0	0	0	0	109.2	V305 E311 A312 H336	V305-S309 CarbonylContact O-C 3.48Å; V305-S309 PolarHBondContact O-N 3.5Å; V305-S309 VanDerWaalsContact O-O 3.06Å; S309-E311 PolarHBondContact O-N 3.47Å; S309-A312 WeakPolarHBondContact O-CB 3.47Å; S309-A312 PolarHBondContact O-N 2.76Å; S309-A312 VanDerWaalsContact O-N 3.11Å; S309-H336 PolarHBondContact OG-CD2 2.85Å; S309-H336 PolarHBondContact OG-NE2 3.48Å
310	P	93.6	Very high	95.9	Very high	114 Å²	114	43.1 Å²	43.1	74%	0.74	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.2	-176.6	-27.5	35.8	0	0	0	114.8
311	E	94.4	Very high	95.9	Very high	126 Å²	126	48.7 Å²	48.7	59%	0.589	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-9	-179.9	-62.6	-172.7	-172	0	0	113.2	S309 P337	S309-E311 PolarHBondContact O-N 3.47Å; E311-P337 HydrophobicContact CB-CG 4.07Å; E311-P337 WeakPolarHBondContact O-CD 3.14Å
312	A	95.1	Very high	95.9	Very high	14 Å²	14	56.5 Å²	56.5	12%	0.116	30%	0.301	C	S	.	.			trans	-65	141.5	176	0	0	0	0	0	111.6	V305 S309 T335 L345	V305-A312 HydrophobicContact CG1-CB 3.52Å; S309-A312 WeakPolarHBondContact O-CB 3.47Å; S309-A312 PolarHBondContact O-N 2.76Å; S309-A312 VanDerWaalsContact O-N 3.11Å; A312-T335 CarbonylContact C-O 3.53Å; A312-T335 WeakPolarHBondContact CA-O 3.15Å; A312-L345 HydrophobicContact CB-CD1 4.1Å
313	Q	94	Very high	95.8	Very high	107 Å²	107	57.6 Å²	57.6	50%	0.5	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	144.7	-179.2	-61.5	-179.4	-2.8	0	0	110.2	I334 T335	Q313-I334 VanDerWaalsContact O-CA 3.3Å; Q313-I334 WeakPolarHBondContact O-CA 3.23Å; Q313-T335 HydrophobicContact CB-CG2 4Å; Q313-T335 PolarHBondContact N-O 2.91Å; Q313-T335 PolarHBondContact O-N 3.5Å
314	I	94.9	Very high	95.8	Very high	44 Å²	44	55.3 Å²	55.3	23%	0.226	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.3	175.3	-176.9	174.5	0	0	0	110	V301 V305 F332 L333 I334	V301-I314 HydrophobicContact CB-CD1 3.73Å; V301-I314 HydrophobicContact CG1-CD1 3.41Å; V301-I314 VanDerWaalsContact CG1-CD1 3.41Å; V305-I314 HydrophobicContact CG2-CD1 4.42Å; I314-F332 HydrophobicContact CD1-CB 4.26Å; I314-F332 HydrophobicContact CD1-CD1 3.68Å; I314-F332 HydrophobicContact CD1-CE1 4.19Å; I314-F332 HydrophobicContact CD1-CG 3.93Å; I314-F332 HydrophobicContact CG1-CB 4.24Å; I314-F332 HydrophobicContact CG1-CD1 3.81Å; I314-F332 HydrophobicContact CG1-CG 4.25Å; I314-L333 WeakPolarHBondContact CA-O 3.24Å; I314-I334 HydrophobicContact CG1-CG1 4.24Å
315	V	95.4	Very high	95.9	Very high	59 Å²	59	61.4 Å²	61.4	36%	0.358	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.9	179.3	-177.4	0	0	0	0	109.2	T317 F332 L333	V315-T317 HydrophobicContact CB-CG2 4.46Å; V315-T317 HydrophobicContact CG1-CG2 4.17Å; V315-T317 PolarHBondContact O-N 2.83Å; V315-F332 WeakPolarHBondContact O-CA 2.81Å; V315-L333 PolarHBondContact N-O 3.34Å; V315-L333 PolarHBondContact O-N 3.16Å
316	L	96.1	Very high	95.9	Very high	20 Å²	20	65.1 Å²	65.1	11%	0.105	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122.5	167.5	179	63	0	0	0	108.7	F320 R321 V330 F332	L316-F320 HydrophobicContact CD1-CB 4.3Å; L316-F320 HydrophobicContact CD1-CD2 4.46Å; L316-F320 HydrophobicContact CD2-CB 3.82Å; L316-F320 HydrophobicContact CG-CB 4.04Å; L316-R321 WeakPolarHBondContact O-CB 3.36Å; L316-V330 HydrophobicContact CD1-CG1 3.55Å; L316-F332 HydrophobicContact CB-CD1 4.46Å; L316-F332 HydrophobicContact CB-CE1 4.17Å; L316-F332 HydrophobicContact CD1-CD1 4.29Å; L316-F332 HydrophobicContact CD1-CE1 3.74Å; L316-F332 HydrophobicContact CD1-CZ 4.19Å
317	T	96.1	Very high	95.9	Very high	34 Å²	34	63.1 Å²	63.1	21%	0.209	35%	0.346	C	S	.	.			trans	-115.9	-147.5	-174.9	66.9	0	0	0	0	111.4	V315 R321 D331 L333	V315-T317 HydrophobicContact CB-CG2 4.46Å; V315-T317 HydrophobicContact CG1-CG2 4.17Å; V315-T317 PolarHBondContact O-N 2.83Å; T317-R321 PolarHBondContact O-N 3.23Å; T317-R321 VanDerWaalsContact O-N 3.12Å; T317-D331 PolarHBondContact N-O 3.36Å; T317-D331 VanDerWaalsContact OG1-CB 3.24Å; T317-D331 WeakPolarHBondContact OG1-CB 3.4Å; T317-D331 PolarHBondContact OG1-O 2.86Å; T317-D331 VanDerWaalsContact OG1-O 3.05Å; T317-L333 HydrophobicContact CG2-CB 3.65Å
318	G	95.6	Very high	95.8	Very high	18 Å²	18	66 Å²	66	19%	0.186	35%	0.351	C	S	.	.	H	α-helix	trans	61.5	-147.6	171.7	0	0	0	0	0	114.8	F320 R322 D331	G318-F320 VanDerWaalsContact C-N 3.34Å; G318-R322 PolarHBondContact O-NH1 2.88Å; G318-D331 VanDerWaalsContact CA-OD2 3.32Å; G318-D331 WeakPolarHBondContact CA-OD2 3.32Å
319	G	96.3	Very high	95.9	Very high	14 Å²	14	66 Å²	66	14%	0.144	35%	0.35	C	S	.	.	H	α-helix	trans	-64	-35.8	-179.9	0	0	0	0	0	113.8	R322 G323 K324	G319-R322 CarbonylContact O-C 3.23Å; G319-R322 PolarHBondContact O-N 3.11Å; G319-R322 VanDerWaalsContact O-N 3.15Å; G319-G323 PolarHBondContact O-N 3.23Å; G319-K324 WeakPolarHBondContact O-CB 3.42Å; G319-K324 WeakPolarHBondContact O-CG 3.3Å; G319-K324 PolarHBondContact O-N 3.27Å; G319-K324 VanDerWaalsContact O-N 3.12Å
320	F	97.6	Very high	96	Very high	13 Å²	13	65.3 Å²	65.3	6%	0.057	35%	0.345	C	S	.	.	H	α-helix	trans	-66.9	-41.3	-179.2	-67.9	-70.6	0	0	0	112	V289 L291 A294 L316 G318 R322 G323 K324 D329 V330	V289-F320 HydrophobicContact CB-CZ 4.25Å; V289-F320 HydrophobicContact CG1-CZ 4.23Å; V289-F320 WeakPolarHBondContact O-CZ 3.33Å; L291-F320 HydrophobicContact CB-CD1 4.4Å; L291-F320 HydrophobicContact CB-CE1 4.31Å; L291-F320 HydrophobicContact CD1-CD1 3.86Å; A294-F320 HydrophobicContact CB-CD1 4.2Å; A294-F320 HydrophobicContact CB-CD2 3.94Å; A294-F320 HydrophobicContact CB-CE1 4.02Å; A294-F320 HydrophobicContact CB-CE2 3.71Å; A294-F320 HydrophobicContact CB-CG 4.18Å; A294-F320 HydrophobicContact CB-CZ 3.76Å; L316-F320 HydrophobicContact CD1-CB 4.3Å; L316-F320 HydrophobicContact CD1-CD2 4.46Å; L316-F320 HydrophobicContact CD2-CB 3.82Å; L316-F320 HydrophobicContact CG-CB 4.04Å; G318-F320 VanDerWaalsContact C-N 3.34Å; F320-R322 PolarHBondContact O-N 3.2Å; F320-G323 WeakPolarHBondContact O-CA 3.07Å; F320-G323 PolarHBondContact O-N 3.13Å; F320-K324 WeakPolarHBondContact CD1-O 3.27Å; F320-D329 VanDerWaalsContact CE2-O 3.25Å; F320-D329 WeakPolarHBondContact CE2-O 3.28Å; F320-V330 HydrophobicContact CE2-CG2 4.15Å
321	R	96.9	Very high	96.2	Very high	122 Å²	122	61.7 Å²	61.7	46%	0.46	32%	0.319	S	S	.	.	H	α-helix	trans	-60.3	-28.8	172.4	-168.6	178.3	-171.1	-89.7	-1	112.9	L316 T317 G323 P439	L316-R321 WeakPolarHBondContact O-CB 3.36Å; T317-R321 PolarHBondContact O-N 3.23Å; T317-R321 VanDerWaalsContact O-N 3.12Å; R321-G323 PolarHBondContact O-N 3.47Å; R321-P439 VanDerWaalsContact CZ-O 3.31Å; R321-P439 PolarHBondContact NH1-O 3.5Å; R321-P439 VanDerWaalsContact NH2-C 3.26Å; R321-P439 PolarHBondContact NH2-O 2.92Å; R321-P439 PolarHBondContact NH2-OXT 2.95Å
322	R	96.7	Very high	96.3	Very high	165 Å²	165	55.8 Å²	55.8	62%	0.623	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	7.3	174.5	-59.6	-169.7	-59.2	-86.6	6	113.6	G318 G319 F320	G318-R322 PolarHBondContact O-NH1 2.88Å; G319-R322 CarbonylContact O-C 3.23Å; G319-R322 PolarHBondContact O-N 3.11Å; G319-R322 VanDerWaalsContact O-N 3.15Å; F320-R322 PolarHBondContact O-N 3.2Å
323	G	96.3	Very high	96.4	Very high	43 Å²	43	56.9 Å²	56.9	44%	0.443	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	6.2	175.9	0	0	0	0	0	115.5	L148 G319 F320 R321 L325	L148-G323 VanDerWaalsContact CD1-C 3.41Å; L148-G323 VanDerWaalsContact CD1-O 3.25Å; L148-G323 WeakPolarHBondContact CD1-O 3.44Å; G319-G323 PolarHBondContact O-N 3.23Å; F320-G323 WeakPolarHBondContact O-CA 3.07Å; F320-G323 PolarHBondContact O-N 3.13Å; R321-G323 PolarHBondContact O-N 3.47Å; G323-L325 PolarHBondContact O-N 2.9Å
324	K	97	Very high	96.4	Very high	89 Å²	89	51.9 Å²	51.9	39%	0.387	27%	0.272	S	S	.	.			trans	-64.8	134.2	177.3	-69.9	-168.7	172	-169.4	0	110.5	L148 G319 F320 T326	L148-K324 HydrophobicContact CD2-CG 3.98Å; G319-K324 WeakPolarHBondContact O-CB 3.42Å; G319-K324 WeakPolarHBondContact O-CG 3.3Å; G319-K324 PolarHBondContact O-N 3.27Å; G319-K324 VanDerWaalsContact O-N 3.12Å; F320-K324 WeakPolarHBondContact CD1-O 3.27Å; K324-T326 VanDerWaalsContact C-N 3.33Å
325	L	97.3	Very high	96.4	Very high	127 Å²	127	50 Å²	50	67%	0.665	26%	0.262	S	S	*	.	S	Bend	trans	-79.3	-19.4	173.5	-59.7	-179.6	0	0	0	112.9	S290 L291 G323	S290-L325 CarbonylContact C-O 3.56Å; L291-L325 HydrophobicContact CD2-CD2 4.22Å; L291-L325 PolarHBondContact N-O 3.42Å; G323-L325 PolarHBondContact O-N 2.9Å
