A0A077ZBB7_TRITR Loading...

PWWP domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBB7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 439 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.4	Very low	26	Very low	242 Å²	242	137.6 Å²	137.6	100%	1.192	81%	0.806	S	S	*	*				0	108.2	0	-79.4	167.4	79	0	0	106.8
2	A	28.3	Very low	26.3	Very low	93 Å²	93	131.8 Å²	131.8	77%	0.769	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-68.2	144.5	167.7	0	0	0	0	0	108.5	E4	A2-E4 PolarHBondContact O-N 3.16Å
3	P	27	Very low	26.2	Very low	115 Å²	115	135.9 Å²	135.9	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.3	125.2	-176.8	27.5	-31	0	0	0	110.1	R5	P3-R5 PolarHBondContact O-N 2.81Å
4	E	22.4	Very low	26.5	Very low	182 Å²	182	133.2 Å²	133.2	85%	0.85	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-57.6	122	172.7	-79	174.3	141.9	0	0	110	A2 V6	A2-E4 PolarHBondContact O-N 3.16Å; E4-V6 PolarHBondContact O-N 3.37Å; E4-V6 VanDerWaalsContact O-N 3.14Å
5	R	26.6	Very low	27.1	Very low	243 Å²	243	141.1 Å²	141.1	92%	0.917	81%	0.806	S	S	*	*			trans	-60.3	111.3	155.8	-80.7	179.9	175.5	167.5	-0.5	106.5	P3 A7	P3-R5 PolarHBondContact O-N 2.81Å; R5-A7 PolarHBondContact O-N 3.07Å
6	V	24.4	Very low	27.2	Very low	138 Å²	138	144.3 Å²	144.3	84%	0.836	81%	0.808	S	S	*	*			trans	-71	88.2	166.3	-177.8	0	0	0	0	106.6	E4 S8	E4-V6 PolarHBondContact O-N 3.37Å; E4-V6 VanDerWaalsContact O-N 3.14Å; V6-S8 PolarHBondContact O-N 3.45Å
7	A	26	Very low	27.9	Very low	84 Å²	84	140.8 Å²	140.8	69%	0.694	80%	0.802	S	S	*	*			trans	-72.4	107	163.6	0	0	0	0	0	106.8	R5 T9	R5-A7 PolarHBondContact O-N 3.07Å; A7-T9 PolarHBondContact O-N 3.29Å
8	S	27.8	Very low	28.7	Very low	95 Å²	95	136.9 Å²	136.9	66%	0.664	78%	0.784	S	S	*	*			trans	-69.1	116.4	170.7	58.7	0	0	0	0	108.9	V6 G10	V6-S8 PolarHBondContact O-N 3.45Å; S8-G10 PolarHBondContact O-N 3.18Å; S8-G10 VanDerWaalsContact O-N 3.15Å
9	T	23.6	Very low	29.5	Very low	143 Å²	143	136.1 Å²	136.1	88%	0.877	79%	0.786	S	S	*	*			trans	-76.7	89.7	174.3	40.3	0	0	0	0	110.2	A7	A7-T9 PolarHBondContact O-N 3.29Å
10	G	27.5	Very low	30.8	Very low	53 Å²	53	131.8 Å²	131.8	55%	0.546	77%	0.765	S	S	.	*			trans	-98.4	127.8	168.9	0	0	0	0	0	110.3	S8	S8-G10 PolarHBondContact O-N 3.18Å; S8-G10 VanDerWaalsContact O-N 3.15Å
11	T	25.1	Very low	32.5	Very low	126 Å²	126	128.6 Å²	128.6	77%	0.773	76%	0.76	S	S	*	*			trans	-95.3	112.8	178.3	-46.7	0	0	0	0	108.9	M13	T11-M13 PolarHBondContact O-N 3.05Å
12	A	29.6	Very low	35	Very low	68 Å²	68	118.8 Å²	118.8	56%	0.562	72%	0.718	S	S	*	*			trans	-64	122.6	-177.2	0	0	0	0	0	112.3
13	M	25	Very low	37.7	Very low	185 Å²	185	114.6 Å²	114.6	91%	0.911	68%	0.682	S	S	*	*			trans	-116.3	152.6	164.9	-110.2	-163	-174.4	0	0	111.2	T11 R15	T11-M13 PolarHBondContact O-N 3.05Å; M13-R15 PolarHBondContact O-N 3.36Å
14	A	30.1	Very low	40.6	Very low	98 Å²	98	109.5 Å²	109.5	81%	0.81	65%	0.65	S	S	*	*			trans	-51.2	125.4	-164.5	0	0	0	0	0	117.2	K16	A14-K16 PolarHBondContact O-N 3.32Å
15	R	35.9	Very low	43.5	Very low	251 Å²	251	104.6 Å²	104.6	95%	0.947	63%	0.632	S	S	*	*			trans	14	95.1	148.8	-64.8	-179.5	176.4	174.1	-1	116.9	M13	M13-R15 PolarHBondContact O-N 3.36Å
16	K	28	Very low	46.2	Very low	192 Å²	192	95.9 Å²	95.9	84%	0.835	60%	0.604	S	S	*	*			trans	-121.6	123.1	152.3	-124.8	177.4	-175.6	177.2	0	108.7	A14	A14-K16 PolarHBondContact O-N 3.32Å
17	A	38.6	Very low	49	Very low	86 Å²	86	101.3 Å²	101.3	71%	0.711	61%	0.609	S	S	*	*			trans	-52.4	141.3	170.1	0	0	0	0	0	109.9	S19	A17-S19 PolarHBondContact O-N 3.49Å
18	P	42.7	Very low	51.8	Low	71 Å²	71	106.2 Å²	106.2	46%	0.461	62%	0.615	S	S	.	*			trans	-65.4	93.4	-175.4	25.2	-32.9	0	0	0	110.7	S20 D54 R56	P18-S20 PolarHBondContact O-N 3.33Å; P18-D54 WeakPolarHBondContact CB-OD2 3.43Å; P18-R56 VanDerWaalsContact CB-NH2 3.32Å
19	S	44.9	Very low	54.6	Low	120 Å²	120	102.9 Å²	102.9	84%	0.839	59%	0.591	S	S	*	*			trans	-74.4	-7	177.8	58.8	0	0	0	0	113.9	A17	A17-S19 PolarHBondContact O-N 3.49Å
20	S	54.3	Low	57.7	Low	51 Å²	51	99.6 Å²	99.6	36%	0.357	57%	0.572	S	S	.	*	S	Bend	trans	-127.3	127	177.3	64.2	0	0	0	0	110	P18 A22 R56	P18-S20 PolarHBondContact O-N 3.33Å; S20-A22 PolarHBondContact O-N 3.31Å; S20-R56 PolarHBondContact O-NH2 3.27Å
21	G	67.3	Low	60.7	Low	64 Å²	64	97.8 Å²	97.8	66%	0.66	55%	0.549	S	S	*	.			trans	-67.4	25	170.5	0	0	0	0	0	114.5
22	A	80.1	Confident	63.7	Low	37 Å²	37	96.6 Å²	96.6	31%	0.306	53%	0.534	S	S	.	.			trans	-78	134.1	178.1	0	0	0	0	0	110.4	S20 R56 L62	S20-A22 PolarHBondContact O-N 3.31Å; A22-R56 PolarHBondContact O-NH2 3.37Å; A22-L62 WeakPolarHBondContact O-CD2 3.37Å
23	V	85.2	Confident	66.4	Low	4 Å²	4	95.2 Å²	95.2	2%	0.024	52%	0.516	C	S	.	.	S	Bend	trans	-99.9	-11.2	177.5	-62.7	0	0	0	0	113.3	F31 I33 V52 V66	V23-F31 WeakPolarHBondContact CG2-O 3.46Å; V23-I33 HydrophobicContact CG1-CB 4.27Å; V23-I33 HydrophobicContact CG1-CD1 4.46Å; V23-I33 HydrophobicContact CG1-CG1 3.37Å; V23-V52 HydrophobicContact CB-CG1 4.05Å; V23-V52 HydrophobicContact CG1-CG1 3.65Å; V23-V52 HydrophobicContact CG2-CG1 4.36Å; V23-V66 HydrophobicContact CB-CG1 4.4Å; V23-V66 HydrophobicContact CG2-CG1 4.22Å; V23-V66 HydrophobicContact CG2-CG2 4.31Å
24	S	86.5	Confident	69.3	Low	9 Å²	9	86.4 Å²	86.4	6%	0.063	47%	0.473	C	S	.	.	S	Bend	trans	-150.3	154.9	-176.9	171.2	0	0	0	0	109.6	N26 S63 E64	S24-N26 PolarHBondContact O-N 3.17Å; S24-N26 WeakPolarHBondContact OG-CB 3.23Å; S24-N26 PolarHBondContact OG-N 3.27Å; S24-S63 CarbonylContact C-O 3.55Å; S24-S63 WeakPolarHBondContact CA-O 3.26Å; S24-S63 PolarHBondContact OG-O 3.08Å; S24-S63 VanDerWaalsContact OG-O 3.09Å; S24-E64 VanDerWaalsContact OG-C 3.26Å; S24-E64 WeakPolarHBondContact OG-CA 3.34Å; S24-E64 PolarHBondContact OG-O 2.79Å
25	T	83.1	Confident	72.2	Confident	78 Å²	78	82 Å²	82	48%	0.479	44%	0.436	S	S	.	.	S	Bend	trans	-68.5	-20.8	168.5	59.3	0	0	0	0	112	R27 L62 S63 E64	T25-R27 PolarHBondContact O-N 3.29Å; T25-L62 HydrophobicContact CG2-CB 3.97Å; T25-L62 WeakPolarHBondContact CG2-O 3.22Å; T25-S63 PolarHBondContact N-O 3.1Å; T25-S63 PolarHBondContact OG1-O 2.79Å; T25-E64 WeakPolarHBondContact OG1-CA 3.24Å; T25-E64 WeakPolarHBondContact OG1-CG 3.19Å; T25-E64 PolarHBondContact OG1-N 3.23Å
26	N	84.9	Confident	74.9	Confident	61 Å²	61	70.2 Å²	70.2	33%	0.326	39%	0.391	S	S	.	.			trans	-74.6	107.6	175.4	-177.2	-4.8	0	0	0	110.8	S24 K28 C29	S24-N26 PolarHBondContact O-N 3.17Å; S24-N26 WeakPolarHBondContact OG-CB 3.23Å; S24-N26 PolarHBondContact OG-N 3.27Å; N26-K28 PolarHBondContact O-N 3.15Å; N26-K28 VanDerWaalsContact O-N 3.1Å; N26-K28 WeakPolarHBondContact OD1-CB 3.27Å; N26-K28 PolarHBondContact OD1-N 3.36Å; N26-C29 HydrophobicContact CB-CB 4.49Å; N26-C29 WeakPolarHBondContact O-CB 3.42Å; N26-C29 PolarHBondContact O-N 2.97Å
27	R	81.7	Confident	78.1	Confident	251 Å²	251	61 Å²	61	95%	0.947	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.7	178.4	-64	-172.8	-179.5	-170.9	0.2	114.7	T25	T25-R27 PolarHBondContact O-N 3.29Å
28	K	85.2	Confident	80.9	Confident	188 Å²	188	57 Å²	57	82%	0.817	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	1.8	175.5	-61.4	-177.9	178.9	178.5	0	112.9	N26 P30	N26-K28 PolarHBondContact O-N 3.15Å; N26-K28 VanDerWaalsContact O-N 3.1Å; N26-K28 WeakPolarHBondContact OD1-CB 3.27Å; N26-K28 PolarHBondContact OD1-N 3.36Å; K28-P30 WeakPolarHBondContact O-CD 3.38Å
29	C	87.4	Confident	83.4	Confident	24 Å²	24	53.6 Å²	53.6	16%	0.162	30%	0.296	C	S	.	.			trans	-59.7	120.4	175.9	178.4	0	0	0	0	109.6	N26 F31 V66	N26-C29 HydrophobicContact CB-CB 4.49Å; N26-C29 WeakPolarHBondContact O-CB 3.42Å; N26-C29 PolarHBondContact O-N 2.97Å; C29-F31 VanDerWaalsContact C-N 3.28Å; C29-F31 PolarHBondContact O-N 3.05Å; C29-V66 VanDerWaalsContact SG-CG2 3.56Å
30	P	88	Confident	85.6	Confident	74 Å²	74	51.2 Å²	51.2	48%	0.481	27%	0.269	S	S	.	.			trans	-77.2	-17.8	-177.4	31.6	-35.1	0	0	0	112.7	K28 Y86	K28-P30 WeakPolarHBondContact O-CD 3.38Å; P30-Y86 PolarHBondContact O-OH 2.96Å
31	F	90.9	Very high	87	Confident	15 Å²	15	52.2 Å²	52.2	7%	0.066	27%	0.27	C	S	.	.			trans	-84.1	147.5	-173.6	-53.7	-71.3	0	0	0	112.6	V23 C29 D35 V37 V52 P81 M84 Y86	V23-F31 WeakPolarHBondContact CG2-O 3.46Å; C29-F31 VanDerWaalsContact C-N 3.28Å; C29-F31 PolarHBondContact O-N 3.05Å; F31-D35 WeakPolarHBondContact CA-OD2 3.23Å; F31-V37 HydrophobicContact CD1-CG1 3.85Å; F31-V37 HydrophobicContact CE1-CG1 3.95Å; F31-V52 HydrophobicContact CB-CG2 4.26Å; F31-P81 HydrophobicContact CE2-CB 4.33Å; F31-M84 HydrophobicContact CD2-CB 4.47Å; F31-M84 HydrophobicContact CD2-CE 4.14Å; F31-M84 HydrophobicContact CD2-SD 4.28Å; F31-M84 HydrophobicContact CE1-CB 4.23Å; F31-M84 HydrophobicContact CE2-CB 3.6Å; F31-M84 HydrophobicContact CE2-CE 4.34Å; F31-M84 HydrophobicContact CE2-CG 4.48Å; F31-M84 HydrophobicContact CE2-SD 4.2Å; F31-M84 HydrophobicContact CG-CE 4.27Å; F31-M84 HydrophobicContact CZ-CB 3.45Å; F31-M84 VanDerWaalsContact CZ-CB 3.45Å; F31-Y86 HydrophobicContact CD1-CE1 4.22Å; F31-Y86 HydrophobicContact CD1-CE2 4.44Å; F31-Y86 HydrophobicContact CE1-CD2 4.39Å; F31-Y86 HydrophobicContact CE1-CE2 4.21Å
32	K	87.8	Confident	87.5	Confident	102 Å²	102	52.3 Å²	52.3	44%	0.443	26%	0.257	S	S	.	.			trans	-122.3	160.1	177.2	-61	-178.5	-179.8	-177.7	0	110.6	G34 D35 V52 D150	K32-G34 PolarHBondContact O-N 3.37Å; K32-D35 PolarHBondContact N-OD2 3.15Å; K32-D35 WeakPolarHBondContact O-CB 3.1Å; K32-D35 PolarHBondContact O-N 3.32Å; K32-D35 VanDerWaalsContact O-N 3.12Å; K32-V52 WeakPolarHBondContact O-CB 3.28Å; K32-V52 WeakPolarHBondContact O-CG1 3.39Å; K32-D150 IonicContact NZ-OD1 3.07Å
33	I	86.8	Confident	87	Confident	39 Å²	39	58.3 Å²	58.3	20%	0.2	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	133	173.7	-58.9	166.7	0	0	0	109	V23 D54 L154	V23-I33 HydrophobicContact CG1-CB 4.27Å; V23-I33 HydrophobicContact CG1-CD1 4.46Å; V23-I33 HydrophobicContact CG1-CG1 3.37Å; I33-D54 HydrophobicContact CD1-CB 3.82Å; I33-D54 HydrophobicContact CG1-CB 4.29Å; I33-L154 HydrophobicContact CG2-CD1 4.09Å; I33-L154 HydrophobicContact CG2-CG 4.21Å
34	G	86.3	Confident	86.4	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	-4.3	-179.6	0	0	0	0	0	115	K32 V36 V52 Q117	K32-G34 PolarHBondContact O-N 3.37Å; G34-V36 PolarHBondContact O-N 2.94Å; G34-V52 PolarHBondContact N-O 3.04Å; G34-Q117 PolarHBondContact O-NE2 2.86Å; G34-Q117 PolarHBondContact O-OE1 3.34Å; G34-Q117 VanDerWaalsContact O-OE1 3.12Å
35	D	90.3	Very high	85.8	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.032	34%	0.34	C	S	.	.			trans	-61.4	127.3	173.9	-74.6	-19.6	0	0	0	111.6	F31 K32 V37 I51 V52 Y86 K152	F31-D35 WeakPolarHBondContact CA-OD2 3.23Å; K32-D35 PolarHBondContact N-OD2 3.15Å; K32-D35 WeakPolarHBondContact O-CB 3.1Å; K32-D35 PolarHBondContact O-N 3.32Å; K32-D35 VanDerWaalsContact O-N 3.12Å; D35-V37 HydrophobicContact CB-CG1 4.1Å; D35-I51 WeakPolarHBondContact O-CA 3.48Å; D35-V52 HydrophobicContact CB-CB 4.29Å; D35-V52 HydrophobicContact CB-CG2 4.02Å; D35-V52 PolarHBondContact O-N 3.22Å; D35-Y86 HydrophobicContact CB-CE1 4.24Å; D35-Y86 WeakPolarHBondContact OD2-CE1 3.47Å; D35-K152 VanDerWaalsContact OD1-CE 3.3Å; D35-K152 WeakPolarHBondContact OD1-CE 3.47Å; D35-K152 IonicContact OD1-NZ 3.54Å; D35-K152 PolarHBondContact OD1-NZ 3.24Å
36	V	92.9	Very high	85.9	Confident	2 Å²	2	68 Å²	68	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.1	169.8	-167.1	0	0	0	0	108.5	G34 G50 I51 L71 I87 A110 L113 F114	G34-V36 PolarHBondContact O-N 2.94Å; V36-G50 WeakPolarHBondContact CA-O 3.42Å; V36-I51 HydrophobicContact CG2-CG1 4.28Å; V36-L71 HydrophobicContact CG1-CD1 4.32Å; V36-I87 HydrophobicContact CB-CB 4.24Å; V36-I87 HydrophobicContact CB-CG2 4.04Å; V36-I87 HydrophobicContact CG1-CB 3.9Å; V36-I87 HydrophobicContact CG1-CD1 4.37Å; V36-I87 HydrophobicContact CG1-CG1 4.04Å; V36-I87 HydrophobicContact CG1-CG2 4.06Å; V36-I87 WeakPolarHBondContact O-CB 3.47Å; V36-I87 PolarHBondContact O-N 3.47Å; V36-A110 HydrophobicContact CG1-CB 3.78Å; V36-L113 HydrophobicContact CG2-CB 4.36Å; V36-F114 HydrophobicContact CB-CB 4.46Å; V36-F114 HydrophobicContact CG2-CB 4.34Å