326	T	97.7	Very high	96.3	Very high	83 Å²	83	47.6 Å²	47.6	51%	0.509	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.5	177.5	60.6	0	0	0	0	111.8	V289 K324	V289-T326 CarbonylContact O-C 3.58Å; V289-T326 WeakPolarHBondContact O-CA 3.44Å; K324-T326 VanDerWaalsContact C-N 3.33Å
327	G	95.9	Very high	96.1	Very high	12 Å²	12	49.3 Å²	49.3	12%	0.124	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	177.9	179.9	0	0	0	0	0	113.3	P288 V289	P288-G327 WeakPolarHBondContact CA-O 3.44Å; V289-G327 PolarHBondContact N-O 3.26Å; V289-G327 PolarHBondContact O-N 2.94Å
328	H	94.4	Very high	95.8	Very high	132 Å²	132	53.3 Å²	53.3	61%	0.611	28%	0.276	S	S	*	.	S	Bend	trans	-95.4	-16.3	175.1	-64.2	-65.9	0	0	0	113	R424	H328-R424 PolarHBondContact O-NH2 3.02Å
329	D	96.9	Very high	95.4	Very high	35 Å²	35	57.3 Å²	57.3	19%	0.187	29%	0.29	C	S	.	.	S	Bend	trans	-161.9	167.7	-174.2	37.3	22.4	0	0	0	109.4	F320 R424 P426	F320-D329 VanDerWaalsContact CE2-O 3.25Å; F320-D329 WeakPolarHBondContact CE2-O 3.28Å; D329-R424 CarbonylContact C-O 3.47Å; D329-R424 VanDerWaalsContact CA-O 3.24Å; D329-R424 WeakPolarHBondContact CA-O 3.34Å; D329-R424 HydrophobicContact CB-CB 3.79Å; D329-R424 WeakPolarHBondContact CB-O 3.46Å; D329-R424 VanDerWaalsContact CG-NH2 3.27Å; D329-R424 IonicContact OD2-CZ 3.37Å; D329-R424 IonicContact OD2-NH1 2.7Å; D329-R424 PolarHBondContact OD2-NH1 3.21Å; D329-R424 IonicContact OD2-NH2 2.93Å; D329-R424 PolarHBondContact OD2-NH2 3.42Å; D329-P426 HydrophobicContact CB-CG 4.29Å
330	V	98.1	Very high	95	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.302	C	S	.	.			trans	-116.5	106.8	177.2	-170	0	0	0	0	109.2	V289 A294 I297 L316 F320 F332 V423 R424 V425 P426	V289-V330 HydrophobicContact CG1-CG2 3.78Å; A294-V330 HydrophobicContact CB-CG1 3.95Å; A294-V330 HydrophobicContact CB-CG2 3.91Å; I297-V330 HydrophobicContact CD1-CG2 3.96Å; L316-V330 HydrophobicContact CD1-CG1 3.55Å; F320-V330 HydrophobicContact CE2-CG2 4.15Å; V330-F332 HydrophobicContact CB-CE2 4.26Å; V330-F332 HydrophobicContact CG1-CD2 4.39Å; V330-F332 HydrophobicContact CG1-CE1 4.16Å; V330-F332 HydrophobicContact CG1-CE2 3.51Å; V330-F332 HydrophobicContact CG1-CZ 3.37Å; V330-V423 HydrophobicContact CG2-CG1 4.16Å; V330-R424 PolarHBondContact N-O 3.45Å; V330-V425 HydrophobicContact CB-CG2 4.39Å; V330-V425 WeakPolarHBondContact O-CA 3.39Å; V330-V425 WeakPolarHBondContact O-CG1 3.32Å; V330-P426 WeakPolarHBondContact O-CD 3.48Å
331	D	97.7	Very high	94.7	Very high	38 Å²	38	60 Å²	60	20%	0.203	31%	0.314	C	S	.	.			trans	-92.1	125.9	-176	-57.9	-61.7	0	0	0	111.8	T317 G318 P426	T317-D331 PolarHBondContact N-O 3.36Å; T317-D331 VanDerWaalsContact OG1-CB 3.24Å; T317-D331 WeakPolarHBondContact OG1-CB 3.4Å; T317-D331 PolarHBondContact OG1-O 2.86Å; T317-D331 VanDerWaalsContact OG1-O 3.05Å; G318-D331 VanDerWaalsContact CA-OD2 3.32Å; G318-D331 WeakPolarHBondContact CA-OD2 3.32Å; D331-P426 WeakPolarHBondContact CA-O 3.24Å; D331-P426 WeakPolarHBondContact OD1-CB 3.09Å; D331-P426 VanDerWaalsContact OD1-CG 3.31Å; D331-P426 WeakPolarHBondContact OD1-CG 3.47Å
332	F	97.2	Very high	94.4	Very high	3 Å²	3	54.7 Å²	54.7	1%	0.013	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.9	173.7	-64	-69.6	0	0	0	112.7	I297 R298 V301 I314 V315 L316 V330 V425 P426 M427 S428	I297-F332 HydrophobicContact CG2-CE2 3.64Å; I297-F332 HydrophobicContact CG2-CZ 4.01Å; R298-F332 HydrophobicContact CB-CE1 3.74Å; R298-F332 HydrophobicContact CB-CZ 3.87Å; R298-F332 HydrophobicContact CG-CE1 3.8Å; R298-F332 HydrophobicContact CG-CZ 4.42Å; V301-F332 HydrophobicContact CG2-CD2 4.29Å; V301-F332 HydrophobicContact CG2-CE2 4.02Å; I314-F332 HydrophobicContact CD1-CB 4.26Å; I314-F332 HydrophobicContact CD1-CD1 3.68Å; I314-F332 HydrophobicContact CD1-CE1 4.19Å; I314-F332 HydrophobicContact CD1-CG 3.93Å; I314-F332 HydrophobicContact CG1-CB 4.24Å; I314-F332 HydrophobicContact CG1-CD1 3.81Å; I314-F332 HydrophobicContact CG1-CG 4.25Å; V315-F332 WeakPolarHBondContact O-CA 2.81Å; L316-F332 HydrophobicContact CB-CD1 4.46Å; L316-F332 HydrophobicContact CB-CE1 4.17Å; L316-F332 HydrophobicContact CD1-CD1 4.29Å; L316-F332 HydrophobicContact CD1-CE1 3.74Å; L316-F332 HydrophobicContact CD1-CZ 4.19Å; V330-F332 HydrophobicContact CB-CE2 4.26Å; V330-F332 HydrophobicContact CG1-CD2 4.39Å; V330-F332 HydrophobicContact CG1-CE1 4.16Å; V330-F332 HydrophobicContact CG1-CE2 3.51Å; V330-F332 HydrophobicContact CG1-CZ 3.37Å; F332-V425 HydrophobicContact CD2-CG1 3.67Å; F332-V425 HydrophobicContact CE2-CG1 3.66Å; F332-P426 PolarHBondContact N-O 2.86Å; F332-M427 HydrophobicContact CB-CG 4.29Å; F332-M427 HydrophobicContact CD2-CG 4.31Å; F332-M427 WeakPolarHBondContact O-CA 3.35Å; F332-S428 PolarHBondContact O-N 2.9Å
333	L	96	Very high	94.1	Very high	36 Å²	36	51.8 Å²	51.8	19%	0.188	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.3	162.9	-177.9	66.7	0	0	0	108.7	I314 V315 T317	I314-L333 WeakPolarHBondContact CA-O 3.24Å; V315-L333 PolarHBondContact N-O 3.34Å; V315-L333 PolarHBondContact O-N 3.16Å; T317-L333 HydrophobicContact CG2-CB 3.65Å
334	I	95.4	Very high	93.8	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137	178.6	-58	170	0	0	0	108	V305 Q313 I314 L345 L349 S428 V429 S430	V305-I334 HydrophobicContact CG1-CG2 4.49Å; V305-I334 HydrophobicContact CG2-CD1 3.95Å; V305-I334 HydrophobicContact CG2-CG1 4.37Å; V305-I334 HydrophobicContact CG2-CG2 4.37Å; Q313-I334 VanDerWaalsContact O-CA 3.3Å; Q313-I334 WeakPolarHBondContact O-CA 3.23Å; I314-I334 HydrophobicContact CG1-CG1 4.24Å; I334-L345 HydrophobicContact CG2-CD1 4.26Å; I334-L349 HydrophobicContact CD1-CD2 3.37Å; I334-S428 PolarHBondContact N-O 2.96Å; I334-V429 HydrophobicContact CB-CG2 4.08Å; I334-V429 HydrophobicContact CG2-CG2 4.38Å; I334-V429 CarbonylContact O-C 3.55Å; I334-V429 VanDerWaalsContact O-CA 3.26Å; I334-V429 WeakPolarHBondContact O-CA 3.24Å; I334-S430 PolarHBondContact O-N 2.85Å
335	T	94.3	Very high	93.7	Very high	3 Å²	3	47 Å²	47	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	169.3	180	-165.8	0	0	0	0	110.2	A312 Q313 S430 S435	A312-T335 CarbonylContact C-O 3.53Å; A312-T335 WeakPolarHBondContact CA-O 3.15Å; Q313-T335 HydrophobicContact CB-CG2 4Å; Q313-T335 PolarHBondContact N-O 2.91Å; Q313-T335 PolarHBondContact O-N 3.5Å; T335-S430 WeakPolarHBondContact CB-O 3.37Å; T335-S430 PolarHBondContact OG1-O 3.07Å; T335-S435 PolarHBondContact OG1-OG 3.06Å
336	H	93.6	Very high	93.6	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.046	24%	0.237	C	C	.	.			trans	-126.9	140.2	176.1	-165.9	-84.9	0	0	0	109.1	S309 E338 S341 E342 V432	S309-H336 PolarHBondContact OG-CD2 2.85Å; S309-H336 PolarHBondContact OG-NE2 3.48Å; H336-E338 VanDerWaalsContact C-N 3.32Å; H336-E338 WeakPolarHBondContact ND1-CB 3.43Å; H336-E338 PolarHBondContact ND1-N 3.41Å; H336-E338 VanDerWaalsContact ND1-N 3.11Å; H336-E338 PolarHBondContact ND1-O 2.92Å; H336-E338 VanDerWaalsContact ND1-O 3.1Å; H336-E338 PolarHBondContact O-N 3.3Å; H336-S341 VanDerWaalsContact CE1-CB 3.45Å; H336-S341 WeakPolarHBondContact CE1-CB 3.35Å; H336-S341 WeakPolarHBondContact ND1-CB 3.41Å; H336-E342 HydrophobicContact CB-CB 4.07Å; H336-V432 VanDerWaalsContact O-CB 3.24Å; H336-V432 WeakPolarHBondContact O-CB 3.19Å; H336-V432 WeakPolarHBondContact O-CG2 3.49Å
337	P	91.5	Very high	93.5	Very high	55 Å²	55	40.2 Å²	40.2	36%	0.357	23%	0.234	S	C	.	.	S	Bend	trans	-65.3	-33.5	-178.6	24.3	-34.7	0	0	0	113.5	E311	E311-P337 HydrophobicContact CB-CG 4.07Å; E311-P337 WeakPolarHBondContact O-CD 3.14Å
338	E	90.6	Very high	93.5	Very high	119 Å²	119	45.1 Å²	45.1	56%	0.556	25%	0.252	S	S	*	.	S	Bend	trans	-87.1	126.6	170.1	-173.6	-173.5	-156.2	0	0	110.1	H336 S341	H336-E338 VanDerWaalsContact C-N 3.32Å; H336-E338 WeakPolarHBondContact ND1-CB 3.43Å; H336-E338 PolarHBondContact ND1-N 3.41Å; H336-E338 VanDerWaalsContact ND1-N 3.11Å; H336-E338 PolarHBondContact ND1-O 2.92Å; H336-E338 VanDerWaalsContact ND1-O 3.1Å; H336-E338 PolarHBondContact O-N 3.3Å; E338-S341 WeakPolarHBondContact O-CB 3.38Å; E338-S341 PolarHBondContact O-N 2.85Å; E338-S341 PolarHBondContact OE2-OG 3.36Å
339	E	86.8	Confident	93.6	Very high	102 Å²	102	39 Å²	39	48%	0.477	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	140	178.8	-178.9	170.3	-146	0	0	112.1	S341 V432 H433	E339-S341 PolarHBondContact O-N 3.41Å; E339-V432 HydrophobicContact CB-CG1 4.36Å; E339-H433 IonicContact OE1-CD2 3.56Å; E339-H433 IonicContact OE2-CD2 3.68Å; E339-H433 IonicContact OE2-NE2 3.46Å; E339-H433 PolarHBondContact OE2-NE2 3.02Å