37	V	95.3	Very high	86.2	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154.4	-167.7	-65.9	0	0	0	0	111.7	F31 D35 A39 P49 G50 V52 V68 M84 K85	F31-V37 HydrophobicContact CD1-CG1 3.85Å; F31-V37 HydrophobicContact CE1-CG1 3.95Å; D35-V37 HydrophobicContact CB-CG1 4.1Å; V37-A39 HydrophobicContact CG2-CB 4.5Å; V37-P49 CarbonylContact O-C 3.38Å; V37-P49 WeakPolarHBondContact O-CA 3.34Å; V37-G50 PolarHBondContact N-O 2.82Å; V37-G50 PolarHBondContact O-N 3.13Å; V37-V52 HydrophobicContact CG1-CG2 3.97Å; V37-V52 HydrophobicContact CG2-CG2 4.07Å; V37-V68 HydrophobicContact CG2-CG1 4.44Å; V37-M84 HydrophobicContact CB-CE 4.47Å; V37-M84 HydrophobicContact CG1-CE 4.41Å; V37-M84 HydrophobicContact CG2-CE 3.94Å; V37-K85 CarbonylContact C-O 3.5Å; V37-K85 WeakPolarHBondContact CA-O 3.3Å; V37-K85 WeakPolarHBondContact CB-O 3.47Å
38	W	96.8	Very high	86.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	133.7	151.5	-67.2	109.7	0	0	0	108.7	W47 P49 M84 K85 I87 F91 C94 F95 Y103 V107	W38-W47 HydrophobicContact CB-CE3 3.78Å; W38-W47 HydrophobicContact CB-CZ3 4.34Å; W38-W47 HydrophobicContact CE3-CB 3.98Å; W38-P49 HydrophobicContact CZ3-CB 4.44Å; W38-M84 CarbonylContact O-C 3.52Å; W38-M84 VanDerWaalsContact O-CA 3.23Å; W38-M84 WeakPolarHBondContact O-CA 3.43Å; W38-K85 HydrophobicContact CB-CB 4.33Å; W38-K85 PolarHBondContact N-O 2.69Å; W38-K85 PolarHBondContact O-N 3.21Å; W38-I87 HydrophobicContact CD2-CD1 3.88Å; W38-I87 HydrophobicContact CE3-CD1 4.43Å; W38-I87 HydrophobicContact CG-CD1 4.22Å; W38-I87 HydrophobicContact CZ2-CD1 3.99Å; W38-I87 PolarHBondContact NE1-O 3.49Å; W38-F91 AromaticContact CZ2-CD2 3.92Å; W38-F91 HydrophobicContact CZ2-CD2 3.92Å; W38-F91 AromaticContact CZ2-CE2 3.65Å; W38-F91 HydrophobicContact CZ2-CE2 3.65Å; W38-F91 HydrophobicContact CZ2-CZ 4.13Å; W38-C94 HydrophobicContact CB-CB 4.34Å; W38-C94 HydrophobicContact CD2-CB 3.6Å; W38-C94 HydrophobicContact CE3-CB 4.13Å; W38-C94 HydrophobicContact CG-CB 3.68Å; W38-C94 HydrophobicContact CZ2-CB 4.32Å; W38-F95 HydrophobicContact CH2-CD2 4.33Å; W38-Y103 WeakPolarHBondContact CH2-OH 3.31Å; W38-Y103 HydrophobicContact CZ3-CE2 4.33Å; W38-Y103 WeakPolarHBondContact CZ3-OH 3.45Å; W38-V107 HydrophobicContact CH2-CB 4.28Å; W38-V107 HydrophobicContact CH2-CG1 3.8Å; W38-V107 HydrophobicContact CH2-CG2 3.44Å; W38-V107 VanDerWaalsContact CH2-CG2 3.44Å; W38-V107 HydrophobicContact CZ2-CG1 4.1Å; W38-V107 HydrophobicContact CZ2-CG2 4.49Å; W38-V107 HydrophobicContact CZ3-CG2 3.89Å
39	A	95.3	Very high	87.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	157.6	172.8	0	0	0	0	0	110.5	V37 W48 V68 W70 V79 Q83 M84	V37-A39 HydrophobicContact CG2-CB 4.5Å; A39-W48 PolarHBondContact N-O 3.17Å; A39-W48 PolarHBondContact O-N 2.9Å; A39-V68 HydrophobicContact CB-CG1 4.42Å; A39-V68 HydrophobicContact CB-CG2 4.36Å; A39-W70 HydrophobicContact CB-CH2 3.52Å; A39-W70 HydrophobicContact CB-CZ3 3.48Å; A39-W70 VanDerWaalsContact CB-CZ3 3.48Å; A39-W70 WeakPolarHBondContact O-CZ3 3.15Å; A39-V79 HydrophobicContact CB-CG1 4.23Å; A39-V79 HydrophobicContact CB-CG2 4.35Å; A39-Q83 WeakPolarHBondContact CA-O 3.48Å; A39-M84 HydrophobicContact CB-CG 4.09Å
40	R	91.6	Very high	87.4	Confident	71 Å²	71	47 Å²	47	27%	0.268	24%	0.239	S	C	.	.			trans	-144.4	144.4	170.5	65.4	-176.5	-173.7	174.9	3	110.9	R44 V46 W47 V79 Q83	R40-R44 WeakPolarHBondContact CD-O 3.43Å; R40-V46 WeakPolarHBondContact CB-O 3.44Å; R40-W47 HydrophobicContact CB-CD2 4.44Å; R40-W47 HydrophobicContact CB-CE3 4.29Å; R40-W47 HydrophobicContact CG-CD2 4.27Å; R40-W47 HydrophobicContact CG-CE3 4.13Å; R40-W47 HydrophobicContact CG-CH2 4.36Å; R40-W47 HydrophobicContact CG-CZ2 4.47Å; R40-W47 HydrophobicContact CG-CZ3 4.2Å; R40-V79 WeakPolarHBondContact O-CG1 3.42Å; R40-Q83 HydrophobicContact CG-CB 3.94Å; R40-Q83 PolarHBondContact N-O 2.74Å; R40-Q83 VanDerWaalsContact N-O 3.08Å; R40-Q83 WeakPolarHBondContact O-CB 3.3Å
41	L	83.4	Confident	87.6	Confident	72 Å²	72	43.5 Å²	43.5	38%	0.377	22%	0.216	S	C	.	.			trans	-68.2	148.1	173.7	-62.5	175.9	0	0	0	110.4	N43 R44 W70	L41-N43 PolarHBondContact O-N 2.82Å; L41-R44 HydrophobicContact CB-CB 4.47Å; L41-R44 HydrophobicContact CB-CG 3.97Å; L41-R44 WeakPolarHBondContact O-CB 3.47Å; L41-R44 PolarHBondContact O-N 3.05Å; L41-W70 HydrophobicContact CD2-CZ2 3.81Å; L41-W70 HydrophobicContact CG-CZ2 4.07Å
42	T	77.2	Confident	87.7	Confident	65 Å²	65	42.8 Å²	42.8	40%	0.399	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	136.6	175.4	-51.8	0	0	0	0	109.8	R44	T42-R44 PolarHBondContact O-N 3.22Å
43	N	70.3	Confident	87.6	Confident	164 Å²	164	38 Å²	38	88%	0.877	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	10.2	-175.2	-49.2	-37.4	0	0	0	116	L41	L41-N43 PolarHBondContact O-N 2.82Å
44	R	71.7	Confident	87.5	Confident	145 Å²	145	36.4 Å²	36.4	55%	0.547	18%	0.184	S	C	.	.			trans	-104.3	138.9	167.8	-59.6	-64.9	-172.2	151.7	1.1	109.8	R40 L41 T42	R40-R44 WeakPolarHBondContact CD-O 3.43Å; L41-R44 HydrophobicContact CB-CB 4.47Å; L41-R44 HydrophobicContact CB-CG 3.97Å; L41-R44 WeakPolarHBondContact O-CB 3.47Å; L41-R44 PolarHBondContact O-N 3.05Å; T42-R44 PolarHBondContact O-N 3.22Å
45	S	74.8	Confident	87.3	Confident	101 Å²	101	36.4 Å²	36.4	71%	0.706	18%	0.184	S	C	*	.			trans	-85	-13	176.5	54.8	0	0	0	0	113.3
46	V	84.2	Confident	86.9	Confident	47 Å²	47	39.5 Å²	39.5	29%	0.285	20%	0.195	S	C	.	.			trans	-91.8	118.5	-170.7	-177	0	0	0	0	110.2	R40 R96	R40-V46 WeakPolarHBondContact CB-O 3.44Å; V46-R96 VanDerWaalsContact CG2-NH1 3.31Å
47	W	92	Very high	86.1	Confident	27 Å²	27	41.5 Å²	41.5	10%	0.102	21%	0.209	C	C	.	.			trans	-75.6	139.2	166.2	-64.2	96	0	0	0	109.8	W38 R40 Q83 K85 C94 Y103	W38-W47 HydrophobicContact CB-CE3 3.78Å; W38-W47 HydrophobicContact CB-CZ3 4.34Å; W38-W47 HydrophobicContact CE3-CB 3.98Å; R40-W47 HydrophobicContact CB-CD2 4.44Å; R40-W47 HydrophobicContact CB-CE3 4.29Å; R40-W47 HydrophobicContact CG-CD2 4.27Å; R40-W47 HydrophobicContact CG-CE3 4.13Å; R40-W47 HydrophobicContact CG-CH2 4.36Å; R40-W47 HydrophobicContact CG-CZ2 4.47Å; R40-W47 HydrophobicContact CG-CZ3 4.2Å; W47-Q83 WeakPolarHBondContact CZ3-O 3.5Å; W47-K85 HydrophobicContact CH2-CD 4.35Å; W47-K85 HydrophobicContact CH2-CG 4.1Å; W47-K85 HydrophobicContact CZ3-CG 4.23Å; W47-C94 HydrophobicContact CB-CB 4Å; W47-C94 HydrophobicContact CD2-CB 4.48Å; W47-C94 HydrophobicContact CG-CB 3.98Å; W47-Y103 WeakPolarHBondContact O-CE2 3.48Å
48	W	93.7	Very high	85	Confident	58 Å²	58	41.5 Å²	41.5	22%	0.22	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.5	177.6	-162.8	-80.5	0	0	0	109.5	A39 W70 L71 Y103	A39-W48 PolarHBondContact N-O 3.17Å; A39-W48 PolarHBondContact O-N 2.9Å; W48-W70 HydrophobicContact CB-CE3 3.93Å; W48-W70 HydrophobicContact CB-CZ3 3.87Å; W48-W70 AromaticContact CD1-CE3 3.89Å; W48-W70 HydrophobicContact CG-CE3 4.23Å; W48-L71 PolarHBondContact NE1-O 3.21Å; W48-Y103 HydrophobicContact CD2-CD2 4.13Å; W48-Y103 AromaticContact CE3-CD2 3.6Å; W48-Y103 HydrophobicContact CE3-CD2 3.6Å; W48-Y103 HydrophobicContact CE3-CE2 4.27Å; W48-Y103 HydrophobicContact CH2-CD2 4.05Å; W48-Y103 HydrophobicContact CH2-CG 4.41Å; W48-Y103 AromaticContact CZ3-CD2 3.57Å; W48-Y103 HydrophobicContact CZ3-CD2 3.57Å; W48-Y103 HydrophobicContact CZ3-CG 4.22Å
49	P	94.3	Very high	83.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	142.7	179.9	29.8	-36.4	0	0	0	112.3	V37 W38 L71 I87 S106 V107 A110	V37-P49 CarbonylContact O-C 3.38Å; V37-P49 WeakPolarHBondContact O-CA 3.34Å; W38-P49 HydrophobicContact CZ3-CB 4.44Å; P49-L71 HydrophobicContact CB-CB 4.48Å; P49-L71 HydrophobicContact CB-CD1 4.31Å; P49-L71 HydrophobicContact CG-CB 4.35Å; P49-L71 PolarHBondContact O-N 2.89Å; P49-I87 HydrophobicContact CB-CD1 3.89Å; P49-S106 WeakPolarHBondContact CG-OG 3.16Å; P49-V107 HydrophobicContact CG-CG2 3.97Å; P49-A110 HydrophobicContact CB-CB 3.63Å; P49-A110 HydrophobicContact CG-CB 4.45Å
50	G	92.6	Very high	83	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	175.3	178.8	0	0	0	0	0	112.8	V36 V37 L69	V36-G50 WeakPolarHBondContact CA-O 3.42Å; V37-G50 PolarHBondContact N-O 2.82Å; V37-G50 PolarHBondContact O-N 3.13Å; G50-L69 CarbonylContact C-O 3.54Å; G50-L69 WeakPolarHBondContact CA-O 3.31Å
51	I	91.7	Very high	82.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.1	177.7	-64.8	177.4	0	0	0	109.1	D35 V36 I53 V68 L69 L71 L113 L154 I158	D35-I51 WeakPolarHBondContact O-CA 3.48Å; V36-I51 HydrophobicContact CG2-CG1 4.28Å; I51-I53 PolarHBondContact O-N 3.18Å; I51-V68 WeakPolarHBondContact O-CA 3.47Å; I51-L69 PolarHBondContact N-O 3.45Å; I51-L69 PolarHBondContact O-N 3.43Å; I51-L71 HydrophobicContact CD1-CD1 4.3Å; I51-L71 HydrophobicContact CD1-CD2 3.79Å; I51-L71 HydrophobicContact CD1-CG 4.36Å; I51-L71 HydrophobicContact CG1-CD1 4.16Å; I51-L71 HydrophobicContact CG1-CD2 4.17Å; I51-L71 HydrophobicContact CG1-CG 4.24Å; I51-L113 HydrophobicContact CD1-CD1 3.73Å; I51-L154 HydrophobicContact CG2-CD2 3.76Å; I51-I158 HydrophobicContact CB-CD1 4.46Å; I51-I158 HydrophobicContact CD1-CD1 3.25Å; I51-I158 HydrophobicContact CG1-CD1 4.4Å; I51-I158 HydrophobicContact CG2-CD1 4.25Å
52	V	91.8	Very high	82.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.6	176	178.2	0	0	0	0	109.7	V23 F31 K32 G34 D35 V37 V66 W67 M84	V23-V52 HydrophobicContact CB-CG1 4.05Å; V23-V52 HydrophobicContact CG1-CG1 3.65Å; V23-V52 HydrophobicContact CG2-CG1 4.36Å; F31-V52 HydrophobicContact CB-CG2 4.26Å; K32-V52 WeakPolarHBondContact O-CB 3.28Å; K32-V52 WeakPolarHBondContact O-CG1 3.39Å; G34-V52 PolarHBondContact N-O 3.04Å; D35-V52 HydrophobicContact CB-CB 4.29Å; D35-V52 HydrophobicContact CB-CG2 4.02Å; D35-V52 PolarHBondContact O-N 3.22Å; V37-V52 HydrophobicContact CG1-CG2 3.97Å; V37-V52 HydrophobicContact CG2-CG2 4.07Å; V52-V66 HydrophobicContact CB-CG1 4.46Å; V52-V66 HydrophobicContact CG1-CG1 3.59Å; V52-V66 HydrophobicContact CG2-CG1 4.14Å; V52-W67 WeakPolarHBondContact CA-O 3.37Å; V52-M84 HydrophobicContact CG2-CE 3.8Å
53	I	87.4	Confident	83	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.			trans	-122	164.2	-179.1	59.8	148.7	0	0	0	111.2	I51 P55 W67 L69 L76 L162	I51-I53 PolarHBondContact O-N 3.18Å; I53-P55 WeakPolarHBondContact O-CD 3.03Å; I53-W67 HydrophobicContact CD1-CB 4.13Å; I53-W67 HydrophobicContact CG1-CB 3.76Å; I53-W67 WeakPolarHBondContact CG1-O 3.33Å; I53-W67 PolarHBondContact N-O 3.24Å; I53-L69 HydrophobicContact CG2-CB 3.99Å; I53-L76 HydrophobicContact CD1-CD1 4.24Å; I53-L76 HydrophobicContact CD1-CD2 3.37Å; I53-L76 HydrophobicContact CD1-CG 4.41Å; I53-L76 HydrophobicContact CG1-CD2 4.3Å; I53-L162 HydrophobicContact CB-CD1 4.42Å; I53-L162 HydrophobicContact CB-CD2 4.47Å; I53-L162 HydrophobicContact CD1-CD2 3.67Å; I53-L162 HydrophobicContact CG2-CD1 4.15Å; I53-L162 HydrophobicContact CG2-CD2 4.28Å
54	D	84.9	Confident	83.9	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	25%	0.246	C	C	.	.			trans	-81.4	117.4	165.6	-170.9	-16.5	0	0	0	109.1	P18 I33 R56 S57	P18-D54 WeakPolarHBondContact CB-OD2 3.43Å; I33-D54 HydrophobicContact CD1-CB 3.82Å; I33-D54 HydrophobicContact CG1-CB 4.29Å; D54-R56 PolarHBondContact O-N 3.3Å; D54-R56 VanDerWaalsContact O-N 3.16Å; D54-R56 VanDerWaalsContact OD1-CB 3.31Å; D54-R56 WeakPolarHBondContact OD1-CB 3.37Å; D54-R56 WeakPolarHBondContact OD1-CG 3.46Å; D54-R56 IonicContact OD1-CZ 3.52Å; D54-R56 PolarHBondContact OD1-N 2.89Å; D54-R56 IonicContact OD1-NE 2.79Å; D54-R56 PolarHBondContact OD1-NE 2.96Å; D54-R56 IonicContact OD1-NH2 3.77Å; D54-R56 PolarHBondContact OD1-NH2 3.44Å; D54-R56 IonicContact OD2-CZ 3.29Å; D54-R56 VanDerWaalsContact OD2-CZ 3.29Å; D54-R56 IonicContact OD2-NE 3.14Å; D54-R56 PolarHBondContact OD2-NE 3.14Å; D54-R56 VanDerWaalsContact OD2-NE 3.14Å; D54-R56 IonicContact OD2-NH2 2.69Å; D54-R56 PolarHBondContact OD2-NH2 3.22Å; D54-S57 WeakPolarHBondContact O-CB 3.45Å; D54-S57 PolarHBondContact O-N 2.9Å; D54-S57 VanDerWaalsContact O-N 3.07Å
55	P	81.2	Confident	84.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-57	-29.5	176.8	17.3	-27.7	0	0	0	113.5	I53 S57 C58 G59 Y60 L62 W67	I53-P55 WeakPolarHBondContact O-CD 3.03Å; P55-S57 PolarHBondContact O-N 3.2Å; P55-C58 CarbonylContact O-C 3.55Å; P55-C58 PolarHBondContact O-N 3.47Å; P55-C58 PolarHBondContact O-SG 3.23Å; P55-G59 PolarHBondContact O-N 3.09Å; P55-Y60 CarbonylContact C-O 3.21Å; P55-Y60 PolarHBondContact O-N 3.17Å; P55-L62 HydrophobicContact CG-CD2 3.68Å; P55-L62 HydrophobicContact CG-CG 4.39Å; P55-W67 HydrophobicContact CB-CB 4.27Å; P55-W67 VanDerWaalsContact CB-CD1 3.43Å; P55-W67 HydrophobicContact CB-CD2 3.99Å; P55-W67 HydrophobicContact CB-CG 3.63Å; P55-W67 HydrophobicContact CG-CG 4.13Å
56	R	81.1	Confident	85.7	Confident	70 Å²	70	39 Å²	39	26%	0.264	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-68	-22.2	-178.2	-60.5	166.9	-67.8	-172.1	2.6	111.9	P18 S20 A22 D54 C58 Y60	P18-R56 VanDerWaalsContact CB-NH2 3.32Å; S20-R56 PolarHBondContact O-NH2 3.27Å; A22-R56 PolarHBondContact O-NH2 3.37Å; D54-R56 PolarHBondContact O-N 3.3Å; D54-R56 VanDerWaalsContact O-N 3.16Å; D54-R56 VanDerWaalsContact OD1-CB 3.31Å; D54-R56 WeakPolarHBondContact OD1-CB 3.37Å; D54-R56 WeakPolarHBondContact OD1-CG 3.46Å; D54-R56 IonicContact OD1-CZ 3.52Å; D54-R56 PolarHBondContact OD1-N 2.89Å; D54-R56 IonicContact OD1-NE 2.79Å; D54-R56 PolarHBondContact OD1-NE 2.96Å; D54-R56 IonicContact OD1-NH2 3.77Å; D54-R56 PolarHBondContact OD1-NH2 3.44Å; D54-R56 IonicContact OD2-CZ 3.29Å; D54-R56 VanDerWaalsContact OD2-CZ 3.29Å; D54-R56 IonicContact OD2-NE 3.14Å; D54-R56 PolarHBondContact OD2-NE 3.14Å; D54-R56 VanDerWaalsContact OD2-NE 3.14Å; D54-R56 IonicContact OD2-NH2 2.69Å; D54-R56 PolarHBondContact OD2-NH2 3.22Å; R56-C58 PolarHBondContact O-N 3.5Å; R56-Y60 VanDerWaalsContact CA-O 3.3Å; R56-Y60 WeakPolarHBondContact CA-O 3.27Å; R56-Y60 PolarHBondContact N-O 2.98Å
57	S	77.4	Confident	86.1	Confident	44 Å²	44	37.7 Å²	37.7	31%	0.308	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-73.1	-11.1	174.5	-58.9	0	0	0	0	113.3	D54 P55	D54-S57 WeakPolarHBondContact O-CB 3.45Å; D54-S57 PolarHBondContact O-N 2.9Å; D54-S57 VanDerWaalsContact O-N 3.07Å; P55-S57 PolarHBondContact O-N 3.2Å
58	C	71.6	Confident	86.1	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.007	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-130.4	22.7	179.3	51.4	0	0	0	0	112.9	P55 R56 Y60 L76 L162 I165	P55-C58 CarbonylContact O-C 3.55Å; P55-C58 PolarHBondContact O-N 3.47Å; P55-C58 PolarHBondContact O-SG 3.23Å; R56-C58 PolarHBondContact O-N 3.5Å; C58-Y60 HydrophobicContact CB-CD2 4.4Å; C58-Y60 WeakPolarHBondContact O-CD2 3.43Å; C58-Y60 WeakPolarHBondContact O-CE2 3.2Å; C58-L76 HydrophobicContact CB-CD1 3.85Å; C58-L162 HydrophobicContact CB-CD2 4.26Å; C58-I165 HydrophobicContact CB-CG2 4.01Å
59	G	72.4	Confident	85.8	Confident	54 Å²	54	33.9 Å²	33.9	56%	0.557	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	88	6.4	172.3	0	0	0	0	0	115.5	P55	P55-G59 PolarHBondContact O-N 3.09Å
60	Y	78.7	Confident	85.5	Confident	103 Å²	103	34.6 Å²	34.6	40%	0.404	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-102.5	155.5	-179.3	-63.8	-83.1	0	0	0	112.9	P55 R56 C58 W67	P55-Y60 CarbonylContact C-O 3.21Å; P55-Y60 PolarHBondContact O-N 3.17Å; R56-Y60 VanDerWaalsContact CA-O 3.3Å; R56-Y60 WeakPolarHBondContact CA-O 3.27Å; R56-Y60 PolarHBondContact N-O 2.98Å; C58-Y60 HydrophobicContact CB-CD2 4.4Å; C58-Y60 WeakPolarHBondContact O-CD2 3.43Å; C58-Y60 WeakPolarHBondContact O-CE2 3.2Å; Y60-W67 AromaticContact CD1-CH2 3.22Å; Y60-W67 HydrophobicContact CD1-CH2 3.22Å; Y60-W67 AromaticContact CD1-CZ2 3.36Å; Y60-W67 HydrophobicContact CD1-CZ2 3.36Å; Y60-W67 HydrophobicContact CD1-CZ3 4.18Å; Y60-W67 HydrophobicContact CD2-CE3 4.18Å; Y60-W67 AromaticContact CD2-CH2 3.47Å; Y60-W67 HydrophobicContact CD2-CH2 3.47Å; Y60-W67 VanDerWaalsContact CD2-CH2 3.47Å; Y60-W67 AromaticContact CD2-CZ2 3.97Å; Y60-W67 HydrophobicContact CD2-CZ2 3.97Å; Y60-W67 AromaticContact CD2-CZ3 3.56Å; Y60-W67 HydrophobicContact CD2-CZ3 3.56Å; Y60-W67 AromaticContact CE1-CH2 3.33Å; Y60-W67 HydrophobicContact CE1-CH2 3.33Å; Y60-W67 AromaticContact CE1-CZ2 3.95Å; Y60-W67 HydrophobicContact CE1-CZ2 3.95Å; Y60-W67 HydrophobicContact CE1-CZ3 4.19Å; Y60-W67 AromaticContact CE2-CH2 3.59Å; Y60-W67 HydrophobicContact CE2-CH2 3.59Å; Y60-W67 HydrophobicContact CE2-CZ2 4.5Å; Y60-W67 AromaticContact CE2-CZ3 3.58Å; Y60-W67 HydrophobicContact CE2-CZ3 3.58Å; Y60-W67 HydrophobicContact CG-CE3 4.48Å; Y60-W67 AromaticContact CG-CH2 3.27Å; Y60-W67 HydrophobicContact CG-CH2 3.27Å; Y60-W67 AromaticContact CG-CZ2 3.36Å; Y60-W67 HydrophobicContact CG-CZ2 3.36Å; Y60-W67 AromaticContact CG-CZ3 3.87Å; Y60-W67 HydrophobicContact CG-CZ3 3.87Å; Y60-W67 AromaticContact CZ-CH2 3.51Å; Y60-W67 AromaticContact CZ-CZ3 3.89Å
61	E	78.9	Confident	85.1	Confident	116 Å²	116	35 Å²	35	54%	0.542	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-88.1	157.1	175.1	-63.4	-170.4	159.9	0	0	112.3	S63	E61-S63 PolarHBondContact O-N 3.48Å
62	L	86.3	Confident	84.2	Confident	47 Å²	47	35.7 Å²	35.7	25%	0.246	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-68.4	130.8	171.3	-68.6	171.2	0	0	0	109.7	A22 T25 P55	A22-L62 WeakPolarHBondContact O-CD2 3.37Å; T25-L62 HydrophobicContact CG2-CB 3.97Å; T25-L62 WeakPolarHBondContact CG2-O 3.22Å; P55-L62 HydrophobicContact CG-CD2 3.68Å; P55-L62 HydrophobicContact CG-CG 4.39Å
63	S	87.2	Confident	83.1	Confident	42 Å²	42	37.5 Å²	37.5	29%	0.294	20%	0.195	S	C	.	.			trans	-123	-172.7	171.7	75.1	0	0	0	0	110.1	S24 T25 E61 R65	S24-S63 CarbonylContact C-O 3.55Å; S24-S63 WeakPolarHBondContact CA-O 3.26Å; S24-S63 PolarHBondContact OG-O 3.08Å; S24-S63 VanDerWaalsContact OG-O 3.09Å; T25-S63 PolarHBondContact N-O 3.1Å; T25-S63 PolarHBondContact OG1-O 2.79Å; E61-S63 PolarHBondContact O-N 3.48Å; S63-R65 PolarHBondContact O-N 3.14Å; S63-R65 WeakPolarHBondContact OG-CB 3.37Å; S63-R65 PolarHBondContact OG-N 2.79Å; S63-R65 VanDerWaalsContact OG-N 3.11Å
64	E	88.2	Confident	82.2	Confident	138 Å²	138	41 Å²	41	65%	0.645	21%	0.212	S	C	*	.	S	Bend	trans	-69.3	-17.8	170.9	-66.4	-168.1	138.2	0	0	112.2	S24 T25	S24-E64 VanDerWaalsContact OG-C 3.26Å; S24-E64 WeakPolarHBondContact OG-CA 3.34Å; S24-E64 PolarHBondContact OG-O 2.79Å; T25-E64 WeakPolarHBondContact OG1-CA 3.24Å; T25-E64 WeakPolarHBondContact OG1-CG 3.19Å; T25-E64 PolarHBondContact OG1-N 3.23Å
65	R	92.3	Very high	81.9	Confident	64 Å²	64	46.1 Å²	46.1	24%	0.242	23%	0.231	C	C	.	.	S	Bend	trans	-87.2	160.6	179.9	-57.4	175.5	66.4	85.8	0.2	110.2	S63 D78 V79	S63-R65 PolarHBondContact O-N 3.14Å; S63-R65 WeakPolarHBondContact OG-CB 3.37Å; S63-R65 PolarHBondContact OG-N 2.79Å; S63-R65 VanDerWaalsContact OG-N 3.11Å; R65-D78 HydrophobicContact CB-CB 4.08Å; R65-D78 WeakPolarHBondContact CD-OD2 3.5Å; R65-D78 IonicContact CZ-OD2 3.05Å; R65-D78 PolarHBondContact NE-O 3.32Å; R65-D78 IonicContact NE-OD2 2.83Å; R65-D78 PolarHBondContact NE-OD2 3.4Å; R65-D78 PolarHBondContact NH2-O 3.5Å; R65-V79 WeakPolarHBondContact CB-O 3.44Å
66	V	92.7	Very high	81.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.9	-176	178.8	0	0	0	0	108.8	V23 C29 V52 V79 P81 M84	V23-V66 HydrophobicContact CB-CG1 4.4Å; V23-V66 HydrophobicContact CG2-CG1 4.22Å; V23-V66 HydrophobicContact CG2-CG2 4.31Å; C29-V66 VanDerWaalsContact SG-CG2 3.56Å; V52-V66 HydrophobicContact CB-CG1 4.46Å; V52-V66 HydrophobicContact CG1-CG1 3.59Å; V52-V66 HydrophobicContact CG2-CG1 4.14Å; V66-V79 PolarHBondContact N-O 3.18Å; V66-V79 PolarHBondContact O-N 2.69Å; V66-P81 HydrophobicContact CG2-CG 4.02Å; V66-M84 HydrophobicContact CB-CE 4.11Å; V66-M84 HydrophobicContact CB-SD 3.74Å; V66-M84 HydrophobicContact CG1-CE 3.77Å; V66-M84 HydrophobicContact CG1-SD 4.1Å; V66-M84 HydrophobicContact CG2-SD 4.33Å
67	W	92	Very high	82.2	Confident	20 Å²	20	45.5 Å²	45.5	8%	0.076	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	129.8	179.9	-77.5	74.5	0	0	0	111.3	V52 I53 P55 Y60 L76 D78	V52-W67 WeakPolarHBondContact CA-O 3.37Å; I53-W67 HydrophobicContact CD1-CB 4.13Å; I53-W67 HydrophobicContact CG1-CB 3.76Å; I53-W67 WeakPolarHBondContact CG1-O 3.33Å; I53-W67 PolarHBondContact N-O 3.24Å; P55-W67 HydrophobicContact CB-CB 4.27Å; P55-W67 VanDerWaalsContact CB-CD1 3.43Å; P55-W67 HydrophobicContact CB-CD2 3.99Å; P55-W67 HydrophobicContact CB-CG 3.63Å; P55-W67 HydrophobicContact CG-CG 4.13Å; Y60-W67 AromaticContact CD1-CH2 3.22Å; Y60-W67 HydrophobicContact CD1-CH2 3.22Å; Y60-W67 AromaticContact CD1-CZ2 3.36Å; Y60-W67 HydrophobicContact CD1-CZ2 3.36Å; Y60-W67 HydrophobicContact CD1-CZ3 4.18Å; Y60-W67 HydrophobicContact CD2-CE3 4.18Å; Y60-W67 AromaticContact CD2-CH2 3.47Å; Y60-W67 HydrophobicContact CD2-CH2 3.47Å; Y60-W67 VanDerWaalsContact CD2-CH2 3.47Å; Y60-W67 AromaticContact CD2-CZ2 3.97Å; Y60-W67 HydrophobicContact CD2-CZ2 3.97Å; Y60-W67 AromaticContact CD2-CZ3 3.56Å; Y60-W67 HydrophobicContact CD2-CZ3 3.56Å; Y60-W67 AromaticContact CE1-CH2 3.33Å; Y60-W67 HydrophobicContact CE1-CH2 3.33Å; Y60-W67 AromaticContact CE1-CZ2 3.95Å; Y60-W67 HydrophobicContact CE1-CZ2 3.95Å; Y60-W67 HydrophobicContact CE1-CZ3 4.19Å; Y60-W67 AromaticContact CE2-CH2 3.59Å; Y60-W67 HydrophobicContact CE2-CH2 3.59Å; Y60-W67 HydrophobicContact CE2-CZ2 4.5Å; Y60-W67 AromaticContact CE2-CZ3 3.58Å; Y60-W67 HydrophobicContact CE2-CZ3 3.58Å; Y60-W67 HydrophobicContact CG-CE3 4.48Å; Y60-W67 AromaticContact CG-CH2 3.27Å; Y60-W67 HydrophobicContact CG-CH2 3.27Å; Y60-W67 AromaticContact CG-CZ2 3.36Å; Y60-W67 HydrophobicContact CG-CZ2 3.36Å; Y60-W67 AromaticContact CG-CZ3 3.87Å; Y60-W67 HydrophobicContact CG-CZ3 3.87Å; Y60-W67 AromaticContact CZ-CH2 3.51Å; Y60-W67 AromaticContact CZ-CZ3 3.89Å; W67-L76 HydrophobicContact CE3-CB 4.15Å; W67-L76 HydrophobicContact CZ3-CB 4.03Å; W67-D78 HydrophobicContact CD2-CB 4.24Å; W67-D78 HydrophobicContact CG-CB 4.47Å; W67-D78 HydrophobicContact CZ2-CB 4.19Å
68	V	92	Very high	82.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.5	-177.6	-179.1	0	0	0	0	109.1	V37 A39 I51 W70 L76 S77 V79 M84	V37-V68 HydrophobicContact CG2-CG1 4.44Å; A39-V68 HydrophobicContact CB-CG1 4.42Å; A39-V68 HydrophobicContact CB-CG2 4.36Å; I51-V68 WeakPolarHBondContact O-CA 3.47Å; V68-W70 HydrophobicContact CG1-CD2 4.43Å; V68-W70 HydrophobicContact CG1-CE3 4.32Å; V68-L76 WeakPolarHBondContact O-CA 3.32Å; V68-S77 PolarHBondContact N-O 2.92Å; V68-S77 PolarHBondContact O-N 3.07Å; V68-V79 HydrophobicContact CB-CG2 4.29Å; V68-V79 HydrophobicContact CG2-CB 4.31Å; V68-V79 HydrophobicContact CG2-CG2 4Å; V68-M84 HydrophobicContact CG2-CE 3.59Å; V68-M84 HydrophobicContact CG2-SD 4.31Å
69	L	88.1	Confident	83.7	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	113.8	161.8	-179.8	72.2	0	0	0	108.5	G50 I51 I53 L71 Q74 L76 I158	G50-L69 CarbonylContact C-O 3.54Å; G50-L69 WeakPolarHBondContact CA-O 3.31Å; I51-L69 PolarHBondContact N-O 3.45Å; I51-L69 PolarHBondContact O-N 3.43Å; I53-L69 HydrophobicContact CG2-CB 3.99Å; L69-L71 PolarHBondContact O-N 2.98Å; L69-Q74 HydrophobicContact CD1-CB 4.4Å; L69-Q74 WeakPolarHBondContact CD1-O 3.3Å; L69-L76 HydrophobicContact CB-CD2 3.76Å; L69-L76 HydrophobicContact CD1-CD2 3.54Å; L69-L76 HydrophobicContact CD1-CG 4.25Å; L69-L76 HydrophobicContact CG-CD2 4.25Å; L69-I158 HydrophobicContact CD2-CG1 4.48Å; L69-I158 HydrophobicContact CD2-CG2 3.78Å