340	G	87.3	Confident	93.6	Very high	38 Å²	38	37.5 Å²	37.5	39%	0.392	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-24.4	-176.8	0	0	0	0	0	112.9	E342 V343	G340-E342 WeakPolarHBondContact CA-OE2 3.48Å; G340-E342 PolarHBondContact N-OE2 3.22Å; G340-E342 PolarHBondContact O-N 3.07Å; G340-V343 VanDerWaalsContact O-CB 3.32Å; G340-V343 WeakPolarHBondContact O-CB 3.41Å; G340-V343 WeakPolarHBondContact O-CG2 3.46Å; G340-V343 PolarHBondContact O-N 3.36Å; G340-V343 VanDerWaalsContact O-N 3.12Å
341	S	91.1	Very high	93.6	Very high	44 Å²	44	40.9 Å²	40.9	31%	0.308	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.9	175.7	-71.6	0	0	0	0	112.8	H336 E338 E339 V343	H336-S341 VanDerWaalsContact CE1-CB 3.45Å; H336-S341 WeakPolarHBondContact CE1-CB 3.35Å; H336-S341 WeakPolarHBondContact ND1-CB 3.41Å; E338-S341 WeakPolarHBondContact O-CB 3.38Å; E338-S341 PolarHBondContact O-N 2.85Å; E338-S341 PolarHBondContact OE2-OG 3.36Å; E339-S341 PolarHBondContact O-N 3.41Å; S341-V343 VanDerWaalsContact C-N 3.31Å
342	E	90.9	Very high	93.6	Very high	11 Å²	11	41 Å²	41	5%	0.051	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.6	168.4	80.1	-66.9	154.5	0	0	113.7	H336 G340 G344 L345 V429 T431	H336-E342 HydrophobicContact CB-CB 4.07Å; G340-E342 WeakPolarHBondContact CA-OE2 3.48Å; G340-E342 PolarHBondContact N-OE2 3.22Å; G340-E342 PolarHBondContact O-N 3.07Å; E342-G344 PolarHBondContact O-N 3.44Å; E342-L345 HydrophobicContact CB-CD1 4.11Å; E342-L345 WeakPolarHBondContact O-CB 3.44Å; E342-L345 VanDerWaalsContact O-CG 3.3Å; E342-L345 WeakPolarHBondContact O-CG 3.48Å; E342-L345 PolarHBondContact O-N 3.35Å; E342-L345 VanDerWaalsContact O-N 3.15Å; E342-V429 HydrophobicContact CB-CG1 3.72Å; E342-V429 HydrophobicContact CG-CG1 3.93Å; E342-T431 WeakPolarHBondContact OE1-CG2 3.46Å
343	V	89.9	Confident	93.6	Very high	104 Å²	104	40.8 Å²	40.8	63%	0.63	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	124.8	-176.5	178.8	0	0	0	0	110.5	G340 S341 L345	G340-V343 VanDerWaalsContact O-CB 3.32Å; G340-V343 WeakPolarHBondContact O-CB 3.41Å; G340-V343 WeakPolarHBondContact O-CG2 3.46Å; G340-V343 PolarHBondContact O-N 3.36Å; G340-V343 VanDerWaalsContact O-N 3.12Å; S341-V343 VanDerWaalsContact C-N 3.31Å; V343-L345 VanDerWaalsContact C-N 3.3Å; V343-L345 PolarHBondContact O-N 2.93Å
344	G	90.4	Very high	93.6	Very high	25 Å²	25	43.1 Å²	43.1	26%	0.258	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	10.4	179.6	0	0	0	0	0	114.2	E342 P347 K348	E342-G344 PolarHBondContact O-N 3.44Å; G344-P347 WeakPolarHBondContact O-CD 3.44Å; G344-K348 WeakPolarHBondContact O-CG 3.49Å
345	L	94	Very high	93.7	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-43.1	169.5	-73.7	-177.5	0	0	0	111.9	V308 A312 I334 E342 V343 K348 L349 V429	V308-L345 HydrophobicContact CG2-CD2 4.36Å; A312-L345 HydrophobicContact CB-CD1 4.1Å; I334-L345 HydrophobicContact CG2-CD1 4.26Å; E342-L345 HydrophobicContact CB-CD1 4.11Å; E342-L345 WeakPolarHBondContact O-CB 3.44Å; E342-L345 VanDerWaalsContact O-CG 3.3Å; E342-L345 WeakPolarHBondContact O-CG 3.48Å; E342-L345 PolarHBondContact O-N 3.35Å; E342-L345 VanDerWaalsContact O-N 3.15Å; V343-L345 VanDerWaalsContact C-N 3.3Å; V343-L345 PolarHBondContact O-N 2.93Å; L345-K348 PolarHBondContact O-N 2.94Å; L345-L349 WeakPolarHBondContact O-CB 3.47Å; L345-L349 PolarHBondContact O-N 3.28Å; L345-V429 HydrophobicContact CB-CG2 4.45Å
346	M	95.8	Very high	93.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-47.1	-175.1	-170	64.3	77.4	0	0	113.1	K348 L349 V350 T364 E387 C389 M427 V429	M346-K348 VanDerWaalsContact C-N 3.33Å; M346-K348 PolarHBondContact O-N 3.08Å; M346-L349 PolarHBondContact O-N 3.2Å; M346-L349 HydrophobicContact SD-CD2 4.2Å; M346-V350 HydrophobicContact CG-CG2 4.18Å; M346-V350 WeakPolarHBondContact O-CB 3.27Å; M346-V350 VanDerWaalsContact O-CG2 3.3Å; M346-V350 WeakPolarHBondContact O-CG2 3.38Å; M346-V350 PolarHBondContact O-N 3.28Å; M346-V350 HydrophobicContact SD-CG2 4.17Å; M346-T364 HydrophobicContact CG-CG2 3.89Å; M346-E387 HydrophobicContact CB-CG 3.7Å; M346-E387 VanDerWaalsContact CB-OE2 3.3Å; M346-E387 WeakPolarHBondContact CB-OE2 3.23Å; M346-E387 HydrophobicContact CG-CG 4.2Å; M346-C389 HydrophobicContact CE-CB 3.84Å; M346-C389 HydrophobicContact CG-CB 3.84Å; M346-C389 HydrophobicContact SD-CB 3.39Å; M346-C389 WeakPolarHBondContact SD-CB 3.42Å; M346-M427 HydrophobicContact CE-CB 3.68Å; M346-M427 WeakPolarHBondContact CE-O 3.29Å; M346-M427 HydrophobicContact SD-CB 4.24Å; M346-M427 HydrophobicContact SD-CE 4.35Å; M346-V429 HydrophobicContact CB-CG2 4.19Å; M346-V429 HydrophobicContact CE-CG2 3.72Å
347	P	95.6	Very high	93.9	Very high	69 Å²	69	55 Å²	55	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-39.8	176.6	-25.2	36.1	0	0	0	113.3	G344 S351	G344-P347 WeakPolarHBondContact O-CD 3.44Å; P347-S351 VanDerWaalsContact O-CB 3.32Å; P347-S351 WeakPolarHBondContact O-CB 3.37Å; P347-S351 PolarHBondContact O-N 3.45Å
348	K	96.3	Very high	94.2	Very high	115 Å²	115	53.4 Å²	53.4	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-63.9	-44.8	176.4	-66.9	173.3	-177.7	173.7	0	111.1	V308 G344 L345 M346 S351 W352	V308-K348 HydrophobicContact CB-CB 3.93Å; V308-K348 HydrophobicContact CG1-CB 3.84Å; G344-K348 WeakPolarHBondContact O-CG 3.49Å; L345-K348 PolarHBondContact O-N 2.94Å; M346-K348 VanDerWaalsContact C-N 3.33Å; M346-K348 PolarHBondContact O-N 3.08Å; K348-S351 PolarHBondContact O-N 3.04Å; K348-W352 WeakPolarHBondContact O-CB 3.36Å; K348-W352 PolarHBondContact O-N 2.93Å
349	L	96.9	Very high	94.5	Very high	2 Å²	2	49 Å²	49	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-49.7	177.8	176.4	62.1	0	0	0	111.7	V301 A304 V305 I334 L345 M346 S351 W352 L353 M427	V301-L349 HydrophobicContact CG1-CD1 4.39Å; V301-L349 HydrophobicContact CG1-CD2 4.38Å; A304-L349 HydrophobicContact CB-CD1 3.31Å; V305-L349 HydrophobicContact CG2-CD1 4.16Å; V305-L349 HydrophobicContact CG2-CD2 4.38Å; I334-L349 HydrophobicContact CD1-CD2 3.37Å; L345-L349 WeakPolarHBondContact O-CB 3.47Å; L345-L349 PolarHBondContact O-N 3.28Å; M346-L349 PolarHBondContact O-N 3.2Å; M346-L349 HydrophobicContact SD-CD2 4.2Å; L349-S351 VanDerWaalsContact C-N 3.34Å; L349-S351 PolarHBondContact O-N 3.48Å; L349-W352 WeakPolarHBondContact O-CB 3.45Å; L349-W352 PolarHBondContact O-N 2.99Å; L349-L353 HydrophobicContact CD1-CD1 4.05Å; L349-L353 HydrophobicContact CD1-CG 4.36Å; L349-L353 HydrophobicContact CG-CD1 3.98Å; L349-L353 WeakPolarHBondContact O-CG 3.3Å; L349-L353 PolarHBondContact O-N 3.2Å; L349-M427 HydrophobicContact CD2-CE 4.46Å; L349-M427 HydrophobicContact CD2-SD 3.79Å
350	V	96.9	Very high	95	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-46.1	177.9	170.4	0	0	0	0	110.2	M346 W352 L353 E354 L359 Q362 C389	M346-V350 HydrophobicContact CG-CG2 4.18Å; M346-V350 WeakPolarHBondContact O-CB 3.27Å; M346-V350 VanDerWaalsContact O-CG2 3.3Å; M346-V350 WeakPolarHBondContact O-CG2 3.38Å; M346-V350 PolarHBondContact O-N 3.28Å; M346-V350 HydrophobicContact SD-CG2 4.17Å; V350-W352 VanDerWaalsContact C-N 3.34Å; V350-W352 PolarHBondContact O-N 3.02Å; V350-L353 PolarHBondContact O-N 3.26Å; V350-E354 HydrophobicContact CG1-CG 4.12Å; V350-E354 WeakPolarHBondContact O-CB 3.46Å; V350-E354 WeakPolarHBondContact O-CG 3.47Å; V350-E354 PolarHBondContact O-N 2.93Å; V350-L359 HydrophobicContact CG1-CD1 4.09Å; V350-Q362 HydrophobicContact CG1-CG 3.85Å; V350-C389 HydrophobicContact CG2-CB 4.36Å
351	S	97.5	Very high	95.5	Very high	71 Å²	71	45.2 Å²	45.2	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-59.6	-42.3	176.6	-177.2	0	0	0	0	112.4	P347 K348 L349 L353 E354 S355	P347-S351 VanDerWaalsContact O-CB 3.32Å; P347-S351 WeakPolarHBondContact O-CB 3.37Å; P347-S351 PolarHBondContact O-N 3.45Å; K348-S351 PolarHBondContact O-N 3.04Å; L349-S351 VanDerWaalsContact C-N 3.34Å; L349-S351 PolarHBondContact O-N 3.48Å; S351-L353 VanDerWaalsContact C-N 3.35Å; S351-L353 PolarHBondContact O-N 2.84Å; S351-E354 PolarHBondContact O-N 3.32Å; S351-S355 WeakPolarHBondContact O-CB 3.44Å; S351-S355 PolarHBondContact O-N 3.04Å; S351-S355 PolarHBondContact O-OG 3.39Å