70	W	87.8	Confident	84.6	Confident	14 Å²	14	47.4 Å²	47.4	5%	0.053	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	128.2	179.7	-61	111.2	0	0	0	111	A39 L41 W48 V68 D73 Q74 R75 S77 V79	A39-W70 HydrophobicContact CB-CH2 3.52Å; A39-W70 HydrophobicContact CB-CZ3 3.48Å; A39-W70 VanDerWaalsContact CB-CZ3 3.48Å; A39-W70 WeakPolarHBondContact O-CZ3 3.15Å; L41-W70 HydrophobicContact CD2-CZ2 3.81Å; L41-W70 HydrophobicContact CG-CZ2 4.07Å; W48-W70 HydrophobicContact CB-CE3 3.93Å; W48-W70 HydrophobicContact CB-CZ3 3.87Å; W48-W70 AromaticContact CD1-CE3 3.89Å; W48-W70 HydrophobicContact CG-CE3 4.23Å; V68-W70 HydrophobicContact CG1-CD2 4.43Å; V68-W70 HydrophobicContact CG1-CE3 4.32Å; W70-D73 WeakPolarHBondContact CB-OD1 3.19Å; W70-Q74 WeakPolarHBondContact O-CA 3.19Å; W70-Q74 PolarHBondContact O-N 3.16Å; W70-R75 PolarHBondContact N-O 3.38Å; W70-S77 VanDerWaalsContact NE1-CB 3.32Å; W70-S77 PolarHBondContact NE1-OG 3.41Å; W70-V79 HydrophobicContact CH2-CG2 4Å; W70-V79 HydrophobicContact CZ2-CG2 3.79Å
71	L	83.4	Confident	85.2	Confident	9 Å²	9	43.9 Å²	43.9	5%	0.047	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	132.7	177.1	-70.6	173.8	0	0	0	109.7	V36 W48 P49 I51 L69 S106 A110 L113	V36-L71 HydrophobicContact CG1-CD1 4.32Å; W48-L71 PolarHBondContact NE1-O 3.21Å; P49-L71 HydrophobicContact CB-CB 4.48Å; P49-L71 HydrophobicContact CB-CD1 4.31Å; P49-L71 HydrophobicContact CG-CB 4.35Å; P49-L71 PolarHBondContact O-N 2.89Å; I51-L71 HydrophobicContact CD1-CD1 4.3Å; I51-L71 HydrophobicContact CD1-CD2 3.79Å; I51-L71 HydrophobicContact CD1-CG 4.36Å; I51-L71 HydrophobicContact CG1-CD1 4.16Å; I51-L71 HydrophobicContact CG1-CD2 4.17Å; I51-L71 HydrophobicContact CG1-CG 4.24Å; L69-L71 PolarHBondContact O-N 2.98Å; L71-S106 VanDerWaalsContact O-CB 3.27Å; L71-S106 WeakPolarHBondContact O-CB 3.49Å; L71-A110 HydrophobicContact CD1-CB 3.45Å; L71-A110 VanDerWaalsContact CD1-CB 3.45Å; L71-L113 HydrophobicContact CD1-CD1 4.27Å; L71-L113 HydrophobicContact CD2-CD1 3.9Å
72	G	72.7	Confident	85.8	Confident	15 Å²	15	41.6 Å²	41.6	16%	0.155	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.3	-45.2	-179.6	0	0	0	0	0	114.3	R265	G72-R265 VanDerWaalsContact O-CZ 3.29Å; G72-R265 PolarHBondContact O-NE 3.3Å; G72-R265 PolarHBondContact O-NH2 3Å
73	D	68	Low	86.1	Confident	37 Å²	37	41.1 Å²	41.1	20%	0.198	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-14.2	177.1	82.3	-3.3	0	0	0	114.2	W70 R75 R265	W70-D73 WeakPolarHBondContact CB-OD1 3.19Å; D73-R75 PolarHBondContact O-N 3.04Å; D73-R75 WeakPolarHBondContact OD1-CB 3.46Å; D73-R75 PolarHBondContact OD1-N 3.25Å; D73-R75 WeakPolarHBondContact OD2-CD 3.38Å; D73-R265 VanDerWaalsContact N-NH2 3.2Å
74	Q	69.9	Low	86.5	Confident	75 Å²	75	39.6 Å²	39.6	35%	0.35	20%	0.198	S	C	.	.			trans	56.9	24.9	178.3	-54.2	178	91.1	0	0	113.6	L69 W70	L69-Q74 HydrophobicContact CD1-CB 4.4Å; L69-Q74 WeakPolarHBondContact CD1-O 3.3Å; W70-Q74 WeakPolarHBondContact O-CA 3.19Å; W70-Q74 PolarHBondContact O-N 3.16Å
75	R	77.2	Confident	86.9	Confident	113 Å²	113	35.1 Å²	35.1	43%	0.426	18%	0.176	S	C	.	.			trans	-81.4	152.4	171.1	-70.3	-178.2	170.5	153.5	-3.9	110	W70 D73	W70-R75 PolarHBondContact N-O 3.38Å; D73-R75 PolarHBondContact O-N 3.04Å; D73-R75 WeakPolarHBondContact OD1-CB 3.46Å; D73-R75 PolarHBondContact OD1-N 3.25Å; D73-R75 WeakPolarHBondContact OD2-CD 3.38Å
76	L	82.8	Confident	87	Confident	32 Å²	32	35.5 Å²	35.5	17%	0.168	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	141	171.5	-65.3	178.5	0	0	0	109.7	I53 C58 W67 V68 L69 L162 I165	I53-L76 HydrophobicContact CD1-CD1 4.24Å; I53-L76 HydrophobicContact CD1-CD2 3.37Å; I53-L76 HydrophobicContact CD1-CG 4.41Å; I53-L76 HydrophobicContact CG1-CD2 4.3Å; C58-L76 HydrophobicContact CB-CD1 3.85Å; W67-L76 HydrophobicContact CE3-CB 4.15Å; W67-L76 HydrophobicContact CZ3-CB 4.03Å; V68-L76 WeakPolarHBondContact O-CA 3.32Å; L69-L76 HydrophobicContact CB-CD2 3.76Å; L69-L76 HydrophobicContact CD1-CD2 3.54Å; L69-L76 HydrophobicContact CD1-CG 4.25Å; L69-L76 HydrophobicContact CG-CD2 4.25Å; L76-L162 HydrophobicContact CD1-CD2 4.48Å; L76-L162 HydrophobicContact CD2-CD2 4.26Å; L76-I165 HydrophobicContact CD1-CD1 3.59Å; L76-I165 HydrophobicContact CD1-CG2 3.98Å; L76-I165 HydrophobicContact CG-CD1 3.89Å
77	S	86.4	Confident	87.1	Confident	25 Å²	25	35.5 Å²	35.5	18%	0.175	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	149.5	168.4	-55.8	0	0	0	0	110.9	V68 W70	V68-S77 PolarHBondContact N-O 2.92Å; V68-S77 PolarHBondContact O-N 3.07Å; W70-S77 VanDerWaalsContact NE1-CB 3.32Å; W70-S77 PolarHBondContact NE1-OG 3.41Å
78	D	89.6	Confident	87.2	Confident	61 Å²	61	36.7 Å²	36.7	33%	0.326	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.2	168.6	68	-52.5	0	0	0	110.2	R65 W67	R65-D78 HydrophobicContact CB-CB 4.08Å; R65-D78 WeakPolarHBondContact CD-OD2 3.5Å; R65-D78 IonicContact CZ-OD2 3.05Å; R65-D78 PolarHBondContact NE-O 3.32Å; R65-D78 IonicContact NE-OD2 2.83Å; R65-D78 PolarHBondContact NE-OD2 3.4Å; R65-D78 PolarHBondContact NH2-O 3.5Å; W67-D78 HydrophobicContact CD2-CB 4.24Å; W67-D78 HydrophobicContact CG-CB 4.47Å; W67-D78 HydrophobicContact CZ2-CB 4.19Å
79	V	91.9	Very high	87.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.1	-174.3	-173.3	0	0	0	0	109.3	A39 R40 R65 V66 V68 W70 Q83 M84	A39-V79 HydrophobicContact CB-CG1 4.23Å; A39-V79 HydrophobicContact CB-CG2 4.35Å; R40-V79 WeakPolarHBondContact O-CG1 3.42Å; R65-V79 WeakPolarHBondContact CB-O 3.44Å; V66-V79 PolarHBondContact N-O 3.18Å; V66-V79 PolarHBondContact O-N 2.69Å; V68-V79 HydrophobicContact CB-CG2 4.29Å; V68-V79 HydrophobicContact CG2-CB 4.31Å; V68-V79 HydrophobicContact CG2-CG2 4Å; W70-V79 HydrophobicContact CH2-CG2 4Å; W70-V79 HydrophobicContact CZ2-CG2 3.79Å; V79-Q83 HydrophobicContact CG1-CB 3.97Å; V79-M84 HydrophobicContact CB-CG 4.16Å; V79-M84 HydrophobicContact CB-SD 4Å; V79-M84 HydrophobicContact CG1-CG 3.63Å; V79-M84 HydrophobicContact CG1-SD 4.12Å
80	E	90.1	Very high	87.3	Confident	78 Å²	78	44.7 Å²	44.7	36%	0.364	23%	0.227	S	C	.	.			trans	-68.8	135.3	173	-165	-174.2	152.9	0	0	109.6	S82 Q83	E80-S82 WeakPolarHBondContact CG-OG 3.48Å; E80-S82 PolarHBondContact O-N 3.09Å; E80-S82 PolarHBondContact OE1-OG 3.09Å; E80-S82 PolarHBondContact OE2-OG 3.41Å; E80-Q83 HydrophobicContact CB-CG 4.18Å; E80-Q83 WeakPolarHBondContact O-CA 3.4Å; E80-Q83 PolarHBondContact O-N 3.02Å
81	P	92.2	Very high	87.6	Confident	29 Å²	29	44.4 Å²	44.4	19%	0.188	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-53.8	-28.6	178.3	-27.9	33.8	0	0	0	114.4	F31 V66 Q83 M84	F31-P81 HydrophobicContact CE2-CB 4.33Å; V66-P81 HydrophobicContact CG2-CG 4.02Å; P81-Q83 PolarHBondContact O-N 3.11Å; P81-M84 PolarHBondContact O-N 3.47Å
82	S	90.9	Very high	88.1	Confident	69 Å²	69	49 Å²	49	48%	0.483	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-69.4	-18.3	176.6	68.7	0	0	0	0	113.8	E80	E80-S82 WeakPolarHBondContact CG-OG 3.48Å; E80-S82 PolarHBondContact O-N 3.09Å; E80-S82 PolarHBondContact OE1-OG 3.09Å; E80-S82 PolarHBondContact OE2-OG 3.41Å
83	Q	93.2	Very high	88.9	Confident	37 Å²	37	51.9 Å²	51.9	17%	0.173	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-103	24.8	178.2	-52.9	-51.4	-48.9	0	0	111.7	A39 R40 W47 V79 E80 P81	A39-Q83 WeakPolarHBondContact CA-O 3.48Å; R40-Q83 HydrophobicContact CG-CB 3.94Å; R40-Q83 PolarHBondContact N-O 2.74Å; R40-Q83 VanDerWaalsContact N-O 3.08Å; R40-Q83 WeakPolarHBondContact O-CB 3.3Å; W47-Q83 WeakPolarHBondContact CZ3-O 3.5Å; V79-Q83 HydrophobicContact CG1-CB 3.97Å; E80-Q83 HydrophobicContact CB-CG 4.18Å; E80-Q83 WeakPolarHBondContact O-CA 3.4Å; E80-Q83 PolarHBondContact O-N 3.02Å; P81-Q83 PolarHBondContact O-N 3.11Å
84	M	95.6	Very high	90.1	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.049	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.7	-179	-61.2	175.1	68.4	0	0	110.7	F31 V37 W38 A39 V52 V66 V68 V79 P81	F31-M84 HydrophobicContact CD2-CB 4.47Å; F31-M84 HydrophobicContact CD2-CE 4.14Å; F31-M84 HydrophobicContact CD2-SD 4.28Å; F31-M84 HydrophobicContact CE1-CB 4.23Å; F31-M84 HydrophobicContact CE2-CB 3.6Å; F31-M84 HydrophobicContact CE2-CE 4.34Å; F31-M84 HydrophobicContact CE2-CG 4.48Å; F31-M84 HydrophobicContact CE2-SD 4.2Å; F31-M84 HydrophobicContact CG-CE 4.27Å; F31-M84 HydrophobicContact CZ-CB 3.45Å; F31-M84 VanDerWaalsContact CZ-CB 3.45Å; V37-M84 HydrophobicContact CB-CE 4.47Å; V37-M84 HydrophobicContact CG1-CE 4.41Å; V37-M84 HydrophobicContact CG2-CE 3.94Å; W38-M84 CarbonylContact O-C 3.52Å; W38-M84 VanDerWaalsContact O-CA 3.23Å; W38-M84 WeakPolarHBondContact O-CA 3.43Å; A39-M84 HydrophobicContact CB-CG 4.09Å; V52-M84 HydrophobicContact CG2-CE 3.8Å; V66-M84 HydrophobicContact CB-CE 4.11Å; V66-M84 HydrophobicContact CB-SD 3.74Å; V66-M84 HydrophobicContact CG1-CE 3.77Å; V66-M84 HydrophobicContact CG1-SD 4.1Å; V66-M84 HydrophobicContact CG2-SD 4.33Å; V68-M84 HydrophobicContact CG2-CE 3.59Å; V68-M84 HydrophobicContact CG2-SD 4.31Å; V79-M84 HydrophobicContact CB-CG 4.16Å; V79-M84 HydrophobicContact CB-SD 4Å; V79-M84 HydrophobicContact CG1-CG 3.63Å; V79-M84 HydrophobicContact CG1-SD 4.12Å; P81-M84 PolarHBondContact O-N 3.47Å
85	K	95.6	Very high	91.1	Very high	44 Å²	44	47.7 Å²	47.7	19%	0.191	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.2	173.5	-61.7	-172.2	179.5	-171.7	0	109.6	V37 W38 W47 E89 D90	V37-K85 CarbonylContact C-O 3.5Å; V37-K85 WeakPolarHBondContact CA-O 3.3Å; V37-K85 WeakPolarHBondContact CB-O 3.47Å; W38-K85 HydrophobicContact CB-CB 4.33Å; W38-K85 PolarHBondContact N-O 2.69Å; W38-K85 PolarHBondContact O-N 3.21Å; W47-K85 HydrophobicContact CH2-CD 4.35Å; W47-K85 HydrophobicContact CH2-CG 4.1Å; W47-K85 HydrophobicContact CZ3-CG 4.23Å; K85-E89 HydrophobicContact CB-CB 4.3Å; K85-E89 HydrophobicContact CB-CG 4.41Å; K85-E89 HydrophobicContact CD-CG 4.49Å; K85-D90 HydrophobicContact CD-CB 4.22Å; K85-D90 IonicContact NZ-OD2 2.8Å; K85-D90 PolarHBondContact NZ-OD2 3.2Å
86	Y	95.3	Very high	91.5	Very high	72 Å²	72	47.6 Å²	47.6	28%	0.282	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	149	170.9	-71.9	-78.8	0	0	0	110.8	P30 F31 D35 V88 E89	P30-Y86 PolarHBondContact O-OH 2.96Å; F31-Y86 HydrophobicContact CD1-CE1 4.22Å; F31-Y86 HydrophobicContact CD1-CE2 4.44Å; F31-Y86 HydrophobicContact CE1-CD2 4.39Å; F31-Y86 HydrophobicContact CE1-CE2 4.21Å; D35-Y86 HydrophobicContact CB-CE1 4.24Å; D35-Y86 WeakPolarHBondContact OD2-CE1 3.47Å; Y86-V88 PolarHBondContact O-N 3.07Å; Y86-E89 PolarHBondContact N-OE2 3.36Å; Y86-E89 VanDerWaalsContact N-OE2 3.15Å; Y86-E89 WeakPolarHBondContact O-CB 3.2Å; Y86-E89 PolarHBondContact O-N 3.09Å
87	I	95.2	Very high	91.5	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.1	-172.8	-165.9	67	0	0	0	113.8	V36 W38 P49 F91 A110 L111 F114	V36-I87 HydrophobicContact CB-CB 4.24Å; V36-I87 HydrophobicContact CB-CG2 4.04Å; V36-I87 HydrophobicContact CG1-CB 3.9Å; V36-I87 HydrophobicContact CG1-CD1 4.37Å; V36-I87 HydrophobicContact CG1-CG1 4.04Å; V36-I87 HydrophobicContact CG1-CG2 4.06Å; V36-I87 WeakPolarHBondContact O-CB 3.47Å; V36-I87 PolarHBondContact O-N 3.47Å; W38-I87 HydrophobicContact CD2-CD1 3.88Å; W38-I87 HydrophobicContact CE3-CD1 4.43Å; W38-I87 HydrophobicContact CG-CD1 4.22Å; W38-I87 HydrophobicContact CZ2-CD1 3.99Å; W38-I87 PolarHBondContact NE1-O 3.49Å; P49-I87 HydrophobicContact CB-CD1 3.89Å; I87-F91 VanDerWaalsContact O-CD2 3.31Å; I87-F91 WeakPolarHBondContact O-CD2 3.11Å; I87-A110 HydrophobicContact CD1-CB 3.77Å; I87-A110 HydrophobicContact CG1-CB 3.96Å; I87-L111 HydrophobicContact CG1-CD2 4.24Å; I87-F114 HydrophobicContact CG2-CB 3.89Å; I87-F114 HydrophobicContact CG2-CD1 4.5Å; I87-F114 HydrophobicContact CG2-CD2 3.61Å; I87-F114 HydrophobicContact CG2-CE2 4.24Å; I87-F114 HydrophobicContact CG2-CG 3.75Å
88	V	93.3	Very high	91.2	Very high	44 Å²	44	61.1 Å²	61.1	27%	0.267	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-7.2	177.6	-61.5	0	0	0	0	113.8	Y86 F114 F134	Y86-V88 PolarHBondContact O-N 3.07Å; V88-F114 HydrophobicContact CB-CZ 4.48Å; V88-F114 HydrophobicContact CG1-CD1 3.95Å; V88-F114 HydrophobicContact CG1-CE1 3.48Å; V88-F114 VanDerWaalsContact CG1-CE1 3.48Å; V88-F114 HydrophobicContact CG1-CE2 4.24Å; V88-F114 HydrophobicContact CG1-CZ 3.63Å; V88-F114 HydrophobicContact CG2-CE2 4.4Å; V88-F114 HydrophobicContact CG2-CZ 3.98Å; V88-F134 HydrophobicContact CB-CE2 4.28Å; V88-F134 HydrophobicContact CG1-CE2 3.81Å; V88-F134 HydrophobicContact CG1-CZ 4.37Å