352	W	97.4	Very high	95.8	Very high	39 Å²	39	44.9 Å²	44.9	15%	0.148	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-42.7	176.2	-172.2	105.7	0	0	0	112	R303 A304 S307 V308 K348 L349 V350 S355 R356 L358	R303-W352 HydrophobicContact CB-CH2 4.4Å; A304-W352 HydrophobicContact CB-CD2 3.67Å; A304-W352 HydrophobicContact CB-CE3 3.24Å; A304-W352 HydrophobicContact CB-CG 4.34Å; A304-W352 HydrophobicContact CB-CH2 4.1Å; A304-W352 HydrophobicContact CB-CZ2 4.43Å; A304-W352 HydrophobicContact CB-CZ3 3.5Å; A304-W352 VanDerWaalsContact CB-CZ3 3.5Å; S307-W352 VanDerWaalsContact CB-NE1 3.3Å; S307-W352 PolarHBondContact OG-NE1 2.92Å; V308-W352 HydrophobicContact CG1-CB 4.33Å; K348-W352 WeakPolarHBondContact O-CB 3.36Å; K348-W352 PolarHBondContact O-N 2.93Å; L349-W352 WeakPolarHBondContact O-CB 3.45Å; L349-W352 PolarHBondContact O-N 2.99Å; V350-W352 VanDerWaalsContact C-N 3.34Å; V350-W352 PolarHBondContact O-N 3.02Å; W352-S355 PolarHBondContact O-OG 3.2Å; W352-R356 VanDerWaalsContact CE2-NH1 3.31Å; W352-R356 VanDerWaalsContact CZ2-CZ 3.45Å; W352-R356 VanDerWaalsContact CZ2-NE 3.3Å; W352-R356 PolarHBondContact O-NH1 2.94Å; W352-L358 HydrophobicContact CZ3-CD1 4.02Å
353	L	97.4	Very high	96	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71.3	-41.1	179.5	-66.8	165	0	0	0	112	I300 A304 L349 V350 S351 R356 G357 L358 L359 F393 M427	I300-L353 HydrophobicContact CG2-CD2 4.28Å; A304-L353 HydrophobicContact CB-CD2 4.11Å; A304-L353 HydrophobicContact CB-CG 4.36Å; L349-L353 HydrophobicContact CD1-CD1 4.05Å; L349-L353 HydrophobicContact CD1-CG 4.36Å; L349-L353 HydrophobicContact CG-CD1 3.98Å; L349-L353 WeakPolarHBondContact O-CG 3.3Å; L349-L353 PolarHBondContact O-N 3.2Å; V350-L353 PolarHBondContact O-N 3.26Å; S351-L353 VanDerWaalsContact C-N 3.35Å; S351-L353 PolarHBondContact O-N 2.84Å; L353-R356 PolarHBondContact O-N 2.92Å; L353-G357 PolarHBondContact O-N 3.47Å; L353-L358 HydrophobicContact CD2-CB 4.43Å; L353-L358 HydrophobicContact CD2-CD1 3.86Å; L353-L358 PolarHBondContact O-N 2.61Å; L353-L358 VanDerWaalsContact O-N 3.11Å; L353-L359 HydrophobicContact CB-CD1 3.9Å; L353-L359 HydrophobicContact CB-CD2 4.18Å; L353-L359 HydrophobicContact CB-CG 3.79Å; L353-L359 HydrophobicContact CD1-CD1 4.44Å; L353-L359 HydrophobicContact CD1-CD2 4.29Å; L353-F393 HydrophobicContact CD1-CE1 4.47Å; L353-F393 HydrophobicContact CD1-CE2 4.41Å; L353-F393 HydrophobicContact CD1-CZ 3.72Å; L353-F393 HydrophobicContact CD2-CE1 4.04Å; L353-F393 HydrophobicContact CD2-CZ 4.11Å; L353-M427 HydrophobicContact CD1-CE 4.15Å; L353-M427 HydrophobicContact CD1-SD 4.48Å
354	E	96.6	Very high	96.2	Very high	85 Å²	85	47.3 Å²	47.3	40%	0.397	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-44.8	176.4	-74.3	179.4	156.8	0	0	111.4	V350 S351 R356 G357 L359 Q362	V350-E354 HydrophobicContact CG1-CG 4.12Å; V350-E354 WeakPolarHBondContact O-CB 3.46Å; V350-E354 WeakPolarHBondContact O-CG 3.47Å; V350-E354 PolarHBondContact O-N 2.93Å; S351-E354 PolarHBondContact O-N 3.32Å; E354-R356 PolarHBondContact O-N 3.04Å; E354-G357 PolarHBondContact O-N 2.91Å; E354-L359 HydrophobicContact CG-CB 4.38Å; E354-L359 HydrophobicContact CG-CD1 3.91Å; E354-L359 HydrophobicContact CG-CG 4.46Å; E354-Q362 VanDerWaalsContact OE1-CG 3.28Å; E354-Q362 WeakPolarHBondContact OE1-CG 3.41Å; E354-Q362 PolarHBondContact OE1-NE2 3.29Å
355	S	97.1	Very high	96.3	Very high	88 Å²	88	48.4 Å²	48.4	62%	0.615	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.2	178.7	70.3	0	0	0	0	114.1	S351 W352	S351-S355 WeakPolarHBondContact O-CB 3.44Å; S351-S355 PolarHBondContact O-N 3.04Å; S351-S355 PolarHBondContact O-OG 3.39Å; W352-S355 PolarHBondContact O-OG 3.2Å
356	R	96.2	Very high	96.1	Very high	134 Å²	134	58.3 Å²	58.3	51%	0.506	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	4.4	178.3	-72.1	169.4	175.9	72.3	-0	113.3	W352 L353 E354 L358	W352-R356 VanDerWaalsContact CE2-NH1 3.31Å; W352-R356 VanDerWaalsContact CZ2-CZ 3.45Å; W352-R356 VanDerWaalsContact CZ2-NE 3.3Å; W352-R356 PolarHBondContact O-NH1 2.94Å; L353-R356 PolarHBondContact O-N 2.92Å; E354-R356 PolarHBondContact O-N 3.04Å; R356-L358 VanDerWaalsContact C-N 3.27Å; R356-L358 HydrophobicContact CB-CD1 3.94Å; R356-L358 HydrophobicContact CB-CG 3.99Å; R356-L358 PolarHBondContact O-N 2.97Å
357	G	96.1	Very high	95.6	Very high	43 Å²	43	61.5 Å²	61.5	44%	0.443	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	28.1	-179.8	0	0	0	0	0	113.8	L353 E354	L353-G357 PolarHBondContact O-N 3.47Å; E354-G357 PolarHBondContact O-N 2.91Å
358	L	96.8	Very high	95	Very high	22 Å²	22	61 Å²	61	12%	0.115	31%	0.312	C	S	.	.			trans	-88.2	-15.5	-177.8	-65.6	169.4	0	0	0	113.2	I300 W352 L353 R356 F393 K394	I300-L358 HydrophobicContact CG2-CD1 3.74Å; W352-L358 HydrophobicContact CZ3-CD1 4.02Å; L353-L358 HydrophobicContact CD2-CB 4.43Å; L353-L358 HydrophobicContact CD2-CD1 3.86Å; L353-L358 PolarHBondContact O-N 2.61Å; L353-L358 VanDerWaalsContact O-N 3.11Å; R356-L358 VanDerWaalsContact C-N 3.27Å; R356-L358 HydrophobicContact CB-CD1 3.94Å; R356-L358 HydrophobicContact CB-CG 3.99Å; R356-L358 PolarHBondContact O-N 2.97Å; L358-F393 CarbonylContact O-C 3.54Å; L358-F393 WeakPolarHBondContact O-CA 3.28Å; L358-K394 PolarHBondContact O-N 3.45Å
359	L	97.3	Very high	94.2	Very high	25 Å²	25	59.4 Å²	59.4	13%	0.131	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.5	179.6	-57.4	-173.3	0	0	0	111.1	V350 L353 E354 Q362 F393	V350-L359 HydrophobicContact CG1-CD1 4.09Å; L353-L359 HydrophobicContact CB-CD1 3.9Å; L353-L359 HydrophobicContact CB-CD2 4.18Å; L353-L359 HydrophobicContact CB-CG 3.79Å; L353-L359 HydrophobicContact CD1-CD1 4.44Å; L353-L359 HydrophobicContact CD1-CD2 4.29Å; E354-L359 HydrophobicContact CG-CB 4.38Å; E354-L359 HydrophobicContact CG-CD1 3.91Å; E354-L359 HydrophobicContact CG-CG 4.46Å; L359-Q362 HydrophobicContact CD1-CB 4.05Å; L359-Q362 HydrophobicContact CD1-CG 4.17Å; L359-F393 HydrophobicContact CD2-CD2 3.46Å; L359-F393 VanDerWaalsContact CD2-CD2 3.46Å; L359-F393 HydrophobicContact CD2-CE1 4.44Å; L359-F393 HydrophobicContact CD2-CE2 3.33Å; L359-F393 HydrophobicContact CD2-CG 4.12Å; L359-F393 HydrophobicContact CD2-CZ 3.87Å
360	L	97.3	Very high	93	Very high	50 Å²	50	65.8 Å²	65.8	26%	0.262	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-31.4	171.1	-56.3	169.7	0	0	0	110.6	I392 K394 W420 A422	L360-I392 HydrophobicContact CB-CB 4.34Å; L360-I392 HydrophobicContact CB-CG2 4.22Å; L360-I392 HydrophobicContact CD1-CG2 4.04Å; L360-I392 PolarHBondContact N-O 3.13Å; L360-K394 HydrophobicContact CD1-CB 4.25Å; L360-K394 HydrophobicContact CD2-CB 4.06Å; L360-K394 HydrophobicContact CD2-CD 4.39Å; L360-K394 HydrophobicContact CD2-CG 4.43Å; L360-K394 HydrophobicContact CG-CB 4.03Å; L360-W420 HydrophobicContact CD1-CE3 4.37Å; L360-W420 HydrophobicContact CD1-CH2 3.89Å; L360-W420 HydrophobicContact CD1-CZ3 3.38Å; L360-W420 HydrophobicContact CD2-CH2 3.92Å; L360-W420 HydrophobicContact CD2-CZ3 4.11Å; L360-W420 HydrophobicContact CG-CZ3 4.37Å; L360-A422 HydrophobicContact CD1-CB 3.73Å
361	Y	97.9	Very high	91.6	Very high	12 Å²	12	72.4 Å²	72.4	5%	0.047	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	145.1	175.6	173.6	-89.3	0	0	0	109.6	F243 R273 A274 A277 K363 S391 I392	F243-Y361 AromaticContact CE1-CD1 3.59Å; F243-Y361 HydrophobicContact CE1-CD1 3.59Å; F243-Y361 AromaticContact CE1-CE1 3.36Å; F243-Y361 HydrophobicContact CE1-CE1 3.36Å; F243-Y361 HydrophobicContact CE1-CE2 4.39Å; F243-Y361 HydrophobicContact CE1-CG 4.23Å; F243-Y361 AromaticContact CE1-CZ 3.78Å; F243-Y361 AromaticContact CZ-CD1 3.99Å; F243-Y361 HydrophobicContact CZ-CD1 3.99Å; F243-Y361 AromaticContact CZ-CE1 3.57Å; F243-Y361 HydrophobicContact CZ-CE1 3.57Å; R273-Y361 HydrophobicContact CB-CE2 4.38Å; R273-Y361 HydrophobicContact CG-CD2 4.1Å; R273-Y361 HydrophobicContact CG-CE2 3.98Å; A274-Y361 VanDerWaalsContact CA-CE2 3.49Å; A274-Y361 HydrophobicContact CB-CE2 3.93Å; A274-Y361 WeakPolarHBondContact CB-OH 3.49Å; A277-Y361 HydrophobicContact CB-CD2 3.93Å; A277-Y361 HydrophobicContact CB-CG 4.17Å; Y361-K363 HydrophobicContact CE1-CB 3.91Å; Y361-K363 VanDerWaalsContact OH-CB 3.31Å; Y361-K363 WeakPolarHBondContact OH-CB 3.29Å; Y361-S391 CarbonylContact O-C 3.33Å; Y361-S391 WeakPolarHBondContact O-CA 3.37Å; Y361-S391 WeakPolarHBondContact O-CB 3.38Å; Y361-I392 HydrophobicContact CD1-CD1 4.45Å; Y361-I392 HydrophobicContact CD1-CG1 4.33Å; Y361-I392 HydrophobicContact CG-CD1 4.26Å; Y361-I392 HydrophobicContact CG-CG1 4.47Å; Y361-I392 PolarHBondContact N-O 3.02Å; Y361-I392 PolarHBondContact O-N 3.37Å
362	Q	96.7	Very high	89.8	Confident	37 Å²	37	72.2 Å²	72.2	17%	0.173	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147.8	164.3	64.4	86.1	2.7	0	0	111.3	V350 E354 L359 T364 L390	V350-Q362 HydrophobicContact CG1-CG 3.85Å; E354-Q362 VanDerWaalsContact OE1-CG 3.28Å; E354-Q362 WeakPolarHBondContact OE1-CG 3.41Å; E354-Q362 PolarHBondContact OE1-NE2 3.29Å; L359-Q362 HydrophobicContact CD1-CB 4.05Å; L359-Q362 HydrophobicContact CD1-CG 4.17Å; Q362-T364 PolarHBondContact OE1-OG1 2.78Å; Q362-L390 CarbonylContact C-O 3.48Å; Q362-L390 VanDerWaalsContact CA-O 3.3Å; Q362-L390 WeakPolarHBondContact CA-O 3.42Å
363	K	96.1	Very high	88.1	Confident	118 Å²	118	76.5 Å²	76.5	51%	0.513	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	109.7	168.2	178.6	178.9	179.6	-179.6	0	109.3	Y361 C389 L390	Y361-K363 HydrophobicContact CE1-CB 3.91Å; Y361-K363 VanDerWaalsContact OH-CB 3.31Å; Y361-K363 WeakPolarHBondContact OH-CB 3.29Å; K363-C389 WeakPolarHBondContact O-CA 3.35Å; K363-L390 PolarHBondContact N-O 3.47Å; K363-L390 PolarHBondContact O-N 3.45Å
364	T	94.2	Very high	86.4	Confident	48 Å²	48	85.2 Å²	85.2	29%	0.294	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	130	176	-54.8	0	0	0	0	110.7	M346 Q362 E387 R388	M346-T364 HydrophobicContact CG-CG2 3.89Å; Q362-T364 PolarHBondContact OE1-OG1 2.78Å; T364-E387 HydrophobicContact CG2-CG 4.43Å; T364-R388 CarbonylContact C-O 3.59Å; T364-R388 WeakPolarHBondContact CA-O 3.33Å
365	T	92.2	Very high	84.6	Confident	48 Å²	48	82.6 Å²	82.6	29%	0.294	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.5	170.6	-52.7	0	0	0	0	107.3	E387 R388	T365-E387 WeakPolarHBondContact O-CA 3.44Å; T365-R388 PolarHBondContact N-O 3.28Å; T365-R388 PolarHBondContact O-N 2.96Å
366	R	89.1	Confident	82.6	Confident	214 Å²	214	83.2 Å²	83.2	81%	0.808	44%	0.439	S	S	*	.			trans	-67.1	153.3	-178.5	-65.4	-176.7	-178.9	-177.4	-0.4	111.3	S368	R366-S368 PolarHBondContact O-N 3.21Å
367	N	86	Confident	80.6	Confident	67 Å²	67	80.8 Å²	80.8	36%	0.358	46%	0.456	S	S	.	.			trans	-59.4	130.2	169.9	-165.2	-12.5	0	0	0	109.7	Y369 R385 E387	N367-Y369 WeakPolarHBondContact OD1-CB 3.32Å; N367-Y369 PolarHBondContact OD1-N 3.43Å; N367-R385 PolarHBondContact OD1-O 2.9Å; N367-E387 HydrophobicContact CB-CB 3.99Å
368	S	83.7	Confident	78.8	Confident	58 Å²	58	89.2 Å²	89.2	41%	0.406	48%	0.475	S	S	.	.			trans	-123.6	1.3	172.2	68.2	0	0	0	0	112	R366 L370 R385	R366-S368 PolarHBondContact O-N 3.21Å; S368-L370 PolarHBondContact O-N 3.33Å; S368-R385 PolarHBondContact N-O 2.66Å; S368-R385 PolarHBondContact O-NE 3.1Å; S368-R385 VanDerWaalsContact O-NE 3.1Å; S368-R385 PolarHBondContact O-NH2 3.14Å; S368-R385 WeakPolarHBondContact OG-CB 3.48Å; S368-R385 PolarHBondContact OG-NE 3.13Å; S368-R385 PolarHBondContact OG-O 3.01Å
369	Y	78.9	Confident	76.9	Confident	82 Å²	82	93.9 Å²	93.9	32%	0.322	51%	0.506	S	S	.	.			trans	-63.2	130.3	177.8	-178.6	-98.2	0	0	0	109.4	N367 E371 R385 F386 I434	N367-Y369 WeakPolarHBondContact OD1-CB 3.32Å; N367-Y369 PolarHBondContact OD1-N 3.43Å; Y369-E371 HydrophobicContact CE1-CB 4Å; Y369-R385 HydrophobicContact CD2-CB 4.5Å; Y369-R385 PolarHBondContact N-O 2.71Å; Y369-F386 HydrophobicContact CD1-CE1 4.04Å; Y369-F386 HydrophobicContact CD2-CE1 4.25Å; Y369-F386 HydrophobicContact CD2-CZ 4.24Å; Y369-F386 HydrophobicContact CE2-CZ 4.47Å; Y369-F386 HydrophobicContact CG-CD1 4.49Å; Y369-F386 AromaticContact CG-CE1 3.88Å; Y369-F386 HydrophobicContact CG-CE1 3.88Å; Y369-F386 HydrophobicContact CG-CZ 4.34Å; Y369-I434 HydrophobicContact CE1-CD1 4.33Å
370	L	71.6	Confident	75	Confident	135 Å²	135	94.9 Å²	94.9	71%	0.707	51%	0.514	S	S	*	.			trans	-124	121.2	171.2	-65.4	173.5	0	0	0	105.3	S368 C372	S368-L370 PolarHBondContact O-N 3.33Å; L370-C372 PolarHBondContact O-N 3.32Å
371	E	67	Low	73.3	Confident	144 Å²	144	98.5 Å²	98.5	67%	0.673	54%	0.544	S	S	*	.			trans	-66	127.9	175.2	-165.4	165.6	-153.7	0	0	108.8	Y369	Y369-E371 HydrophobicContact CE1-CB 4Å
372	C	60.8	Low	71.7	Confident	68 Å²	68	102.6 Å²	102.6	46%	0.459	57%	0.567	S	S	.	*			trans	-130.4	120.2	-179.3	-179.2	0	0	0	0	107.9	L370 E374 G375	L370-C372 PolarHBondContact O-N 3.32Å; C372-E374 PolarHBondContact O-N 3.47Å; C372-G375 PolarHBondContact O-N 2.97Å; C372-G375 PolarHBondContact SG-O 2.89Å; C372-G375 VanDerWaalsContact SG-O 3.35Å
373	S	60.2	Low	70.3	Confident	129 Å²	129	108.9 Å²	108.9	90%	0.902	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-25.7	179.1	51.4	0	0	0	0	113.2	G375	S373-G375 VanDerWaalsContact C-N 3.31Å
374	E	62.5	Low	69.3	Low	183 Å²	183	106.4 Å²	106.4	86%	0.855	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	4.3	177.1	-58.8	-164.1	157.5	0	0	113.3	C372	C372-E374 PolarHBondContact O-N 3.47Å
375	G	58.1	Low	68.8	Low	29 Å²	29	108.2 Å²	108.2	30%	0.299	59%	0.593	S	S	.	*			trans	69.1	178.2	-171	0	0	0	0	0	112.6	C372 S373 G377	C372-G375 PolarHBondContact O-N 2.97Å; C372-G375 PolarHBondContact SG-O 2.89Å; C372-G375 VanDerWaalsContact SG-O 3.35Å; S373-G375 VanDerWaalsContact C-N 3.31Å; G375-G377 PolarHBondContact O-N 2.83Å; G375-G377 VanDerWaalsContact O-N 3.13Å
376	P	56.8	Low	68.6	Low	101 Å²	101	107.5 Å²	107.5	66%	0.656	59%	0.586	S	S	*	*			trans	-72.3	107	177.3	27.4	-31.2	0	0	0	110.4	R378	P376-R378 PolarHBondContact O-N 3.09Å
377	G	54.3	Low	68.8	Low	84 Å²	84	98.3 Å²	98.3	87%	0.866	55%	0.552	S	S	*	*	S	Bend	trans	-58.8	-16.2	177.5	0	0	0	0	0	115.2	G375	G375-G377 PolarHBondContact O-N 2.83Å; G375-G377 VanDerWaalsContact O-N 3.13Å
378	R	56.6	Low	69.1	Low	220 Å²	220	98.4 Å²	98.4	83%	0.83	55%	0.548	S	S	*	.	S	Bend	trans	-141.2	141.1	160.3	-91.5	-175.3	176.7	-173.7	-0.7	109.5	P376 P380	P376-R378 PolarHBondContact O-N 3.09Å; R378-P380 WeakPolarHBondContact O-CD 3.28Å
379	P	57.7	Low	69.7	Low	119 Å²	119	95.7 Å²	95.7	77%	0.773	53%	0.529	S	S	*	.			trans	-60	124.1	170.7	16.5	-20.2	0	0	0	109
380	P	57.7	Low	70.6	Confident	47 Å²	47	94.3 Å²	94.3	31%	0.305	53%	0.527	S	S	.	.			trans	-61.8	154.3	176.7	25.9	-34.3	0	0	0	110.7	R378 N382 R385	R378-P380 WeakPolarHBondContact O-CD 3.28Å; P380-N382 WeakPolarHBondContact CB-O 3.45Å; P380-N382 WeakPolarHBondContact CG-O 3.47Å; P380-N382 PolarHBondContact O-N 2.9Å; P380-R385 HydrophobicContact CG-CG 4.44Å
381	S	61.5	Low	71.8	Confident	126 Å²	126	88 Å²	88	88%	0.881	49%	0.494	S	S	*	.	S	Bend	trans	-62	-22.9	174.6	54.1	0	0	0	0	113
382	N	63.7	Low	73.3	Confident	98 Å²	98	81.2 Å²	81.2	52%	0.524	46%	0.462	S	S	.	.	S	Bend	trans	-113.6	120.8	168.8	-70.9	-38.5	0	0	0	109.5	P380	P380-N382 WeakPolarHBondContact CB-O 3.45Å; P380-N382 WeakPolarHBondContact CG-O 3.47Å; P380-N382 PolarHBondContact O-N 2.9Å
383	I	66.9	Low	75	Confident	169 Å²	169	78.1 Å²	78.1	87%	0.867	44%	0.441	S	S	*	.	S	Bend	trans	-65.5	-39.3	-178.3	-65.7	171.1	0	0	0	111.5
384	D	75.3	Confident	76.7	Confident	65 Å²	65	75.3 Å²	75.3	35%	0.348	41%	0.413	S	S	.	.			trans	-96.2	121.2	177.2	-173.1	-0.2	0	0	0	110.7	F386	D384-F386 WeakPolarHBondContact OD1-CB 3.44Å; D384-F386 VanDerWaalsContact OD1-CD2 3.26Å; D384-F386 WeakPolarHBondContact OD1-CD2 3.18Å; D384-F386 PolarHBondContact OD1-N 2.83Å
385	R	84.3	Confident	78.3	Confident	86 Å²	86	66.9 Å²	66.9	33%	0.325	37%	0.373	S	S	.	.			trans	-111.3	-1.3	-178.8	-66.9	-173.3	70.5	172.3	1.7	113.2	N367 S368 Y369 P380	N367-R385 PolarHBondContact OD1-O 2.9Å; S368-R385 PolarHBondContact N-O 2.66Å; S368-R385 PolarHBondContact O-NE 3.1Å; S368-R385 VanDerWaalsContact O-NE 3.1Å; S368-R385 PolarHBondContact O-NH2 3.14Å; S368-R385 WeakPolarHBondContact OG-CB 3.48Å; S368-R385 PolarHBondContact OG-NE 3.13Å; S368-R385 PolarHBondContact OG-O 3.01Å; Y369-R385 HydrophobicContact CD2-CB 4.5Å; Y369-R385 PolarHBondContact N-O 2.71Å; P380-R385 HydrophobicContact CG-CG 4.44Å
386	F	88.6	Confident	80	Confident	34 Å²	34	67.6 Å²	67.6	15%	0.149	37%	0.374	C	S	.	.	S	Bend	trans	-69	164.7	178.3	-66.4	-60.1	0	0	0	112.3	Y369 D384 R388 V429 I434	Y369-F386 HydrophobicContact CD1-CE1 4.04Å; Y369-F386 HydrophobicContact CD2-CE1 4.25Å; Y369-F386 HydrophobicContact CD2-CZ 4.24Å; Y369-F386 HydrophobicContact CE2-CZ 4.47Å; Y369-F386 HydrophobicContact CG-CD1 4.49Å; Y369-F386 AromaticContact CG-CE1 3.88Å; Y369-F386 HydrophobicContact CG-CE1 3.88Å; Y369-F386 HydrophobicContact CG-CZ 4.34Å; D384-F386 WeakPolarHBondContact OD1-CB 3.44Å; D384-F386 VanDerWaalsContact OD1-CD2 3.26Å; D384-F386 WeakPolarHBondContact OD1-CD2 3.18Å; D384-F386 PolarHBondContact OD1-N 2.83Å; F386-R388 PolarHBondContact O-N 3.46Å; F386-V429 WeakPolarHBondContact CB-O 3.34Å; F386-I434 HydrophobicContact CE1-CD1 3.81Å; F386-I434 HydrophobicContact CE2-CD1 4.44Å; F386-I434 HydrophobicContact CZ-CD1 3.35Å; F386-I434 HydrophobicContact CZ-CG2 4.43Å