89	E	91.6	Very high	90.5	Very high	85 Å²	85	59.1 Å²	59.1	40%	0.397	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	130.4	-179.6	-176.8	-175.3	176	0	0	110.4	K85 Y86 F91	K85-E89 HydrophobicContact CB-CB 4.3Å; K85-E89 HydrophobicContact CB-CG 4.41Å; K85-E89 HydrophobicContact CD-CG 4.49Å; Y86-E89 PolarHBondContact N-OE2 3.36Å; Y86-E89 VanDerWaalsContact N-OE2 3.15Å; Y86-E89 WeakPolarHBondContact O-CB 3.2Å; Y86-E89 PolarHBondContact O-N 3.09Å; E89-F91 PolarHBondContact O-N 2.91Å; E89-F91 VanDerWaalsContact O-N 3.08Å
90	D	91.1	Very high	89.7	Confident	90 Å²	90	61.7 Å²	61.7	48%	0.481	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.6	39.6	-179.3	-66.9	-22	0	0	0	113.5	K85 N92 A93 C94	K85-D90 HydrophobicContact CD-CB 4.22Å; K85-D90 IonicContact NZ-OD2 2.8Å; K85-D90 PolarHBondContact NZ-OD2 3.2Å; D90-N92 VanDerWaalsContact C-N 3.3Å; D90-N92 PolarHBondContact O-N 2.95Å; D90-A93 HydrophobicContact CB-CB 4.23Å; D90-A93 WeakPolarHBondContact O-CB 3.42Å; D90-A93 PolarHBondContact O-N 2.83Å; D90-C94 PolarHBondContact O-N 3.15Å; D90-C94 VanDerWaalsContact O-N 3.08Å; D90-C94 PolarHBondContact O-SG 3.09Å
91	F	94.4	Very high	89	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.035	32%	0.324	C	S	.	.	H	α-helix	trans	-51.7	-47	-171.6	-169.3	-83.7	0	0	0	112.3	W38 I87 E89 A93 C94 F95 V107 L111 V127 A130 L131	W38-F91 AromaticContact CZ2-CD2 3.92Å; W38-F91 HydrophobicContact CZ2-CD2 3.92Å; W38-F91 AromaticContact CZ2-CE2 3.65Å; W38-F91 HydrophobicContact CZ2-CE2 3.65Å; W38-F91 HydrophobicContact CZ2-CZ 4.13Å; I87-F91 VanDerWaalsContact O-CD2 3.31Å; I87-F91 WeakPolarHBondContact O-CD2 3.11Å; E89-F91 PolarHBondContact O-N 2.91Å; E89-F91 VanDerWaalsContact O-N 3.08Å; F91-A93 VanDerWaalsContact C-N 3.26Å; F91-A93 PolarHBondContact O-N 3.24Å; F91-C94 PolarHBondContact O-N 3.44Å; F91-F95 HydrophobicContact CD1-CB 3.97Å; F91-F95 HydrophobicContact CD1-CG 4.45Å; F91-F95 HydrophobicContact CE1-CB 3.77Å; F91-F95 AromaticContact CE1-CD2 3.78Å; F91-F95 HydrophobicContact CE1-CD2 3.78Å; F91-F95 AromaticContact CE1-CG 3.79Å; F91-F95 HydrophobicContact CE1-CG 3.79Å; F91-F95 HydrophobicContact CZ-CB 4.47Å; F91-F95 AromaticContact CZ-CD2 3.94Å; F91-F95 HydrophobicContact CZ-CD2 3.94Å; F91-F95 HydrophobicContact CZ-CG 4.4Å; F91-F95 WeakPolarHBondContact O-CB 3.45Å; F91-F95 PolarHBondContact O-N 3.05Å; F91-V107 HydrophobicContact CE2-CG1 4.01Å; F91-V107 HydrophobicContact CZ-CG1 3.65Å; F91-L111 HydrophobicContact CE2-CD1 3.89Å; F91-L111 HydrophobicContact CE2-CD2 4.01Å; F91-L111 HydrophobicContact CE2-CG 4.25Å; F91-L111 HydrophobicContact CZ-CD1 4.01Å; F91-V127 HydrophobicContact CE1-CG1 4.42Å; F91-V127 HydrophobicContact CZ-CG1 4.33Å; F91-A130 HydrophobicContact CD1-CB 3.89Å; F91-A130 HydrophobicContact CD2-CB 3.77Å; F91-A130 HydrophobicContact CE1-CB 3.85Å; F91-A130 HydrophobicContact CE2-CB 3.73Å; F91-A130 HydrophobicContact CG-CB 3.87Å; F91-A130 HydrophobicContact CZ-CB 3.77Å; F91-L131 HydrophobicContact CD1-CD2 3.86Å; F91-L131 HydrophobicContact CD1-CG 4.1Å; F91-L131 HydrophobicContact CE1-CD2 3.88Å; F91-L131 HydrophobicContact CE1-CG 3.83Å
92	N	92.4	Very high	88.1	Confident	105 Å²	105	61.6 Å²	61.6	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-60.5	-30	178	-79.4	-70.4	0	0	0	114	D90 L131	D90-N92 VanDerWaalsContact C-N 3.3Å; D90-N92 PolarHBondContact O-N 2.95Å; N92-L131 PolarHBondContact ND2-O 3.18Å; N92-L131 VanDerWaalsContact OD1-CD2 3.23Å; N92-L131 WeakPolarHBondContact OD1-CD2 3.45Å; N92-L131 PolarHBondContact OD1-O 2.74Å
93	A	90	Very high	87.6	Confident	76 Å²	76	58.4 Å²	58.4	63%	0.628	30%	0.303	S	S	*	.	H	α-helix	trans	-84.2	-28.3	179.3	0	0	0	0	0	112.4	D90 F91	D90-A93 HydrophobicContact CB-CB 4.23Å; D90-A93 WeakPolarHBondContact O-CB 3.42Å; D90-A93 PolarHBondContact O-N 2.83Å; F91-A93 VanDerWaalsContact C-N 3.26Å; F91-A93 PolarHBondContact O-N 3.24Å
94	C	92.9	Very high	87.1	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-85.2	-35	177.3	-58.1	0	0	0	0	111.8	W38 W47 D90 F91 Y103	W38-C94 HydrophobicContact CB-CB 4.34Å; W38-C94 HydrophobicContact CD2-CB 3.6Å; W38-C94 HydrophobicContact CE3-CB 4.13Å; W38-C94 HydrophobicContact CG-CB 3.68Å; W38-C94 HydrophobicContact CZ2-CB 4.32Å; W47-C94 HydrophobicContact CB-CB 4Å; W47-C94 HydrophobicContact CD2-CB 4.48Å; W47-C94 HydrophobicContact CG-CB 3.98Å; D90-C94 PolarHBondContact O-N 3.15Å; D90-C94 VanDerWaalsContact O-N 3.08Å; D90-C94 PolarHBondContact O-SG 3.09Å; F91-C94 PolarHBondContact O-N 3.44Å; C94-Y103 PolarHBondContact O-OH 2.9Å
95	F	91.2	Very high	86.5	Confident	20 Å²	20	61.6 Å²	61.6	9%	0.088	32%	0.319	C	S	.	.			trans	-73.2	134.5	-174.2	-175.7	-99.6	0	0	0	113.3	W38 F91 N97 Y103 H104 V107 V127 L131	W38-F95 HydrophobicContact CH2-CD2 4.33Å; F91-F95 HydrophobicContact CD1-CB 3.97Å; F91-F95 HydrophobicContact CD1-CG 4.45Å; F91-F95 HydrophobicContact CE1-CB 3.77Å; F91-F95 AromaticContact CE1-CD2 3.78Å; F91-F95 HydrophobicContact CE1-CD2 3.78Å; F91-F95 AromaticContact CE1-CG 3.79Å; F91-F95 HydrophobicContact CE1-CG 3.79Å; F91-F95 HydrophobicContact CZ-CB 4.47Å; F91-F95 AromaticContact CZ-CD2 3.94Å; F91-F95 HydrophobicContact CZ-CD2 3.94Å; F91-F95 HydrophobicContact CZ-CG 4.4Å; F91-F95 WeakPolarHBondContact O-CB 3.45Å; F91-F95 PolarHBondContact O-N 3.05Å; F95-N97 WeakPolarHBondContact CD1-OD1 3.47Å; F95-N97 VanDerWaalsContact CE1-OD1 3.23Å; F95-N97 WeakPolarHBondContact CE1-OD1 3.34Å; F95-Y103 WeakPolarHBondContact CA-OH 3.39Å; F95-Y103 HydrophobicContact CD2-CE1 4.15Å; F95-Y103 HydrophobicContact CE2-CE1 4.1Å; F95-H104 AromaticContact CE2-ND1 3.6Å; F95-H104 AromaticContact CZ-CE1 3.44Å; F95-H104 VanDerWaalsContact CZ-CE1 3.44Å; F95-H104 WeakPolarHBondContact CZ-CE1 3.45Å; F95-H104 AromaticContact CZ-ND1 3.27Å; F95-H104 VanDerWaalsContact CZ-ND1 3.27Å; F95-H104 WeakPolarHBondContact CZ-ND1 3.27Å; F95-V107 HydrophobicContact CD2-CG1 4Å; F95-V107 HydrophobicContact CD2-CG2 4.38Å; F95-V107 HydrophobicContact CE2-CB 4.4Å; F95-V107 HydrophobicContact CE2-CG1 4.04Å; F95-V107 HydrophobicContact CE2-CG2 4.41Å; F95-V127 HydrophobicContact CD2-CG1 4.49Å; F95-V127 HydrophobicContact CE2-CG1 3.7Å; F95-V127 HydrophobicContact CZ-CG1 3.71Å; F95-L131 HydrophobicContact CB-CD2 4.27Å; F95-L131 HydrophobicContact CD1-CD1 4.19Å; F95-L131 HydrophobicContact CD1-CD2 3.66Å; F95-L131 HydrophobicContact CD1-CG 4.37Å; F95-L131 HydrophobicContact CE1-CD1 3.91Å; F95-L131 HydrophobicContact CE1-CD2 4.24Å; F95-L131 HydrophobicContact CG-CD2 4.12Å
96	R	87	Confident	86.1	Confident	111 Å²	111	59.6 Å²	59.6	42%	0.419	31%	0.311	S	S	.	.			trans	-102.4	110.6	174.2	-69.8	-179.5	56.5	-179.5	-6	111.9	V46 R98 G99 Y103 H104	V46-R96 VanDerWaalsContact CG2-NH1 3.31Å; R96-R98 VanDerWaalsContact C-N 3.25Å; R96-R98 PolarHBondContact NH2-O 3.47Å; R96-R98 PolarHBondContact O-N 2.8Å; R96-G99 PolarHBondContact O-N 2.94Å; R96-G99 VanDerWaalsContact O-N 3.12Å; R96-Y103 HydrophobicContact CB-CE1 3.86Å; R96-Y103 PolarHBondContact N-OH 3.28Å; R96-Y103 VanDerWaalsContact N-OH 3.14Å; R96-H104 PolarHBondContact O-CE1 3.01Å
97	N	82.2	Confident	85.8	Confident	125 Å²	125	56.2 Å²	56.2	67%	0.668	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-39.6	170.5	-69.5	-17.9	0	0	0	112.3	F95 G99 H104	F95-N97 WeakPolarHBondContact CD1-OD1 3.47Å; F95-N97 VanDerWaalsContact CE1-OD1 3.23Å; F95-N97 WeakPolarHBondContact CE1-OD1 3.34Å; N97-G99 VanDerWaalsContact C-N 3.3Å; N97-G99 PolarHBondContact O-N 2.86Å; N97-H104 PolarHBondContact O-NE2 3.1Å
98	R	80.5	Confident	85.5	Confident	217 Å²	217	58.3 Å²	58.3	82%	0.819	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	42.6	176.2	-59.6	-175.9	-177.4	-179.6	0	112.2	R96	R96-R98 VanDerWaalsContact C-N 3.25Å; R96-R98 PolarHBondContact NH2-O 3.47Å; R96-R98 PolarHBondContact O-N 2.8Å
99	G	73.7	Confident	85.2	Confident	19 Å²	19	56.9 Å²	56.9	20%	0.196	30%	0.296	C	S	.	.			trans	-78.9	162.3	170.2	0	0	0	0	0	112.3	R96 N97 H104	R96-G99 PolarHBondContact O-N 2.94Å; R96-G99 VanDerWaalsContact O-N 3.12Å; N97-G99 VanDerWaalsContact C-N 3.3Å; N97-G99 PolarHBondContact O-N 2.86Å; G99-H104 PolarHBondContact O-NE2 2.97Å
100	S	75	Confident	85.2	Confident	54 Å²	54	52.9 Å²	52.9	38%	0.378	28%	0.277	S	S	.	.			trans	-66.7	160.9	168.7	57.7	0	0	0	0	110.9	S102 Y103 H104	S100-S102 VanDerWaalsContact C-N 3.27Å; S100-S102 PolarHBondContact O-N 3.15Å; S100-S102 PolarHBondContact OG-OG 3.4Å; S100-Y103 WeakPolarHBondContact O-CB 3.24Å; S100-Y103 PolarHBondContact O-N 3.34Å; S100-Y103 WeakPolarHBondContact OG-CB 3.48Å; S100-Y103 PolarHBondContact OG-N 3.48Å; S100-Y103 VanDerWaalsContact OG-N 3.15Å; S100-H104 PolarHBondContact O-CD2 2.96Å; S100-H104 PolarHBondContact O-N 2.89Å
101	P	75.3	Confident	85.2	Confident	75 Å²	75	48.6 Å²	48.6	49%	0.487	25%	0.254	S	S	.	.	H	α-helix	trans	-51.9	-46.5	171.3	-27.5	35.6	0	0	0	112.3	Y103 H104 D105 E269	P101-Y103 VanDerWaalsContact C-N 3.31Å; P101-Y103 PolarHBondContact O-N 2.77Å; P101-H104 PolarHBondContact O-N 2.86Å; P101-H104 VanDerWaalsContact O-N 3.1Å; P101-D105 PolarHBondContact O-N 2.84Å; P101-E269 WeakPolarHBondContact CB-OE1 3.47Å
102	S	72.9	Confident	85	Confident	30 Å²	30	50.2 Å²	50.2	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-34.9	175.6	59	0	0	0	0	114.7	S100 S106	S100-S102 VanDerWaalsContact C-N 3.27Å; S100-S102 PolarHBondContact O-N 3.15Å; S100-S102 PolarHBondContact OG-OG 3.4Å; S102-S106 WeakPolarHBondContact O-CB 3.34Å; S102-S106 PolarHBondContact O-N 2.9Å; S102-S106 PolarHBondContact O-OG 3.33Å
103	Y	80.5	Confident	84.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-51.5	173.2	168.8	-92	0	0	0	109.6	W38 W47 W48 C94 F95 R96 S100 P101 D105 S106 V107	W38-Y103 WeakPolarHBondContact CH2-OH 3.31Å; W38-Y103 HydrophobicContact CZ3-CE2 4.33Å; W38-Y103 WeakPolarHBondContact CZ3-OH 3.45Å; W47-Y103 WeakPolarHBondContact O-CE2 3.48Å; W48-Y103 HydrophobicContact CD2-CD2 4.13Å; W48-Y103 AromaticContact CE3-CD2 3.6Å; W48-Y103 HydrophobicContact CE3-CD2 3.6Å; W48-Y103 HydrophobicContact CE3-CE2 4.27Å; W48-Y103 HydrophobicContact CH2-CD2 4.05Å; W48-Y103 HydrophobicContact CH2-CG 4.41Å; W48-Y103 AromaticContact CZ3-CD2 3.57Å; W48-Y103 HydrophobicContact CZ3-CD2 3.57Å; W48-Y103 HydrophobicContact CZ3-CG 4.22Å; C94-Y103 PolarHBondContact O-OH 2.9Å; F95-Y103 WeakPolarHBondContact CA-OH 3.39Å; F95-Y103 HydrophobicContact CD2-CE1 4.15Å; F95-Y103 HydrophobicContact CE2-CE1 4.1Å; R96-Y103 HydrophobicContact CB-CE1 3.86Å; R96-Y103 PolarHBondContact N-OH 3.28Å; R96-Y103 VanDerWaalsContact N-OH 3.14Å; S100-Y103 WeakPolarHBondContact O-CB 3.24Å; S100-Y103 PolarHBondContact O-N 3.34Å; S100-Y103 WeakPolarHBondContact OG-CB 3.48Å; S100-Y103 PolarHBondContact OG-N 3.48Å; S100-Y103 VanDerWaalsContact OG-N 3.15Å; P101-Y103 VanDerWaalsContact C-N 3.31Å; P101-Y103 PolarHBondContact O-N 2.77Å; Y103-D105 VanDerWaalsContact C-N 3.31Å; Y103-D105 PolarHBondContact O-N 2.78Å; Y103-S106 PolarHBondContact O-N 3.43Å; Y103-S106 VanDerWaalsContact O-N 3.11Å; Y103-S106 PolarHBondContact O-OG 3.42Å; Y103-V107 HydrophobicContact CD1-CG2 4.38Å; Y103-V107 HydrophobicContact CE1-CG2 3.93Å; Y103-V107 HydrophobicContact CE2-CG2 4.2Å; Y103-V107 WeakPolarHBondContact O-CG2 3.38Å; Y103-V107 PolarHBondContact O-N 2.69Å
104	H	83.6	Confident	84.7	Confident	58 Å²	58	42.3 Å²	42.3	27%	0.269	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-40.8	179.6	-70.4	-61.2	0	0	0	112.3	F95 R96 N97 G99 S100 P101 V107 R108	F95-H104 AromaticContact CE2-ND1 3.6Å; F95-H104 AromaticContact CZ-CE1 3.44Å; F95-H104 VanDerWaalsContact CZ-CE1 3.44Å; F95-H104 WeakPolarHBondContact CZ-CE1 3.45Å; F95-H104 AromaticContact CZ-ND1 3.27Å; F95-H104 VanDerWaalsContact CZ-ND1 3.27Å; F95-H104 WeakPolarHBondContact CZ-ND1 3.27Å; R96-H104 PolarHBondContact O-CE1 3.01Å; N97-H104 PolarHBondContact O-NE2 3.1Å; G99-H104 PolarHBondContact O-NE2 2.97Å; S100-H104 PolarHBondContact O-CD2 2.96Å; S100-H104 PolarHBondContact O-N 2.89Å; P101-H104 PolarHBondContact O-N 2.86Å; P101-H104 VanDerWaalsContact O-N 3.1Å; H104-V107 PolarHBondContact O-N 2.83Å; H104-R108 PolarHBondContact O-N 3.1Å