387	E	91.9	Very high	80.9	Confident	20 Å²	20	65.9 Å²	65.9	9%	0.093	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	128.3	169	178.8	168.4	-128.6	0	0	109	M346 T364 T365 N367 S428 V429	M346-E387 HydrophobicContact CB-CG 3.7Å; M346-E387 VanDerWaalsContact CB-OE2 3.3Å; M346-E387 WeakPolarHBondContact CB-OE2 3.23Å; M346-E387 HydrophobicContact CG-CG 4.2Å; T364-E387 HydrophobicContact CG2-CG 4.43Å; T365-E387 WeakPolarHBondContact O-CA 3.44Å; N367-E387 HydrophobicContact CB-CB 3.99Å; E387-S428 CarbonylContact O-C 3.57Å; E387-S428 WeakPolarHBondContact O-CA 3.48Å; E387-V429 HydrophobicContact CB-CB 4.38Å; E387-V429 PolarHBondContact O-N 3.43Å
388	R	93.4	Very high	81.5	Confident	69 Å²	69	65.6 Å²	65.6	26%	0.26	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	144.6	-176.2	61.8	-179.2	-176.1	125	-1.3	112	T364 T365 F386 M427	T364-R388 CarbonylContact C-O 3.59Å; T364-R388 WeakPolarHBondContact CA-O 3.33Å; T365-R388 PolarHBondContact N-O 3.28Å; T365-R388 PolarHBondContact O-N 2.96Å; F386-R388 PolarHBondContact O-N 3.46Å; R388-M427 CarbonylContact C-O 3.52Å; R388-M427 VanDerWaalsContact CA-O 3.24Å; R388-M427 WeakPolarHBondContact CA-O 3.49Å
389	C	96.3	Very high	82	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.007	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	116.3	174.3	-173.5	0	0	0	0	109.3	M346 V350 K363 M427	M346-C389 HydrophobicContact CE-CB 3.84Å; M346-C389 HydrophobicContact CG-CB 3.84Å; M346-C389 HydrophobicContact SD-CB 3.39Å; M346-C389 WeakPolarHBondContact SD-CB 3.42Å; V350-C389 HydrophobicContact CG2-CB 4.36Å; K363-C389 WeakPolarHBondContact O-CA 3.35Å; C389-M427 HydrophobicContact CB-CE 4.18Å; C389-M427 PolarHBondContact N-O 3.14Å; C389-M427 PolarHBondContact O-N 3.06Å
390	L	96.4	Very high	82.1	Confident	54 Å²	54	55.5 Å²	55.5	28%	0.283	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.4	168	-60.7	-179.6	0	0	0	107.8	F243 Q362 K363 P426	F243-L390 HydrophobicContact CZ-CB 4.42Å; Q362-L390 CarbonylContact C-O 3.48Å; Q362-L390 VanDerWaalsContact CA-O 3.3Å; Q362-L390 WeakPolarHBondContact CA-O 3.42Å; K363-L390 PolarHBondContact N-O 3.47Å; K363-L390 PolarHBondContact O-N 3.45Å; L390-P426 HydrophobicContact CD2-CB 4.24Å
391	S	97.4	Very high	81.6	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	157.8	-174.8	77.7	0	0	0	0	113.6	Y361 F393 V425	Y361-S391 CarbonylContact O-C 3.33Å; Y361-S391 WeakPolarHBondContact O-CA 3.37Å; Y361-S391 WeakPolarHBondContact O-CB 3.38Å; S391-F393 VanDerWaalsContact OG-CD2 3.29Å; S391-F393 WeakPolarHBondContact OG-CD2 3.4Å; S391-F393 WeakPolarHBondContact OG-CE2 3.44Å; S391-V425 PolarHBondContact N-O 3.26Å; S391-V425 PolarHBondContact O-N 2.9Å; S391-V425 PolarHBondContact OG-O 3.07Å
392	I	98.2	Very high	80.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.7	169.1	-57.1	171.6	0	0	0	106.7	F243 A277 I285 L360 Y361 A422 V423 R424	F243-I392 HydrophobicContact CD1-CD1 3.86Å; F243-I392 HydrophobicContact CE1-CD1 4.21Å; F243-I392 HydrophobicContact CG-CD1 4.38Å; A277-I392 HydrophobicContact CB-CD1 3.95Å; I285-I392 HydrophobicContact CD1-CD1 3.83Å; I285-I392 HydrophobicContact CD1-CG1 4.38Å; I285-I392 HydrophobicContact CD1-CG2 4.46Å; L360-I392 HydrophobicContact CB-CB 4.34Å; L360-I392 HydrophobicContact CB-CG2 4.22Å; L360-I392 HydrophobicContact CD1-CG2 4.04Å; L360-I392 PolarHBondContact N-O 3.13Å; Y361-I392 HydrophobicContact CD1-CD1 4.45Å; Y361-I392 HydrophobicContact CD1-CG1 4.33Å; Y361-I392 HydrophobicContact CG-CD1 4.26Å; Y361-I392 HydrophobicContact CG-CG1 4.47Å; Y361-I392 PolarHBondContact N-O 3.02Å; Y361-I392 PolarHBondContact O-N 3.37Å; I392-A422 HydrophobicContact CG2-CB 3.7Å; I392-V423 CarbonylContact C-O 3.52Å; I392-V423 WeakPolarHBondContact CA-O 3.39Å; I392-R424 HydrophobicContact CG1-CG 4.49Å
393	F	97.3	Very high	79.2	Confident	3 Å²	3	54.7 Å²	54.7	1%	0.013	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	147.2	179.8	-89.7	-125.3	0	0	0	111.6	I297 V301 L353 L358 L359 S391 A422 V423 V425 M427	I297-F393 HydrophobicContact CG2-CD1 4.22Å; I297-F393 HydrophobicContact CG2-CE1 4.23Å; V301-F393 HydrophobicContact CG2-CE1 3.74Å; V301-F393 HydrophobicContact CG2-CZ 3.7Å; L353-F393 HydrophobicContact CD1-CE1 4.47Å; L353-F393 HydrophobicContact CD1-CE2 4.41Å; L353-F393 HydrophobicContact CD1-CZ 3.72Å; L353-F393 HydrophobicContact CD2-CE1 4.04Å; L353-F393 HydrophobicContact CD2-CZ 4.11Å; L358-F393 CarbonylContact O-C 3.54Å; L358-F393 WeakPolarHBondContact O-CA 3.28Å; L359-F393 HydrophobicContact CD2-CD2 3.46Å; L359-F393 VanDerWaalsContact CD2-CD2 3.46Å; L359-F393 HydrophobicContact CD2-CE1 4.44Å; L359-F393 HydrophobicContact CD2-CE2 3.33Å; L359-F393 HydrophobicContact CD2-CG 4.12Å; L359-F393 HydrophobicContact CD2-CZ 3.87Å; S391-F393 VanDerWaalsContact OG-CD2 3.29Å; S391-F393 WeakPolarHBondContact OG-CD2 3.4Å; S391-F393 WeakPolarHBondContact OG-CE2 3.44Å; F393-A422 CarbonylContact O-C 3.48Å; F393-A422 VanDerWaalsContact O-CA 3.27Å; F393-A422 WeakPolarHBondContact O-CA 3.47Å; F393-V423 PolarHBondContact N-O 2.81Å; F393-V423 PolarHBondContact O-N 3.35Å; F393-V425 HydrophobicContact CB-CG2 3.83Å; F393-V425 HydrophobicContact CD1-CG2 4.29Å; F393-V425 HydrophobicContact CD2-CB 3.43Å; F393-V425 VanDerWaalsContact CD2-CB 3.43Å; F393-V425 HydrophobicContact CD2-CG1 4.06Å; F393-V425 HydrophobicContact CD2-CG2 3.46Å; F393-V425 VanDerWaalsContact CD2-CG2 3.46Å; F393-V425 HydrophobicContact CE2-CB 3.59Å; F393-V425 HydrophobicContact CE2-CG1 3.74Å; F393-V425 HydrophobicContact CE2-CG2 4.03Å; F393-V425 HydrophobicContact CG-CB 4.11Å; F393-V425 HydrophobicContact CG-CG2 3.6Å; F393-V425 HydrophobicContact CZ-CB 4.39Å; F393-V425 HydrophobicContact CZ-CG1 4.12Å; F393-M427 HydrophobicContact CE2-CE 4.15Å; F393-M427 HydrophobicContact CZ-CE 4.42Å; F393-M427 HydrophobicContact CZ-SD 4.4Å
394	K	96.6	Very high	77.6	Confident	71 Å²	71	52.5 Å²	52.5	31%	0.309	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	95.4	166.7	-175.8	-178.6	-178.7	179.1	0	109.2	L358 L360 W420	L358-K394 PolarHBondContact O-N 3.45Å; L360-K394 HydrophobicContact CD1-CB 4.25Å; L360-K394 HydrophobicContact CD2-CB 4.06Å; L360-K394 HydrophobicContact CD2-CD 4.39Å; L360-K394 HydrophobicContact CD2-CG 4.43Å; L360-K394 HydrophobicContact CG-CB 4.03Å; K394-W420 HydrophobicContact CB-CE3 4.39Å; K394-W420 HydrophobicContact CD-CD2 4.19Å; K394-W420 HydrophobicContact CD-CE3 4.45Å; K394-W420 HydrophobicContact CD-CG 4.43Å; K394-W420 HydrophobicContact CG-CB 4.19Å; K394-W420 HydrophobicContact CG-CD2 3.66Å; K394-W420 HydrophobicContact CG-CE3 3.58Å; K394-W420 HydrophobicContact CG-CG 3.94Å; K394-W420 HydrophobicContact CG-CZ3 4.09Å
395	L	95.9	Very high	75.6	Confident	6 Å²	6	59 Å²	59	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.6	179.3	-178.5	63.1	0	0	0	110.5	E293 A296 I297 I300 Q399 T400 W420 R421 V423	E293-L395 HydrophobicContact CB-CD2 3.78Å; E293-L395 HydrophobicContact CG-CD2 3.77Å; A296-L395 HydrophobicContact CB-CD1 4.37Å; I297-L395 HydrophobicContact CD1-CD2 4.16Å; I297-L395 HydrophobicContact CG1-CD1 3.96Å; I297-L395 HydrophobicContact CG1-CD2 4.26Å; I300-L395 HydrophobicContact CD1-CD1 4.23Å; L395-Q399 HydrophobicContact CD1-CB 4.25Å; L395-T400 HydrophobicContact CD2-CG2 4.15Å; L395-W420 CarbonylContact O-C 3.57Å; L395-W420 WeakPolarHBondContact O-CA 3.32Å; L395-W420 VanDerWaalsContact O-CB 3.24Å; L395-W420 WeakPolarHBondContact O-CB 3.36Å; L395-R421 PolarHBondContact N-O 3.27Å; L395-R421 PolarHBondContact O-N 3.26Å; L395-V423 HydrophobicContact CB-CG2 4.06Å; L395-V423 HydrophobicContact CD2-CG2 4.12Å
396	S	92.3	Very high	73	Confident	44 Å²	44	60 Å²	60	31%	0.308	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	141.7	179.7	-57.9	0	0	0	0	111.5	G398 Q399	S396-G398 PolarHBondContact O-N 3.01Å; S396-G398 VanDerWaalsContact O-N 3.15Å; S396-Q399 VanDerWaalsContact N-OE1 3.14Å; S396-Q399 WeakPolarHBondContact O-CB 3.41Å; S396-Q399 PolarHBondContact O-N 2.98Å
397	A	77	Confident	70.3	Confident	65 Å²	65	67 Å²	67	54%	0.537	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-59.1	-28.9	-176.8	0	0	0	0	0	113.9	Q399 T400 R419	A397-Q399 PolarHBondContact O-N 3.14Å; A397-T400 PolarHBondContact O-OG1 3.49Å; A397-R419 WeakPolarHBondContact CB-O 3.48Å; A397-R419 PolarHBondContact N-O 2.75Å
398	G	67.2	Low	67.6	Low	78 Å²	78	75.2 Å²	75.2	80%	0.804	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-74.8	-6.9	176.7	0	0	0	0	0	115	S396	S396-G398 PolarHBondContact O-N 3.01Å; S396-G398 VanDerWaalsContact O-N 3.15Å
399	Q	66.8	Low	64.6	Low	71 Å²	71	78.3 Å²	78.3	33%	0.332	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-93	-8.5	-176.7	-64.6	174.6	-43.5	0	0	113.1	A296 L395 S396 A397	A296-Q399 WeakPolarHBondContact CB-O 3.48Å; L395-Q399 HydrophobicContact CD1-CB 4.25Å; S396-Q399 VanDerWaalsContact N-OE1 3.14Å; S396-Q399 WeakPolarHBondContact O-CB 3.41Å; S396-Q399 PolarHBondContact O-N 2.98Å; A397-Q399 PolarHBondContact O-N 3.14Å
400	T	60.1	Low	61.7	Low	55 Å²	55	85 Å²	85	34%	0.337	53%	0.528	S	S	.	.	S	Bend	trans	-92.3	-3	-179.4	54.2	0	0	0	0	113.6	E293 A296 L395 A397 S402	E293-T400 HydrophobicContact CG-CG2 3.75Å; A296-T400 HydrophobicContact CB-CG2 4.47Å; L395-T400 HydrophobicContact CD2-CG2 4.15Å; A397-T400 PolarHBondContact O-OG1 3.49Å; T400-S402 PolarHBondContact O-N 3.48Å
401	G	45.6	Very low	58.8	Low	61 Å²	61	86.6 Å²	86.6	63%	0.629	55%	0.55	S	S	*	.			trans	-84.2	110.2	-178.4	0	0	0	0	0	113.4
402	S	37.9	Very low	55.8	Low	112 Å²	112	92.2 Å²	92.2	78%	0.783	59%	0.589	S	S	*	*			trans	-60.6	133.4	148.9	51	0	0	0	0	108.8	T400 V404	T400-S402 PolarHBondContact O-N 3.48Å; S402-V404 PolarHBondContact O-N 3.16Å
403	G	37.8	Very low	53.1	Low	81 Å²	81	97.9 Å²	97.9	84%	0.835	63%	0.626	S	S	*	*	S	Bend	trans	-45.9	109.5	-170.5	0	0	0	0	0	115.5
404	V	32.4	Very low	50.4	Low	124 Å²	124	103 Å²	103	75%	0.752	66%	0.662	S	S	*	*			trans	-138.7	113.9	146.2	179.8	0	0	0	0	104.9	S402 S406	S402-V404 PolarHBondContact O-N 3.16Å; V404-S406 PolarHBondContact O-N 3.07Å; V404-S406 VanDerWaalsContact O-N 3.13Å
405	Q	34.5	Very low	47.8	Very low	201 Å²	201	103.7 Å²	103.7	94%	0.939	68%	0.681	S	S	*	*			trans	-64.2	108.5	164.4	-76.8	176.2	-15.4	0	0	106.9
406	S	30.5	Very low	45.6	Very low	108 Å²	108	110.4 Å²	110.4	76%	0.755	72%	0.722	S	S	*	*			trans	-106.7	121	164.5	50.5	0	0	0	0	107.9	V404	V404-S406 PolarHBondContact O-N 3.07Å; V404-S406 VanDerWaalsContact O-N 3.13Å
407	E	31.8	Very low	44.1	Very low	181 Å²	181	116.5 Å²	116.5	85%	0.846	75%	0.746	S	S	*	*			trans	-50	144.5	-174.3	-66.8	172.9	140.1	0	0	113.8	T409	E407-T409 PolarHBondContact O-N 2.93Å
408	E	34.4	Very low	43.9	Very low	192 Å²	192	118.8 Å²	118.8	90%	0.897	74%	0.741	S	S	*	*			trans	-54.9	105.3	172.1	-71.3	178.2	145.9	0	0	110.5
409	T	30.3	Very low	45	Very low	133 Å²	133	124.5 Å²	124.5	82%	0.816	74%	0.738	S	S	*	*			trans	-96.6	108.3	163.1	-36.8	0	0	0	0	107.9	E407 A411	E407-T409 PolarHBondContact O-N 2.93Å; T409-A411 PolarHBondContact O-N 2.88Å; T409-A411 VanDerWaalsContact O-N 3.13Å
410	T	36.2	Very low	46.3	Very low	141 Å²	141	124.1 Å²	124.1	87%	0.865	73%	0.734	S	S	*	*			trans	-66.3	103.8	175.8	48.7	0	0	0	0	110.7
411	A	34.3	Very low	47.9	Very low	89 Å²	89	123.2 Å²	123.2	74%	0.736	72%	0.724	S	S	*	*			trans	-129.3	126.6	162.8	0	0	0	0	0	109.2	T409	T409-A411 PolarHBondContact O-N 2.88Å; T409-A411 VanDerWaalsContact O-N 3.13Å
412	S	35.4	Very low	50.4	Low	120 Å²	120	120.3 Å²	120.3	84%	0.839	69%	0.694	S	S	*	*			trans	-56.7	132.4	-177.7	-69	0	0	0	0	112.6	S414	S412-S414 PolarHBondContact O-N 2.94Å
413	P	41.8	Very low	53.3	Low	120 Å²	120	115 Å²	115	78%	0.779	66%	0.657	S	S	*	*			trans	-86.1	109.6	179.6	31.6	-29.7	0	0	0	110.9
414	S	39	Very low	56.1	Low	110 Å²	110	113.9 Å²	113.9	77%	0.769	63%	0.627	S	S	*	*			trans	-88.2	130.2	161.6	61.2	0	0	0	0	109.9	S412	S412-S414 PolarHBondContact O-N 2.94Å
415	A	43.3	Very low	59.2	Low	86 Å²	86	108 Å²	108	71%	0.711	59%	0.592	S	S	*	*	S	Bend	trans	58.2	96.1	178.4	0	0	0	0	0	114.8	E417	A415-E417 PolarHBondContact O-N 2.84Å
416	T	48.3	Very low	62.2	Low	147 Å²	147	99.5 Å²	99.5	90%	0.902	55%	0.554	S	S	*	*			trans	-10.8	82.1	167.8	45.8	0	0	0	0	115.9	R418	T416-R418 PolarHBondContact O-N 2.88Å
417	E	61.1	Low	65.3	Low	171 Å²	171	94.4 Å²	94.4	80%	0.799	52%	0.518	S	S	*	.			trans	-66.1	118	169.1	-79.5	-175.9	158.6	0	0	108.2	A415 R419	A415-E417 PolarHBondContact O-N 2.84Å; E417-R419 PolarHBondContact O-N 2.67Å
418	R	74.2	Confident	68.3	Low	114 Å²	114	87 Å²	87	43%	0.43	49%	0.487	S	S	.	.			trans	-64.1	98.9	176.1	-170.1	-177.6	173.8	-156.8	-8.5	108.2	D284 T416 W420	D284-R418 IonicContact OD1-NH1 2.76Å; D284-R418 IonicContact OD2-CZ 3.98Å; D284-R418 IonicContact OD2-NH1 2.74Å; D284-R418 PolarHBondContact OD2-NH1 2.83Å; D284-R418 IonicContact OD2-NH2 3.96Å; D284-R418 PolarHBondContact OD2-NH2 3.47Å; T416-R418 PolarHBondContact O-N 2.88Å; R418-W420 HydrophobicContact CG-CD2 4.13Å; R418-W420 HydrophobicContact CG-CG 4.26Å; R418-W420 HydrophobicContact CG-CZ2 4.34Å; R418-W420 WeakPolarHBondContact CG-O 3.4Å; R418-W420 VanDerWaalsContact NE-CZ2 3.26Å; R418-W420 PolarHBondContact O-N 2.83Å
419	R	88.5	Confident	71.1	Confident	197 Å²	197	78.1 Å²	78.1	74%	0.743	45%	0.445	S	S	*	.			trans	-71.7	19.8	-178.2	-64	-173.6	177	178.2	-2.4	114.8	A397 E417	A397-R419 WeakPolarHBondContact CB-O 3.48Å; A397-R419 PolarHBondContact N-O 2.75Å; E417-R419 PolarHBondContact O-N 2.67Å
420	W	94	Very high	73.8	Confident	64 Å²	64	71.9 Å²	71.9	24%	0.242	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	155.1	-176	64.1	-92	0	0	0	110.3	L360 K394 L395 R418	L360-W420 HydrophobicContact CD1-CE3 4.37Å; L360-W420 HydrophobicContact CD1-CH2 3.89Å; L360-W420 HydrophobicContact CD1-CZ3 3.38Å; L360-W420 HydrophobicContact CD2-CH2 3.92Å; L360-W420 HydrophobicContact CD2-CZ3 4.11Å; L360-W420 HydrophobicContact CG-CZ3 4.37Å; K394-W420 HydrophobicContact CB-CE3 4.39Å; K394-W420 HydrophobicContact CD-CD2 4.19Å; K394-W420 HydrophobicContact CD-CE3 4.45Å; K394-W420 HydrophobicContact CD-CG 4.43Å; K394-W420 HydrophobicContact CG-CB 4.19Å; K394-W420 HydrophobicContact CG-CD2 3.66Å; K394-W420 HydrophobicContact CG-CE3 3.58Å; K394-W420 HydrophobicContact CG-CG 3.94Å; K394-W420 HydrophobicContact CG-CZ3 4.09Å; L395-W420 CarbonylContact O-C 3.57Å; L395-W420 WeakPolarHBondContact O-CA 3.32Å; L395-W420 VanDerWaalsContact O-CB 3.24Å; L395-W420 WeakPolarHBondContact O-CB 3.36Å; R418-W420 HydrophobicContact CG-CD2 4.13Å; R418-W420 HydrophobicContact CG-CG 4.26Å; R418-W420 HydrophobicContact CG-CZ2 4.34Å; R418-W420 WeakPolarHBondContact CG-O 3.4Å; R418-W420 VanDerWaalsContact NE-CZ2 3.26Å; R418-W420 PolarHBondContact O-N 2.83Å
421	R	95.3	Very high	76	Confident	36 Å²	36	66.1 Å²	66.1	14%	0.136	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	154.8	172.4	65.6	174.6	-76.5	-159.9	2	111.9	D284 Q287 P288 E293 L395 V423	D284-R421 HydrophobicContact CB-CB 4.26Å; D284-R421 PolarHBondContact O-NH2 3.39Å; Q287-R421 PolarHBondContact O-NH2 3.19Å; P288-R421 PolarHBondContact O-NH1 3.17Å; E293-R421 WeakPolarHBondContact OE1-CD 3.41Å; E293-R421 IonicContact OE1-CZ 3.44Å; E293-R421 IonicContact OE1-NE 2.67Å; E293-R421 IonicContact OE1-NH1 3.14Å; E293-R421 PolarHBondContact OE1-NH1 2.99Å; E293-R421 IonicContact OE2-NH1 2.79Å; L395-R421 PolarHBondContact N-O 3.27Å; L395-R421 PolarHBondContact O-N 3.26Å; R421-V423 HydrophobicContact CG-CG2 4.29Å
422	A	97.4	Very high	78	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	134.9	174.5	0	0	0	0	0	111.5	H281 D284 L360 I392 F393	H281-A422 HydrophobicContact CB-CB 3.63Å; D284-A422 HydrophobicContact CB-CB 3.79Å; D284-A422 WeakPolarHBondContact CB-O 3.44Å; D284-A422 PolarHBondContact OD2-N 2.93Å; L360-A422 HydrophobicContact CD1-CB 3.73Å; I392-A422 HydrophobicContact CG2-CB 3.7Å; F393-A422 CarbonylContact O-C 3.48Å; F393-A422 VanDerWaalsContact O-CA 3.27Å; F393-A422 WeakPolarHBondContact O-CA 3.47Å
423	V	97.9	Very high	79.3	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.1	178.4	-179.4	0	0	0	0	110	V289 I297 V330 I392 F393 L395 R421 V425	V289-V423 HydrophobicContact CG1-CG1 4.12Å; V289-V423 HydrophobicContact CG2-CG1 3.69Å; I297-V423 HydrophobicContact CD1-CB 3.93Å; I297-V423 HydrophobicContact CD1-CG1 3.56Å; I297-V423 HydrophobicContact CD1-CG2 4.29Å; V330-V423 HydrophobicContact CG2-CG1 4.16Å; I392-V423 CarbonylContact C-O 3.52Å; I392-V423 WeakPolarHBondContact CA-O 3.39Å; F393-V423 PolarHBondContact N-O 2.81Å; F393-V423 PolarHBondContact O-N 3.35Å; L395-V423 HydrophobicContact CB-CG2 4.06Å; L395-V423 HydrophobicContact CD2-CG2 4.12Å; R421-V423 HydrophobicContact CG-CG2 4.29Å; V423-V425 HydrophobicContact CG1-CG2 4.22Å