105	D	83.1	Confident	84.6	Confident	56 Å²	56	42.2 Å²	42.2	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	-61.8	-43.5	173.6	-88.2	-38.7	0	0	0	112.6	P101 Y103 V107 R108 I109	P101-D105 PolarHBondContact O-N 2.84Å; Y103-D105 VanDerWaalsContact C-N 3.31Å; Y103-D105 PolarHBondContact O-N 2.78Å; D105-V107 VanDerWaalsContact C-N 3.26Å; D105-V107 PolarHBondContact O-N 3.09Å; D105-R108 PolarHBondContact O-N 3.17Å; D105-R108 IonicContact OD1-CZ 2.65Å; D105-R108 IonicContact OD1-NE 3.57Å; D105-R108 IonicContact OD1-NH2 3.09Å; D105-R108 PolarHBondContact OD1-NH2 3Å; D105-R108 VanDerWaalsContact OD1-NH2 3.07Å; D105-I109 VanDerWaalsContact O-CG1 3.3Å; D105-I109 WeakPolarHBondContact O-CG1 3.33Å; D105-I109 PolarHBondContact O-N 3.34Å
106	S	86.4	Confident	84.2	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-36	177.2	73.1	0	0	0	0	112.3	P49 L71 S102 Y103 A110	P49-S106 WeakPolarHBondContact CG-OG 3.16Å; L71-S106 VanDerWaalsContact O-CB 3.27Å; L71-S106 WeakPolarHBondContact O-CB 3.49Å; S102-S106 WeakPolarHBondContact O-CB 3.34Å; S102-S106 PolarHBondContact O-N 2.9Å; S102-S106 PolarHBondContact O-OG 3.33Å; Y103-S106 PolarHBondContact O-N 3.43Å; Y103-S106 VanDerWaalsContact O-N 3.11Å; Y103-S106 PolarHBondContact O-OG 3.42Å; S106-A110 WeakPolarHBondContact O-CB 3.14Å; S106-A110 PolarHBondContact O-N 2.89Å
107	V	89.6	Confident	84	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-70.6	-43.3	177.5	177.6	0	0	0	0	110.9	W38 P49 F91 F95 Y103 H104 D105 I109 A110 L111 V127	W38-V107 HydrophobicContact CH2-CB 4.28Å; W38-V107 HydrophobicContact CH2-CG1 3.8Å; W38-V107 HydrophobicContact CH2-CG2 3.44Å; W38-V107 VanDerWaalsContact CH2-CG2 3.44Å; W38-V107 HydrophobicContact CZ2-CG1 4.1Å; W38-V107 HydrophobicContact CZ2-CG2 4.49Å; W38-V107 HydrophobicContact CZ3-CG2 3.89Å; P49-V107 HydrophobicContact CG-CG2 3.97Å; F91-V107 HydrophobicContact CE2-CG1 4.01Å; F91-V107 HydrophobicContact CZ-CG1 3.65Å; F95-V107 HydrophobicContact CD2-CG1 4Å; F95-V107 HydrophobicContact CD2-CG2 4.38Å; F95-V107 HydrophobicContact CE2-CB 4.4Å; F95-V107 HydrophobicContact CE2-CG1 4.04Å; F95-V107 HydrophobicContact CE2-CG2 4.41Å; Y103-V107 HydrophobicContact CD1-CG2 4.38Å; Y103-V107 HydrophobicContact CE1-CG2 3.93Å; Y103-V107 HydrophobicContact CE2-CG2 4.2Å; Y103-V107 WeakPolarHBondContact O-CG2 3.38Å; Y103-V107 PolarHBondContact O-N 2.69Å; H104-V107 PolarHBondContact O-N 2.83Å; D105-V107 VanDerWaalsContact C-N 3.26Å; D105-V107 PolarHBondContact O-N 3.09Å; V107-I109 PolarHBondContact O-N 3.48Å; V107-A110 WeakPolarHBondContact O-CB 3.43Å; V107-A110 PolarHBondContact O-N 3.49Å; V107-L111 PolarHBondContact O-N 3.5Å; V107-V127 HydrophobicContact CG1-CG2 4.34Å
108	R	89.2	Confident	84.2	Confident	45 Å²	45	36.4 Å²	36.4	17%	0.17	18%	0.184	C	C	.	.	H	α-helix	trans	-57.7	-49	174.3	179.4	-176.4	56.7	75.8	2.8	111	H104 D105 A110 L111 E112 P126 V127	H104-R108 PolarHBondContact O-N 3.1Å; D105-R108 PolarHBondContact O-N 3.17Å; D105-R108 IonicContact OD1-CZ 2.65Å; D105-R108 IonicContact OD1-NE 3.57Å; D105-R108 IonicContact OD1-NH2 3.09Å; D105-R108 PolarHBondContact OD1-NH2 3Å; D105-R108 VanDerWaalsContact OD1-NH2 3.07Å; R108-A110 VanDerWaalsContact C-N 3.29Å; R108-A110 PolarHBondContact O-N 3.06Å; R108-L111 PolarHBondContact O-N 3.01Å; R108-E112 WeakPolarHBondContact CG-OE1 3.07Å; R108-E112 IonicContact CZ-OE1 2.9Å; R108-E112 VanDerWaalsContact NH1-CD 3.32Å; R108-E112 IonicContact NH1-OE1 2.99Å; R108-E112 PolarHBondContact NH1-OE1 3.14Å; R108-E112 IonicContact NH1-OE2 3.3Å; R108-E112 PolarHBondContact NH1-OE2 2.76Å; R108-E112 VanDerWaalsContact NH1-OE2 3.17Å; R108-E112 WeakPolarHBondContact O-CG 3.2Å; R108-E112 PolarHBondContact O-N 2.9Å; R108-P126 HydrophobicContact CG-CG 4.34Å; R108-V127 HydrophobicContact CB-CG2 4.12Å
109	I	85.9	Confident	84.3	Confident	14 Å²	14	29.5 Å²	29.5	7%	0.072	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-40.3	177.5	-69.6	166.9	0	0	0	111.1	D105 V107 L111 E112 L113 L263	D105-I109 VanDerWaalsContact O-CG1 3.3Å; D105-I109 WeakPolarHBondContact O-CG1 3.33Å; D105-I109 PolarHBondContact O-N 3.34Å; V107-I109 PolarHBondContact O-N 3.48Å; I109-L111 VanDerWaalsContact C-N 3.33Å; I109-L111 PolarHBondContact O-N 2.92Å; I109-E112 PolarHBondContact O-N 3.35Å; I109-L113 HydrophobicContact CG2-CD1 3.73Å; I109-L113 HydrophobicContact CG2-CG 4.23Å; I109-L113 WeakPolarHBondContact O-CB 3.49Å; I109-L113 VanDerWaalsContact O-CG 3.23Å; I109-L113 WeakPolarHBondContact O-CG 3.17Å; I109-L113 PolarHBondContact O-N 3.23Å; I109-L263 HydrophobicContact CD1-CD1 4.16Å; I109-L263 HydrophobicContact CD1-CD2 3.68Å; I109-L263 HydrophobicContact CD1-CG 4.3Å
110	A	91.4	Very high	84.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-44.7	176.3	0	0	0	0	0	112	V36 P49 L71 I87 S106 V107 R108 L113 F114	V36-A110 HydrophobicContact CG1-CB 3.78Å; P49-A110 HydrophobicContact CB-CB 3.63Å; P49-A110 HydrophobicContact CG-CB 4.45Å; L71-A110 HydrophobicContact CD1-CB 3.45Å; L71-A110 VanDerWaalsContact CD1-CB 3.45Å; I87-A110 HydrophobicContact CD1-CB 3.77Å; I87-A110 HydrophobicContact CG1-CB 3.96Å; S106-A110 WeakPolarHBondContact O-CB 3.14Å; S106-A110 PolarHBondContact O-N 2.89Å; V107-A110 WeakPolarHBondContact O-CB 3.43Å; V107-A110 PolarHBondContact O-N 3.49Å; R108-A110 VanDerWaalsContact C-N 3.29Å; R108-A110 PolarHBondContact O-N 3.06Å; A110-L113 PolarHBondContact O-N 2.98Å; A110-F114 WeakPolarHBondContact O-CB 3.47Å; A110-F114 PolarHBondContact O-N 2.95Å
111	L	92.8	Very high	85.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-42.5	177.4	-67.6	171.9	0	0	0	112	I87 F91 V107 R108 I109 L113 F114 F115 P126 V127 A130 F134	I87-L111 HydrophobicContact CG1-CD2 4.24Å; F91-L111 HydrophobicContact CE2-CD1 3.89Å; F91-L111 HydrophobicContact CE2-CD2 4.01Å; F91-L111 HydrophobicContact CE2-CG 4.25Å; F91-L111 HydrophobicContact CZ-CD1 4.01Å; V107-L111 PolarHBondContact O-N 3.5Å; R108-L111 PolarHBondContact O-N 3.01Å; I109-L111 VanDerWaalsContact C-N 3.33Å; I109-L111 PolarHBondContact O-N 2.92Å; L111-L113 VanDerWaalsContact C-N 3.33Å; L111-L113 PolarHBondContact O-N 2.85Å; L111-F114 WeakPolarHBondContact O-CB 3.46Å; L111-F114 PolarHBondContact O-N 3.02Å; L111-F114 VanDerWaalsContact O-N 3.16Å; L111-F115 VanDerWaalsContact O-CD2 3.23Å; L111-F115 WeakPolarHBondContact O-CD2 3.49Å; L111-F115 PolarHBondContact O-N 3.09Å; L111-P126 HydrophobicContact CB-CB 3.9Å; L111-P126 HydrophobicContact CB-CG 4.29Å; L111-P126 HydrophobicContact CD1-CB 3.97Å; L111-P126 HydrophobicContact CD1-CG 4.48Å; L111-P126 WeakPolarHBondContact CD1-O 3.33Å; L111-V127 HydrophobicContact CD1-CB 4.45Å; L111-V127 HydrophobicContact CD1-CG2 3.94Å; L111-A130 HydrophobicContact CD1-CB 4.02Å; L111-A130 HydrophobicContact CD2-CB 4.42Å; L111-F134 HydrophobicContact CD2-CZ 4.45Å
112	E	89.2	Confident	86.1	Confident	42 Å²	42	32 Å²	32	20%	0.196	19%	0.192	C	C	.	.	H	α-helix	trans	-58.2	-45.4	175.2	-73.4	169.4	-175.1	0	0	111.4	R108 I109 F115 M116	R108-E112 WeakPolarHBondContact CG-OE1 3.07Å; R108-E112 IonicContact CZ-OE1 2.9Å; R108-E112 VanDerWaalsContact NH1-CD 3.32Å; R108-E112 IonicContact NH1-OE1 2.99Å; R108-E112 PolarHBondContact NH1-OE1 3.14Å; R108-E112 IonicContact NH1-OE2 3.3Å; R108-E112 PolarHBondContact NH1-OE2 2.76Å; R108-E112 VanDerWaalsContact NH1-OE2 3.17Å; R108-E112 WeakPolarHBondContact O-CG 3.2Å; R108-E112 PolarHBondContact O-N 2.9Å; I109-E112 PolarHBondContact O-N 3.35Å; E112-F115 PolarHBondContact O-N 2.69Å; E112-M116 VanDerWaalsContact O-CB 3.29Å; E112-M116 WeakPolarHBondContact O-CB 3.42Å; E112-M116 PolarHBondContact O-N 3.44Å
113	L	86.6	Confident	86.7	Confident	11 Å²	11	31.8 Å²	31.8	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-39.9	175.2	-70.1	171.7	0	0	0	111.8	V36 I51 L71 I109 A110 L111 M116 Q117 P155 F157	V36-L113 HydrophobicContact CG2-CB 4.36Å; I51-L113 HydrophobicContact CD1-CD1 3.73Å; L71-L113 HydrophobicContact CD1-CD1 4.27Å; L71-L113 HydrophobicContact CD2-CD1 3.9Å; I109-L113 HydrophobicContact CG2-CD1 3.73Å; I109-L113 HydrophobicContact CG2-CG 4.23Å; I109-L113 WeakPolarHBondContact O-CB 3.49Å; I109-L113 VanDerWaalsContact O-CG 3.23Å; I109-L113 WeakPolarHBondContact O-CG 3.17Å; I109-L113 PolarHBondContact O-N 3.23Å; A110-L113 PolarHBondContact O-N 2.98Å; L111-L113 VanDerWaalsContact C-N 3.33Å; L111-L113 PolarHBondContact O-N 2.85Å; L113-M116 PolarHBondContact O-N 2.79Å; L113-Q117 WeakPolarHBondContact O-CB 3.49Å; L113-Q117 VanDerWaalsContact O-CG 3.24Å; L113-Q117 WeakPolarHBondContact O-CG 3.4Å; L113-Q117 PolarHBondContact O-N 2.86Å; L113-P155 HydrophobicContact CD2-CG 4.04Å; L113-F157 HydrophobicContact CD1-CZ 4.03Å; L113-F157 HydrophobicContact CD2-CE1 4.01Å; L113-F157 HydrophobicContact CD2-CZ 4.14Å
114	F	90.3	Very high	86.9	Confident	5 Å²	5	40.2 Å²	40.2	2%	0.022	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-49.1	176.1	173.1	-98.7	0	0	0	112	V36 I87 V88 A110 L111 Q117 L118 I142 L146	V36-F114 HydrophobicContact CB-CB 4.46Å; V36-F114 HydrophobicContact CG2-CB 4.34Å; I87-F114 HydrophobicContact CG2-CB 3.89Å; I87-F114 HydrophobicContact CG2-CD1 4.5Å; I87-F114 HydrophobicContact CG2-CD2 3.61Å; I87-F114 HydrophobicContact CG2-CE2 4.24Å; I87-F114 HydrophobicContact CG2-CG 3.75Å; V88-F114 HydrophobicContact CB-CZ 4.48Å; V88-F114 HydrophobicContact CG1-CD1 3.95Å; V88-F114 HydrophobicContact CG1-CE1 3.48Å; V88-F114 VanDerWaalsContact CG1-CE1 3.48Å; V88-F114 HydrophobicContact CG1-CE2 4.24Å; V88-F114 HydrophobicContact CG1-CZ 3.63Å; V88-F114 HydrophobicContact CG2-CE2 4.4Å; V88-F114 HydrophobicContact CG2-CZ 3.98Å; A110-F114 WeakPolarHBondContact O-CB 3.47Å; A110-F114 PolarHBondContact O-N 2.95Å; L111-F114 WeakPolarHBondContact O-CB 3.46Å; L111-F114 PolarHBondContact O-N 3.02Å; L111-F114 VanDerWaalsContact O-N 3.16Å; F114-Q117 PolarHBondContact O-N 2.65Å; F114-L118 HydrophobicContact CD1-CD1 4.21Å; F114-L118 HydrophobicContact CE1-CD1 3.62Å; F114-L118 HydrophobicContact CE2-CD1 3.96Å; F114-L118 HydrophobicContact CZ-CD1 3.48Å; F114-L118 VanDerWaalsContact CZ-CD1 3.48Å; F114-L118 WeakPolarHBondContact O-CG 3.47Å; F114-L118 PolarHBondContact O-N 3.45Å; F114-I142 HydrophobicContact CE1-CD1 4.33Å; F114-I142 HydrophobicContact CE1-CG1 4.45Å; F114-I142 HydrophobicContact CE1-CG2 4.1Å; F114-I142 HydrophobicContact CZ-CG2 3.76Å; F114-L146 HydrophobicContact CE2-CD2 4.3Å
115	F	89.4	Confident	87.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.6	-40.5	177	-80.7	-76.2	0	0	0	112	L111 E112 Q117 L118 G119 L120 C122 P123 F134 L138 I142	L111-F115 VanDerWaalsContact O-CD2 3.23Å; L111-F115 WeakPolarHBondContact O-CD2 3.49Å; L111-F115 PolarHBondContact O-N 3.09Å; E112-F115 PolarHBondContact O-N 2.69Å; F115-Q117 PolarHBondContact O-N 2.75Å; F115-L118 PolarHBondContact O-N 2.92Å; F115-G119 PolarHBondContact O-N 3.36Å; F115-L120 HydrophobicContact CD1-CB 3.85Å; F115-L120 HydrophobicContact CD1-CD1 4.37Å; F115-L120 PolarHBondContact O-N 3.09Å; F115-C122 HydrophobicContact CB-CB 3.96Å; F115-C122 HydrophobicContact CD2-CB 4.36Å; F115-C122 HydrophobicContact CG-CB 4.26Å; F115-P123 HydrophobicContact CE2-CG 4.32Å; F115-P123 HydrophobicContact CZ-CG 4.15Å; F115-F134 HydrophobicContact CE2-CE1 4.11Å; F115-F134 HydrophobicContact CE2-CZ 4.17Å; F115-F134 HydrophobicContact CZ-CD1 4.44Å; F115-F134 AromaticContact CZ-CE1 3.87Å; F115-F134 HydrophobicContact CZ-CE1 3.87Å; F115-F134 HydrophobicContact CZ-CZ 4.08Å; F115-L138 HydrophobicContact CE1-CD1 4.03Å; F115-L138 HydrophobicContact CE1-CD2 4.11Å; F115-L138 HydrophobicContact CE1-CG 4.34Å; F115-L138 HydrophobicContact CZ-CD2 4.03Å; F115-I142 HydrophobicContact CE1-CD1 4.05Å; F115-I142 HydrophobicContact CE1-CG1 4.3Å; F115-I142 HydrophobicContact CZ-CD1 4.12Å