424	R	98	Very high	80.1	Confident	56 Å²	56	58.5 Å²	58.5	21%	0.211	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	128.8	174.6	-71.7	-165.9	-57.1	114.2	18.3	110.2	I285 H328 D329 V330 I392	I285-R424 HydrophobicContact CD1-CG 4.41Å; I285-R424 HydrophobicContact CG1-CG 4.24Å; I285-R424 HydrophobicContact CG2-CG 3.94Å; H328-R424 PolarHBondContact O-NH2 3.02Å; D329-R424 CarbonylContact C-O 3.47Å; D329-R424 VanDerWaalsContact CA-O 3.24Å; D329-R424 WeakPolarHBondContact CA-O 3.34Å; D329-R424 HydrophobicContact CB-CB 3.79Å; D329-R424 WeakPolarHBondContact CB-O 3.46Å; D329-R424 VanDerWaalsContact CG-NH2 3.27Å; D329-R424 IonicContact OD2-CZ 3.37Å; D329-R424 IonicContact OD2-NH1 2.7Å; D329-R424 PolarHBondContact OD2-NH1 3.21Å; D329-R424 IonicContact OD2-NH2 2.93Å; D329-R424 PolarHBondContact OD2-NH2 3.42Å; V330-R424 PolarHBondContact N-O 3.45Å; I392-R424 HydrophobicContact CG1-CG 4.49Å
425	V	97.9	Very high	80.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	88.3	-178.4	-174.6	0	0	0	0	110	I297 V330 F332 S391 F393 V423 M427	I297-V425 HydrophobicContact CD1-CG2 4.04Å; I297-V425 HydrophobicContact CG2-CG1 4.09Å; I297-V425 HydrophobicContact CG2-CG2 3.94Å; V330-V425 HydrophobicContact CB-CG2 4.39Å; V330-V425 WeakPolarHBondContact O-CA 3.39Å; V330-V425 WeakPolarHBondContact O-CG1 3.32Å; F332-V425 HydrophobicContact CD2-CG1 3.67Å; F332-V425 HydrophobicContact CE2-CG1 3.66Å; S391-V425 PolarHBondContact N-O 3.26Å; S391-V425 PolarHBondContact O-N 2.9Å; S391-V425 PolarHBondContact OG-O 3.07Å; F393-V425 HydrophobicContact CB-CG2 3.83Å; F393-V425 HydrophobicContact CD1-CG2 4.29Å; F393-V425 HydrophobicContact CD2-CB 3.43Å; F393-V425 VanDerWaalsContact CD2-CB 3.43Å; F393-V425 HydrophobicContact CD2-CG1 4.06Å; F393-V425 HydrophobicContact CD2-CG2 3.46Å; F393-V425 VanDerWaalsContact CD2-CG2 3.46Å; F393-V425 HydrophobicContact CE2-CB 3.59Å; F393-V425 HydrophobicContact CE2-CG1 3.74Å; F393-V425 HydrophobicContact CE2-CG2 4.03Å; F393-V425 HydrophobicContact CG-CB 4.11Å; F393-V425 HydrophobicContact CG-CG2 3.6Å; F393-V425 HydrophobicContact CZ-CB 4.39Å; F393-V425 HydrophobicContact CZ-CG1 4.12Å; V423-V425 HydrophobicContact CG1-CG2 4.22Å; V425-M427 HydrophobicContact CG1-CG 4.2Å
426	P	96.6	Very high	80.6	Confident	23 Å²	23	58.2 Å²	58.2	15%	0.149	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	135	168.9	-19.6	34.7	0	0	0	110.8	D329 V330 D331 F332 L390	D329-P426 HydrophobicContact CB-CG 4.29Å; V330-P426 WeakPolarHBondContact O-CD 3.48Å; D331-P426 WeakPolarHBondContact CA-O 3.24Å; D331-P426 WeakPolarHBondContact OD1-CB 3.09Å; D331-P426 VanDerWaalsContact OD1-CG 3.31Å; D331-P426 WeakPolarHBondContact OD1-CG 3.47Å; F332-P426 PolarHBondContact N-O 2.86Å; L390-P426 HydrophobicContact CD2-CB 4.24Å
427	M	96.2	Very high	80.2	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.1	174.8	-59.6	177.2	-73.6	0	0	109	V301 F332 M346 L349 L353 R388 C389 F393 V425	V301-M427 HydrophobicContact CG1-SD 4.01Å; F332-M427 HydrophobicContact CB-CG 4.29Å; F332-M427 HydrophobicContact CD2-CG 4.31Å; F332-M427 WeakPolarHBondContact O-CA 3.35Å; M346-M427 HydrophobicContact CE-CB 3.68Å; M346-M427 WeakPolarHBondContact CE-O 3.29Å; M346-M427 HydrophobicContact SD-CB 4.24Å; M346-M427 HydrophobicContact SD-CE 4.35Å; L349-M427 HydrophobicContact CD2-CE 4.46Å; L349-M427 HydrophobicContact CD2-SD 3.79Å; L353-M427 HydrophobicContact CD1-CE 4.15Å; L353-M427 HydrophobicContact CD1-SD 4.48Å; R388-M427 CarbonylContact C-O 3.52Å; R388-M427 VanDerWaalsContact CA-O 3.24Å; R388-M427 WeakPolarHBondContact CA-O 3.49Å; C389-M427 HydrophobicContact CB-CE 4.18Å; C389-M427 PolarHBondContact N-O 3.14Å; C389-M427 PolarHBondContact O-N 3.06Å; F393-M427 HydrophobicContact CE2-CE 4.15Å; F393-M427 HydrophobicContact CZ-CE 4.42Å; F393-M427 HydrophobicContact CZ-SD 4.4Å; V425-M427 HydrophobicContact CG1-CG 4.2Å
428	S	94.6	Very high	78.9	Confident	27 Å²	27	54.4 Å²	54.4	19%	0.189	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.9	173.4	-66.2	0	0	0	0	110.4	F332 I334 E387	F332-S428 PolarHBondContact O-N 2.9Å; I334-S428 PolarHBondContact N-O 2.96Å; E387-S428 CarbonylContact O-C 3.57Å; E387-S428 WeakPolarHBondContact O-CA 3.48Å
429	V	92.1	Very high	77	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.024	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.8	176	174.9	0	0	0	0	109.2	I334 E342 L345 M346 F386 E387	I334-V429 HydrophobicContact CB-CG2 4.08Å; I334-V429 HydrophobicContact CG2-CG2 4.38Å; I334-V429 CarbonylContact O-C 3.55Å; I334-V429 VanDerWaalsContact O-CA 3.26Å; I334-V429 WeakPolarHBondContact O-CA 3.24Å; E342-V429 HydrophobicContact CB-CG1 3.72Å; E342-V429 HydrophobicContact CG-CG1 3.93Å; L345-V429 HydrophobicContact CB-CG2 4.45Å; M346-V429 HydrophobicContact CB-CG2 4.19Å; M346-V429 HydrophobicContact CE-CG2 3.72Å; F386-V429 WeakPolarHBondContact CB-O 3.34Å; E387-V429 HydrophobicContact CB-CB 4.38Å; E387-V429 PolarHBondContact O-N 3.43Å
430	S	87.6	Confident	76.4	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.021	26%	0.255	C	S	.	.			trans	-122.4	156.2	179.2	74.7	0	0	0	0	112.8	I334 T335	I334-S430 PolarHBondContact O-N 2.85Å; T335-S430 WeakPolarHBondContact CB-O 3.37Å; T335-S430 PolarHBondContact OG1-O 3.07Å
431	T	82.2	Confident	75.5	Confident	20 Å²	20	48.9 Å²	48.9	12%	0.123	26%	0.255	C	S	.	.			trans	-65.1	156.5	169.1	55.5	0	0	0	0	111.3	E342 H433 I434	E342-T431 WeakPolarHBondContact OE1-CG2 3.46Å; T431-H433 VanDerWaalsContact C-N 3.32Å; T431-H433 PolarHBondContact O-N 3.5Å; T431-I434 PolarHBondContact O-N 3.27Å
432	V	75.9	Confident	74.4	Confident	11 Å²	11	49.6 Å²	49.6	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-29.1	-174.1	77.1	0	0	0	0	114	H336 E339 I434 S435 K436	H336-V432 VanDerWaalsContact O-CB 3.24Å; H336-V432 WeakPolarHBondContact O-CB 3.19Å; H336-V432 WeakPolarHBondContact O-CG2 3.49Å; E339-V432 HydrophobicContact CB-CG1 4.36Å; V432-I434 PolarHBondContact O-N 2.55Å; V432-S435 WeakPolarHBondContact CA-OG 3.4Å; V432-S435 PolarHBondContact O-N 3.2Å; V432-S435 PolarHBondContact O-OG 3.43Å; V432-K436 PolarHBondContact O-N 2.86Å
433	H	64.2	Low	73	Confident	101 Å²	101	52.5 Å²	52.5	47%	0.468	28%	0.277	S	S	.	.	H	α-helix	trans	-66.2	-28.2	-177.3	-74	-65	0	0	0	112.5	E339 T431	E339-H433 IonicContact OE1-CD2 3.56Å; E339-H433 IonicContact OE2-CD2 3.68Å; E339-H433 IonicContact OE2-NE2 3.46Å; E339-H433 PolarHBondContact OE2-NE2 3.02Å; T431-H433 VanDerWaalsContact C-N 3.32Å; T431-H433 PolarHBondContact O-N 3.5Å
434	I	58.2	Low	71.5	Confident	57 Å²	57	55.8 Å²	55.8	29%	0.292	29%	0.294	S	S	.	.	H	α-helix	trans	-89.9	-26.6	-175.9	-58.7	179.3	0	0	0	111.2	Y369 F386 T431 V432	Y369-I434 HydrophobicContact CE1-CD1 4.33Å; F386-I434 HydrophobicContact CE1-CD1 3.81Å; F386-I434 HydrophobicContact CE2-CD1 4.44Å; F386-I434 HydrophobicContact CZ-CD1 3.35Å; F386-I434 HydrophobicContact CZ-CG2 4.43Å; T431-I434 PolarHBondContact O-N 3.27Å; V432-I434 PolarHBondContact O-N 2.55Å
435	S	50.5	Low	69.7	Low	29 Å²	29	55.7 Å²	55.7	20%	0.203	30%	0.3	C	S	.	.	H	α-helix	trans	-77.1	-22.6	176.9	48.5	0	0	0	0	113.3	T335 V432 E437	T335-S435 PolarHBondContact OG1-OG 3.06Å; V432-S435 WeakPolarHBondContact CA-OG 3.4Å; V432-S435 PolarHBondContact O-N 3.2Å; V432-S435 PolarHBondContact O-OG 3.43Å; S435-E437 VanDerWaalsContact C-N 3.32Å
436	K	42.1	Very low	67.7	Low	161 Å²	161	59.7 Å²	59.7	70%	0.7	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-16.6	173.8	-71.8	-178.8	-178.8	174.5	0	114.2	V432	V432-K436 PolarHBondContact O-N 2.86Å
437	E	39.3	Very low	65.5	Low	165 Å²	165	62.5 Å²	62.5	77%	0.771	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	10.6	178.4	-67.5	-166	159.7	0	0	113.9	S435 P439	S435-E437 VanDerWaalsContact C-N 3.32Å; E437-P439 WeakPolarHBondContact O-CD 3.47Å
438	V	33.7	Very low	62.9	Low	72 Å²	72	67.7 Å²	67.7	44%	0.436	36%	0.362	S	S	.	.			trans	-98.3	90.8	173.5	-173.2	0	0	0	0	109
439	P	34.7	Very low	60	Low	162 Å²	162	71.4 Å²	71.4	100%	1.052	38%	0.378	S	S	*	.			trans	-60.3	0	174.3	25	-33.4	0	0	0	112.3	R321 E437	R321-P439 VanDerWaalsContact CZ-O 3.31Å; R321-P439 PolarHBondContact NH1-O 3.5Å; R321-P439 VanDerWaalsContact NH2-C 3.26Å; R321-P439 PolarHBondContact NH2-O 2.92Å; R321-P439 PolarHBondContact NH2-OXT 2.95Å; E437-P439 WeakPolarHBondContact O-CD 3.47Å

Retrieved 439 of 439 residues in 480.8 ms (Link to these results)

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