116	M	83.5	Confident	87.5	Confident	85 Å²	85	39 Å²	39	42%	0.419	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-46.5	175.5	-176.7	-175.2	-61.8	0	0	111.9	E112 L113 L118 G119 A257	E112-M116 VanDerWaalsContact O-CB 3.29Å; E112-M116 WeakPolarHBondContact O-CB 3.42Å; E112-M116 PolarHBondContact O-N 3.44Å; L113-M116 PolarHBondContact O-N 2.79Å; M116-L118 PolarHBondContact O-N 2.86Å; M116-G119 PolarHBondContact O-N 2.94Å; M116-A257 WeakPolarHBondContact CE-O 3.39Å
117	Q	83.4	Confident	87.8	Confident	31 Å²	31	39.8 Å²	39.8	15%	0.145	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-26.2	178.3	-76.8	178.9	-3.9	0	0	113.4	G34 L113 F114 F115 N149	G34-Q117 PolarHBondContact O-NE2 2.86Å; G34-Q117 PolarHBondContact O-OE1 3.34Å; G34-Q117 VanDerWaalsContact O-OE1 3.12Å; L113-Q117 WeakPolarHBondContact O-CB 3.49Å; L113-Q117 VanDerWaalsContact O-CG 3.24Å; L113-Q117 WeakPolarHBondContact O-CG 3.4Å; L113-Q117 PolarHBondContact O-N 2.86Å; F114-Q117 PolarHBondContact O-N 2.65Å; F115-Q117 PolarHBondContact O-N 2.75Å; Q117-N149 PolarHBondContact O-ND2 3.47Å
118	L	85.6	Confident	87.8	Confident	19 Å²	19	43.3 Å²	43.3	10%	0.099	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.7	176.2	-64.7	-179.5	0	0	0	113.2	F114 F115 M116 L120 I142 A145 L146 N149	F114-L118 HydrophobicContact CD1-CD1 4.21Å; F114-L118 HydrophobicContact CE1-CD1 3.62Å; F114-L118 HydrophobicContact CE2-CD1 3.96Å; F114-L118 HydrophobicContact CZ-CD1 3.48Å; F114-L118 VanDerWaalsContact CZ-CD1 3.48Å; F114-L118 WeakPolarHBondContact O-CG 3.47Å; F114-L118 PolarHBondContact O-N 3.45Å; F115-L118 PolarHBondContact O-N 2.92Å; M116-L118 PolarHBondContact O-N 2.86Å; L118-L120 VanDerWaalsContact C-N 3.26Å; L118-L120 HydrophobicContact CB-CB 4.44Å; L118-L120 HydrophobicContact CB-CD1 3.91Å; L118-L120 HydrophobicContact CB-CG 3.84Å; L118-L120 HydrophobicContact CD1-CD1 4.12Å; L118-L120 PolarHBondContact O-N 3.39Å; L118-I142 HydrophobicContact CD1-CG2 4.11Å; L118-A145 HydrophobicContact CB-CB 4Å; L118-A145 HydrophobicContact CD1-CB 4.38Å; L118-A145 HydrophobicContact CD2-CB 3.94Å; L118-A145 HydrophobicContact CG-CB 4.33Å; L118-L146 HydrophobicContact CD1-CG 4.47Å; L118-L146 HydrophobicContact CD2-CD2 3.89Å; L118-L146 HydrophobicContact CD2-CG 4.11Å; L118-N149 HydrophobicContact CD2-CB 4.46Å
119	G	83.2	Confident	88	Confident	71 Å²	71	43.7 Å²	43.7	73%	0.732	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	28.8	-174.3	0	0	0	0	0	113	F115 M116	F115-G119 PolarHBondContact O-N 3.36Å; M116-G119 PolarHBondContact O-N 2.94Å
120	L	86.8	Confident	88.3	Confident	39 Å²	39	43.2 Å²	43.2	20%	0.204	26%	0.259	C	S	.	.			trans	-107.1	151	-177.8	-62.7	-178.8	0	0	0	110.9	F115 L118 C122 T141 I142 A145	F115-L120 HydrophobicContact CD1-CB 3.85Å; F115-L120 HydrophobicContact CD1-CD1 4.37Å; F115-L120 PolarHBondContact O-N 3.09Å; L118-L120 VanDerWaalsContact C-N 3.26Å; L118-L120 HydrophobicContact CB-CB 4.44Å; L118-L120 HydrophobicContact CB-CD1 3.91Å; L118-L120 HydrophobicContact CB-CG 3.84Å; L118-L120 HydrophobicContact CD1-CD1 4.12Å; L118-L120 PolarHBondContact O-N 3.39Å; L120-C122 PolarHBondContact O-N 3.4Å; L120-T141 HydrophobicContact CD1-CG2 4.1Å; L120-T141 HydrophobicContact CD2-CG2 3.55Å; L120-T141 HydrophobicContact CG-CG2 4.49Å; L120-I142 HydrophobicContact CD1-CG1 3.99Å; L120-A145 HydrophobicContact CD1-CB 4.25Å
121	S	86.9	Confident	88.3	Confident	112 Å²	112	45.3 Å²	45.3	78%	0.783	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-68.6	122.6	171.2	-58.3	0	0	0	0	109.9
122	C	87	Confident	88.3	Confident	49 Å²	49	49.8 Å²	49.8	33%	0.331	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-69.2	133.8	173.4	-172.3	0	0	0	0	109.7	F115 L120	F115-C122 HydrophobicContact CB-CB 3.96Å; F115-C122 HydrophobicContact CD2-CB 4.36Å; F115-C122 HydrophobicContact CG-CB 4.26Å; L120-C122 PolarHBondContact O-N 3.4Å
123	P	87.3	Confident	88.3	Confident	26 Å²	26	49.6 Å²	49.6	17%	0.169	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-56.7	156.6	169.1	-24.5	34.4	0	0	0	112.6	F115 D125 P126 E129 L138	F115-P123 HydrophobicContact CE2-CG 4.32Å; F115-P123 HydrophobicContact CZ-CG 4.15Å; P123-D125 VanDerWaalsContact C-N 3.31Å; P123-D125 PolarHBondContact O-N 3.41Å; P123-P126 WeakPolarHBondContact O-CD 3.4Å; P123-E129 WeakPolarHBondContact CB-OE2 3.44Å; P123-E129 WeakPolarHBondContact CG-OE2 3.2Å; P123-L138 HydrophobicContact CG-CD2 4.18Å
124	N	84.1	Confident	88.6	Confident	179 Å²	179	50 Å²	50	96%	0.957	31%	0.312	S	S	*	.	S	Bend	trans	-63.6	-36.7	178.2	-69.8	-24.5	0	0	0	112.7
125	D	89.4	Confident	88.5	Confident	84 Å²	84	52.4 Å²	52.4	45%	0.449	33%	0.329	S	S	.	.	S	Bend	trans	-125.8	83	172.3	-175.6	-8	0	0	0	108.9	P123 V127 T128 E129	P123-D125 VanDerWaalsContact C-N 3.31Å; P123-D125 PolarHBondContact O-N 3.41Å; D125-V127 PolarHBondContact O-N 3.28Å; D125-V127 PolarHBondContact OD1-N 3.3Å; D125-T128 VanDerWaalsContact CG-CB 3.45Å; D125-T128 PolarHBondContact OD1-N 2.82Å; D125-T128 VanDerWaalsContact OD1-N 3.09Å; D125-T128 PolarHBondContact OD1-OG1 3.29Å; D125-T128 WeakPolarHBondContact OD2-CB 3.16Å; D125-T128 PolarHBondContact OD2-OG1 3.48Å; D125-E129 PolarHBondContact O-N 3.12Å; D125-E129 VanDerWaalsContact O-N 3.17Å
126	P	90.1	Very high	88.7	Confident	4 Å²	4	59.5 Å²	59.5	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-67.5	-27.7	-174	27.6	-33.7	0	0	0	112.1	R108 L111 P123 A130	R108-P126 HydrophobicContact CG-CG 4.34Å; L111-P126 HydrophobicContact CB-CB 3.9Å; L111-P126 HydrophobicContact CB-CG 4.29Å; L111-P126 HydrophobicContact CD1-CB 3.97Å; L111-P126 HydrophobicContact CD1-CG 4.48Å; L111-P126 WeakPolarHBondContact CD1-O 3.33Å; P123-P126 WeakPolarHBondContact O-CD 3.4Å; P126-A130 WeakPolarHBondContact O-CB 3.35Å; P126-A130 PolarHBondContact O-N 2.92Å
127	V	91.5	Very high	89.1	Confident	20 Å²	20	59.5 Å²	59.5	12%	0.121	38%	0.376	C	S	.	.	H	α-helix	trans	-71.1	-48.1	-179	179.2	0	0	0	0	110.4	F91 F95 V107 R108 L111 D125 E129 A130 L131	F91-V127 HydrophobicContact CE1-CG1 4.42Å; F91-V127 HydrophobicContact CZ-CG1 4.33Å; F95-V127 HydrophobicContact CD2-CG1 4.49Å; F95-V127 HydrophobicContact CE2-CG1 3.7Å; F95-V127 HydrophobicContact CZ-CG1 3.71Å; V107-V127 HydrophobicContact CG1-CG2 4.34Å; R108-V127 HydrophobicContact CB-CG2 4.12Å; L111-V127 HydrophobicContact CD1-CB 4.45Å; L111-V127 HydrophobicContact CD1-CG2 3.94Å; D125-V127 PolarHBondContact O-N 3.28Å; D125-V127 PolarHBondContact OD1-N 3.3Å; V127-E129 VanDerWaalsContact C-N 3.31Å; V127-E129 PolarHBondContact O-N 3.42Å; V127-A130 PolarHBondContact O-N 2.76Å; V127-L131 HydrophobicContact CG1-CD1 4.27Å; V127-L131 WeakPolarHBondContact O-CG 3.22Å; V127-L131 PolarHBondContact O-N 2.83Å
128	T	90.7	Very high	89.5	Confident	74 Å²	74	59.4 Å²	59.4	45%	0.454	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-38.2	176.9	-62.5	0	0	0	0	111.6	D125 L131 S132	D125-T128 VanDerWaalsContact CG-CB 3.45Å; D125-T128 PolarHBondContact OD1-N 2.82Å; D125-T128 VanDerWaalsContact OD1-N 3.09Å; D125-T128 PolarHBondContact OD1-OG1 3.29Å; D125-T128 WeakPolarHBondContact OD2-CB 3.16Å; D125-T128 PolarHBondContact OD2-OG1 3.48Å; T128-L131 PolarHBondContact O-N 2.86Å; T128-S132 WeakPolarHBondContact O-CB 3.36Å; T128-S132 PolarHBondContact O-N 3.35Å; T128-S132 PolarHBondContact O-OG 3.15Å
129	E	92	Very high	89.8	Confident	53 Å²	53	60.4 Å²	60.4	25%	0.248	38%	0.381	C	S	.	.	H	α-helix	trans	-67.9	-39	176.2	-152.1	-174.2	154.3	0	0	112	P123 D125 V127 S132 G133 F134 L138	P123-E129 WeakPolarHBondContact CB-OE2 3.44Å; P123-E129 WeakPolarHBondContact CG-OE2 3.2Å; D125-E129 PolarHBondContact O-N 3.12Å; D125-E129 VanDerWaalsContact O-N 3.17Å; V127-E129 VanDerWaalsContact C-N 3.31Å; V127-E129 PolarHBondContact O-N 3.42Å; E129-S132 CarbonylContact O-C 3.5Å; E129-S132 WeakPolarHBondContact O-CA 3.48Å; E129-S132 WeakPolarHBondContact O-CB 3.4Å; E129-S132 PolarHBondContact O-N 3.13Å; E129-S132 VanDerWaalsContact O-N 3.16Å; E129-G133 PolarHBondContact O-N 2.9Å; E129-G133 VanDerWaalsContact O-N 3.14Å; E129-F134 HydrophobicContact CB-CD1 3.89Å; E129-F134 HydrophobicContact CB-CE1 4.05Å; E129-F134 HydrophobicContact CG-CD1 3.72Å; E129-F134 HydrophobicContact CG-CE1 4.38Å; E129-F134 PolarHBondContact O-N 3.41Å; E129-L138 VanDerWaalsContact OE1-CD2 3.22Å; E129-L138 WeakPolarHBondContact OE1-CD2 3.08Å
130	A	93.4	Very high	90.2	Very high	3 Å²	3	60.4 Å²	60.4	3%	0.025	36%	0.362	C	S	.	.	H	α-helix	trans	-64.7	-41.9	175.1	0	0	0	0	0	112.4	F91 L111 P126 V127 S132 G133 F134	F91-A130 HydrophobicContact CD1-CB 3.89Å; F91-A130 HydrophobicContact CD2-CB 3.77Å; F91-A130 HydrophobicContact CE1-CB 3.85Å; F91-A130 HydrophobicContact CE2-CB 3.73Å; F91-A130 HydrophobicContact CG-CB 3.87Å; F91-A130 HydrophobicContact CZ-CB 3.77Å; L111-A130 HydrophobicContact CD1-CB 4.02Å; L111-A130 HydrophobicContact CD2-CB 4.42Å; P126-A130 WeakPolarHBondContact O-CB 3.35Å; P126-A130 PolarHBondContact O-N 2.92Å; V127-A130 PolarHBondContact O-N 2.76Å; A130-S132 PolarHBondContact O-N 2.93Å; A130-G133 WeakPolarHBondContact O-CA 3.43Å; A130-G133 PolarHBondContact O-N 2.8Å; A130-F134 HydrophobicContact CB-CE1 3.89Å; A130-F134 HydrophobicContact CB-CE2 4.07Å; A130-F134 HydrophobicContact CB-CZ 3.47Å; A130-F134 VanDerWaalsContact CB-CZ 3.47Å
131	L	91.4	Very high	90.4	Very high	44 Å²	44	61.1 Å²	61.1	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-33.8	172.5	-74.5	168.9	0	0	0	111.9	F91 N92 F95 V127 T128 G133	F91-L131 HydrophobicContact CD1-CD2 3.86Å; F91-L131 HydrophobicContact CD1-CG 4.1Å; F91-L131 HydrophobicContact CE1-CD2 3.88Å; F91-L131 HydrophobicContact CE1-CG 3.83Å; N92-L131 PolarHBondContact ND2-O 3.18Å; N92-L131 VanDerWaalsContact OD1-CD2 3.23Å; N92-L131 WeakPolarHBondContact OD1-CD2 3.45Å; N92-L131 PolarHBondContact OD1-O 2.74Å; F95-L131 HydrophobicContact CB-CD2 4.27Å; F95-L131 HydrophobicContact CD1-CD1 4.19Å; F95-L131 HydrophobicContact CD1-CD2 3.66Å; F95-L131 HydrophobicContact CD1-CG 4.37Å; F95-L131 HydrophobicContact CE1-CD1 3.91Å; F95-L131 HydrophobicContact CE1-CD2 4.24Å; F95-L131 HydrophobicContact CG-CD2 4.12Å; V127-L131 HydrophobicContact CG1-CD1 4.27Å; V127-L131 WeakPolarHBondContact O-CG 3.22Å; V127-L131 PolarHBondContact O-N 2.83Å; T128-L131 PolarHBondContact O-N 2.86Å; L131-G133 PolarHBondContact O-N 2.99Å
132	S	92	Very high	90.6	Very high	95 Å²	95	56.1 Å²	56.1	66%	0.664	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	0.3	175	-52.8	0	0	0	0	113.5	T128 E129 A130	T128-S132 WeakPolarHBondContact O-CB 3.36Å; T128-S132 PolarHBondContact O-N 3.35Å; T128-S132 PolarHBondContact O-OG 3.15Å; E129-S132 CarbonylContact O-C 3.5Å; E129-S132 WeakPolarHBondContact O-CA 3.48Å; E129-S132 WeakPolarHBondContact O-CB 3.4Å; E129-S132 PolarHBondContact O-N 3.13Å; E129-S132 VanDerWaalsContact O-N 3.16Å; A130-S132 PolarHBondContact O-N 2.93Å
133	G	90.5	Very high	90.7	Very high	38 Å²	38	61 Å²	61	39%	0.392	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	13.3	178.4	0	0	0	0	0	115.2	E129 A130 L131 N139	E129-G133 PolarHBondContact O-N 2.9Å; E129-G133 VanDerWaalsContact O-N 3.14Å; A130-G133 WeakPolarHBondContact O-CA 3.43Å; A130-G133 PolarHBondContact O-N 2.8Å; L131-G133 PolarHBondContact O-N 2.99Å; G133-N139 PolarHBondContact O-ND2 3.23Å
134	F	91.4	Very high	90.7	Very high	20 Å²	20	66.2 Å²	66.2	9%	0.088	36%	0.361	C	S	.	.			trans	57.8	156.2	-171.4	-55.2	-64.5	0	0	0	115.2	V88 L111 F115 E129 A130 L138 N139 I142	V88-F134 HydrophobicContact CB-CE2 4.28Å; V88-F134 HydrophobicContact CG1-CE2 3.81Å; V88-F134 HydrophobicContact CG1-CZ 4.37Å; L111-F134 HydrophobicContact CD2-CZ 4.45Å; F115-F134 HydrophobicContact CE2-CE1 4.11Å; F115-F134 HydrophobicContact CE2-CZ 4.17Å; F115-F134 HydrophobicContact CZ-CD1 4.44Å; F115-F134 AromaticContact CZ-CE1 3.87Å; F115-F134 HydrophobicContact CZ-CE1 3.87Å; F115-F134 HydrophobicContact CZ-CZ 4.08Å; E129-F134 HydrophobicContact CB-CD1 3.89Å; E129-F134 HydrophobicContact CB-CE1 4.05Å; E129-F134 HydrophobicContact CG-CD1 3.72Å; E129-F134 HydrophobicContact CG-CE1 4.38Å; E129-F134 PolarHBondContact O-N 3.41Å; A130-F134 HydrophobicContact CB-CE1 3.89Å; A130-F134 HydrophobicContact CB-CE2 4.07Å; A130-F134 HydrophobicContact CB-CZ 3.47Å; A130-F134 VanDerWaalsContact CB-CZ 3.47Å; F134-L138 HydrophobicContact CB-CB 4.45Å; F134-L138 HydrophobicContact CB-CD2 4.16Å; F134-L138 HydrophobicContact CB-CG 4.49Å; F134-L138 HydrophobicContact CD1-CD2 3.78Å; F134-L138 HydrophobicContact CG-CD2 4.19Å; F134-N139 PolarHBondContact O-ND2 2.86Å; F134-I142 HydrophobicContact CD2-CD1 4.17Å; F134-I142 HydrophobicContact CE2-CD1 4.42Å; F134-I142 HydrophobicContact CG-CD1 4.5Å
135	S	90	Very high	90.8	Very high	54 Å²	54	58.4 Å²	58.4	38%	0.378	32%	0.321	S	S	.	.			trans	-64.5	150.9	172.6	64.2	0	0	0	0	111.9	S137 L138 N139	S135-S137 VanDerWaalsContact C-N 3.25Å; S135-S137 PolarHBondContact O-N 2.83Å; S135-S137 PolarHBondContact OG-OG 3.42Å; S135-L138 PolarHBondContact O-N 3.48Å; S135-L138 VanDerWaalsContact OG-CB 3.25Å; S135-L138 WeakPolarHBondContact OG-CB 3.39Å; S135-L138 PolarHBondContact OG-N 2.9Å; S135-N139 PolarHBondContact O-N 2.8Å; S135-N139 PolarHBondContact O-ND2 3.06Å
136	N	91.9	Very high	90.7	Very high	149 Å²	149	57.6 Å²	57.6	80%	0.797	32%	0.316	S	S	*	.	H	α-helix	trans	-56.1	-39	178.9	-74.6	-24.9	0	0	0	112.9	E140	N136-E140 WeakPolarHBondContact O-CB 3.48Å; N136-E140 PolarHBondContact O-N 3.21Å; N136-E140 VanDerWaalsContact O-N 3.1Å
137	S	92	Very high	90.2	Very high	85 Å²	85	64.2 Å²	64.2	59%	0.594	35%	0.352	S	S	*	.	H	α-helix	trans	-66	-40.1	176.5	46.8	0	0	0	0	112.4	S135 T141	S135-S137 VanDerWaalsContact C-N 3.25Å; S135-S137 PolarHBondContact O-N 2.83Å; S135-S137 PolarHBondContact OG-OG 3.42Å; S137-T141 PolarHBondContact O-N 3.5Å; S137-T141 VanDerWaalsContact O-N 3.09Å; S137-T141 PolarHBondContact O-OG1 2.95Å
138	L	91.7	Very high	89.5	Confident	29 Å²	29	71.6 Å²	71.6	15%	0.152	38%	0.382	C	S	.	.	H	α-helix	trans	-69.5	-44.8	177.8	-173.6	58.6	0	0	0	111.2	F115 P123 E129 F134 S135 E140 T141 I142	F115-L138 HydrophobicContact CE1-CD1 4.03Å; F115-L138 HydrophobicContact CE1-CD2 4.11Å; F115-L138 HydrophobicContact CE1-CG 4.34Å; F115-L138 HydrophobicContact CZ-CD2 4.03Å; P123-L138 HydrophobicContact CG-CD2 4.18Å; E129-L138 VanDerWaalsContact OE1-CD2 3.22Å; E129-L138 WeakPolarHBondContact OE1-CD2 3.08Å; F134-L138 HydrophobicContact CB-CB 4.45Å; F134-L138 HydrophobicContact CB-CD2 4.16Å; F134-L138 HydrophobicContact CB-CG 4.49Å; F134-L138 HydrophobicContact CD1-CD2 3.78Å; F134-L138 HydrophobicContact CG-CD2 4.19Å; S135-L138 PolarHBondContact O-N 3.48Å; S135-L138 VanDerWaalsContact OG-CB 3.25Å; S135-L138 WeakPolarHBondContact OG-CB 3.39Å; S135-L138 PolarHBondContact OG-N 2.9Å; L138-E140 VanDerWaalsContact C-N 3.3Å; L138-E140 PolarHBondContact O-N 3.21Å; L138-T141 CarbonylContact O-C 3.59Å; L138-T141 WeakPolarHBondContact O-CA 3.38Å; L138-T141 WeakPolarHBondContact O-CB 3.44Å; L138-T141 PolarHBondContact O-N 2.85Å; L138-I142 HydrophobicContact CD1-CD1 4.47Å; L138-I142 HydrophobicContact CD1-CG1 4.46Å; L138-I142 HydrophobicContact CG-CD1 3.92Å; L138-I142 HydrophobicContact CG-CG1 4.39Å; L138-I142 WeakPolarHBondContact O-CG1 3.4Å; L138-I142 PolarHBondContact O-N 3.02Å
139	N	92.1	Very high	88.5	Confident	40 Å²	40	69.7 Å²	69.7	21%	0.214	37%	0.369	C	S	.	.	H	α-helix	trans	-56.3	-43.8	175.2	-84.4	-41.8	0	0	0	112.5	G133 F134 S135 T141 I142 R143	G133-N139 PolarHBondContact O-ND2 3.23Å; F134-N139 PolarHBondContact O-ND2 2.86Å; S135-N139 PolarHBondContact O-N 2.8Å; S135-N139 PolarHBondContact O-ND2 3.06Å; N139-T141 VanDerWaalsContact C-N 3.31Å; N139-T141 PolarHBondContact O-N 3.28Å; N139-I142 PolarHBondContact O-N 3.25Å; N139-R143 WeakPolarHBondContact O-CG 3.32Å; N139-R143 PolarHBondContact O-N 3.34Å
140	E	91.9	Very high	86.9	Confident	71 Å²	71	72.3 Å²	72.3	33%	0.332	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.6	-178.5	60.4	-158.2	0	0	112	N136 L138 R143 R144	N136-E140 WeakPolarHBondContact O-CB 3.48Å; N136-E140 PolarHBondContact O-N 3.21Å; N136-E140 VanDerWaalsContact O-N 3.1Å; L138-E140 VanDerWaalsContact C-N 3.3Å; L138-E140 PolarHBondContact O-N 3.21Å; E140-R143 IonicContact OE2-NH1 3.52Å; E140-R144 VanDerWaalsContact CG-CZ 3.43Å; E140-R144 WeakPolarHBondContact O-CG 3.23Å; E140-R144 PolarHBondContact O-N 3.37Å; E140-R144 VanDerWaalsContact O-N 3.16Å; E140-R144 IonicContact OE1-CZ 2.64Å; E140-R144 VanDerWaalsContact OE1-CZ 3.3Å; E140-R144 IonicContact OE1-NE 3.17Å; E140-R144 PolarHBondContact OE1-NE 2.71Å; E140-R144 IonicContact OE1-NH2 2.96Å; E140-R144 PolarHBondContact OE1-NH2 2.96Å
141	T	91.6	Very high	85.1	Confident	54 Å²	54	79.6 Å²	79.6	33%	0.331	42%	0.418	S	S	.	.	H	α-helix	trans	-68.3	-43	174.9	-55.9	0	0	0	0	111.7	L120 S137 L138 N139 R144 A145	L120-T141 HydrophobicContact CD1-CG2 4.1Å; L120-T141 HydrophobicContact CD2-CG2 3.55Å; L120-T141 HydrophobicContact CG-CG2 4.49Å; S137-T141 PolarHBondContact O-N 3.5Å; S137-T141 VanDerWaalsContact O-N 3.09Å; S137-T141 PolarHBondContact O-OG1 2.95Å; L138-T141 CarbonylContact O-C 3.59Å; L138-T141 WeakPolarHBondContact O-CA 3.38Å; L138-T141 WeakPolarHBondContact O-CB 3.44Å; L138-T141 PolarHBondContact O-N 2.85Å; N139-T141 VanDerWaalsContact C-N 3.31Å; N139-T141 PolarHBondContact O-N 3.28Å; T141-R144 PolarHBondContact O-N 2.85Å; T141-A145 WeakPolarHBondContact O-CB 3.37Å; T141-A145 PolarHBondContact O-N 3.05Å
142	I	90.9	Very high	83.8	Confident	7 Å²	7	79.3 Å²	79.3	4%	0.036	42%	0.415	C	S	.	.	H	α-helix	trans	-59.3	-47.3	175.3	-71.3	166.8	0	0	0	110.3	F114 F115 L118 L120 F134 L138 N139 R144 A145 L146	F114-I142 HydrophobicContact CE1-CD1 4.33Å; F114-I142 HydrophobicContact CE1-CG1 4.45Å; F114-I142 HydrophobicContact CE1-CG2 4.1Å; F114-I142 HydrophobicContact CZ-CG2 3.76Å; F115-I142 HydrophobicContact CE1-CD1 4.05Å; F115-I142 HydrophobicContact CE1-CG1 4.3Å; F115-I142 HydrophobicContact CZ-CD1 4.12Å; L118-I142 HydrophobicContact CD1-CG2 4.11Å; L120-I142 HydrophobicContact CD1-CG1 3.99Å; F134-I142 HydrophobicContact CD2-CD1 4.17Å; F134-I142 HydrophobicContact CE2-CD1 4.42Å; F134-I142 HydrophobicContact CG-CD1 4.5Å; L138-I142 HydrophobicContact CD1-CD1 4.47Å; L138-I142 HydrophobicContact CD1-CG1 4.46Å; L138-I142 HydrophobicContact CG-CD1 3.92Å; L138-I142 HydrophobicContact CG-CG1 4.39Å; L138-I142 WeakPolarHBondContact O-CG1 3.4Å; L138-I142 PolarHBondContact O-N 3.02Å; N139-I142 PolarHBondContact O-N 3.25Å; I142-R144 PolarHBondContact O-N 2.93Å; I142-A145 PolarHBondContact O-N 3.48Å; I142-L146 HydrophobicContact CG2-CD1 3.76Å; I142-L146 HydrophobicContact CG2-CG 4.31Å; I142-L146 WeakPolarHBondContact O-CG 3.39Å; I142-L146 PolarHBondContact O-N 2.94Å
143	R	89	Confident	82.3	Confident	151 Å²	151	80.6 Å²	80.6	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-57.2	-51.1	177.4	-74	175.1	-172.3	154	1.7	111.9	N139 E140 A145 L146 D147	N139-R143 WeakPolarHBondContact O-CG 3.32Å; N139-R143 PolarHBondContact O-N 3.34Å; E140-R143 IonicContact OE2-NH1 3.52Å; R143-A145 VanDerWaalsContact C-N 3.26Å; R143-A145 PolarHBondContact O-N 3.18Å; R143-L146 PolarHBondContact O-N 3.04Å; R143-D147 PolarHBondContact O-N 3.04Å
144	R	88.1	Confident	81.2	Confident	136 Å²	136	79.7 Å²	79.7	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-32.9	177.8	-67.9	175.2	-160.7	153.3	-1.8	113.2	E140 T141 I142 K148	E140-R144 VanDerWaalsContact CG-CZ 3.43Å; E140-R144 WeakPolarHBondContact O-CG 3.23Å; E140-R144 PolarHBondContact O-N 3.37Å; E140-R144 VanDerWaalsContact O-N 3.16Å; E140-R144 IonicContact OE1-CZ 2.64Å; E140-R144 VanDerWaalsContact OE1-CZ 3.3Å; E140-R144 IonicContact OE1-NE 3.17Å; E140-R144 PolarHBondContact OE1-NE 2.71Å; E140-R144 IonicContact OE1-NH2 2.96Å; E140-R144 PolarHBondContact OE1-NH2 2.96Å; T141-R144 PolarHBondContact O-N 2.85Å; I142-R144 PolarHBondContact O-N 2.93Å; R144-K148 VanDerWaalsContact O-CG 3.3Å; R144-K148 WeakPolarHBondContact O-CG 3.22Å; R144-K148 PolarHBondContact O-N 3.44Å
145	A	86.3	Confident	80.1	Confident	16 Å²	16	80 Å²	80	13%	0.132	41%	0.409	C	S	.	.	H	α-helix	trans	-73	-41.9	177.2	0	0	0	0	0	111.3	L118 L120 T141 I142 R143 D147 K148 N149	L118-A145 HydrophobicContact CB-CB 4Å; L118-A145 HydrophobicContact CD1-CB 4.38Å; L118-A145 HydrophobicContact CD2-CB 3.94Å; L118-A145 HydrophobicContact CG-CB 4.33Å; L120-A145 HydrophobicContact CD1-CB 4.25Å; T141-A145 WeakPolarHBondContact O-CB 3.37Å; T141-A145 PolarHBondContact O-N 3.05Å; I142-A145 PolarHBondContact O-N 3.48Å; R143-A145 VanDerWaalsContact C-N 3.26Å; R143-A145 PolarHBondContact O-N 3.18Å; A145-D147 VanDerWaalsContact C-N 3.35Å; A145-D147 PolarHBondContact O-N 3.2Å; A145-K148 PolarHBondContact O-N 2.86Å; A145-N149 WeakPolarHBondContact O-CB 3.4Å; A145-N149 PolarHBondContact O-N 3.08Å
146	L	85.6	Confident	78.9	Confident	66 Å²	66	80.7 Å²	80.7	35%	0.346	41%	0.414	S	S	.	.	H	α-helix	trans	-60.4	-43	174.4	-74.2	167.2	0	0	0	111.7	F114 L118 I142 R143 K148 N149	F114-L146 HydrophobicContact CE2-CD2 4.3Å; L118-L146 HydrophobicContact CD1-CG 4.47Å; L118-L146 HydrophobicContact CD2-CD2 3.89Å; L118-L146 HydrophobicContact CD2-CG 4.11Å; I142-L146 HydrophobicContact CG2-CD1 3.76Å; I142-L146 HydrophobicContact CG2-CG 4.31Å; I142-L146 WeakPolarHBondContact O-CG 3.39Å; I142-L146 PolarHBondContact O-N 2.94Å; R143-L146 PolarHBondContact O-N 3.04Å; L146-K148 PolarHBondContact O-N 2.59Å; L146-N149 PolarHBondContact O-N 3Å
147	D	80.1	Confident	77.7	Confident	144 Å²	144	76.9 Å²	76.9	77%	0.77	39%	0.39	S	S	*	.	H	α-helix	trans	-63.5	-28.2	177.7	-68.5	-22	0	0	0	113	R143 A145	R143-D147 PolarHBondContact O-N 3.04Å; A145-D147 VanDerWaalsContact C-N 3.35Å; A145-D147 PolarHBondContact O-N 3.2Å
148	K	77.8	Confident	76.7	Confident	174 Å²	174	72.8 Å²	72.8	76%	0.757	36%	0.362	S	S	*	.	H	α-helix	trans	-89.3	-19	179	-72.3	176.7	-178.3	-177.2	0	113.6	R144 A145 L146 D150	R144-K148 VanDerWaalsContact O-CG 3.3Å; R144-K148 WeakPolarHBondContact O-CG 3.22Å; R144-K148 PolarHBondContact O-N 3.44Å; A145-K148 PolarHBondContact O-N 2.86Å; L146-K148 PolarHBondContact O-N 2.59Å; K148-D150 PolarHBondContact O-N 3.02Å; K148-D150 VanDerWaalsContact O-N 3.07Å
149	N	68.1	Low	75.8	Confident	34 Å²	34	75.8 Å²	75.8	18%	0.182	38%	0.375	C	S	.	.			trans	-85.9	82.8	-169.5	-162.9	-2.2	0	0	0	111	Q117 L118 A145 L146 H151	Q117-N149 PolarHBondContact O-ND2 3.47Å; L118-N149 HydrophobicContact CD2-CB 4.46Å; A145-N149 WeakPolarHBondContact O-CB 3.4Å; A145-N149 PolarHBondContact O-N 3.08Å; L146-N149 PolarHBondContact O-N 3Å; N149-H151 PolarHBondContact OD1-O 3.44Å
150	D	59.2	Low	74.7	Confident	108 Å²	108	77.2 Å²	77.2	58%	0.578	38%	0.38	S	S	*	.			trans	-82.7	-22.1	-175.8	-144.3	11.8	0	0	0	112.9	K32 K148	K32-D150 IonicContact NZ-OD1 3.07Å; K148-D150 PolarHBondContact O-N 3.02Å; K148-D150 VanDerWaalsContact O-N 3.07Å
151	H	54.6	Low	73.7	Confident	157 Å²	157	76.6 Å²	76.6	73%	0.727	38%	0.375	S	S	*	.			trans	-140.8	117.7	-177.2	-45.1	-41.4	0	0	0	111.4	N149	N149-H151 PolarHBondContact OD1-O 3.44Å
152	K	64.2	Low	72.7	Confident	37 Å²	37	74.2 Å²	74.2	16%	0.161	36%	0.36	C	S	.	.			trans	-98.6	111.1	174.1	-63.5	-179.8	177.7	-173	0	109.6	D35 L154	D35-K152 VanDerWaalsContact OD1-CE 3.3Å; D35-K152 WeakPolarHBondContact OD1-CE 3.47Å; D35-K152 IonicContact OD1-NZ 3.54Å; D35-K152 PolarHBondContact OD1-NZ 3.24Å; K152-L154 PolarHBondContact O-N 3.21Å
153	T	61.9	Low	71.8	Confident	122 Å²	122	78.6 Å²	78.6	75%	0.748	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-73.1	122.3	164.5	36.3	0	0	0	0	108.9
154	L	67.9	Low	70.9	Confident	20 Å²	20	75.4 Å²	75.4	11%	0.105	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-59.4	133.8	172.7	-72	174.1	0	0	0	109.4	I33 I51 K152 I158 Q159 L162	I33-L154 HydrophobicContact CG2-CD1 4.09Å; I33-L154 HydrophobicContact CG2-CG 4.21Å; I51-L154 HydrophobicContact CG2-CD2 3.76Å; K152-L154 PolarHBondContact O-N 3.21Å; L154-I158 HydrophobicContact CB-CB 4.47Å; L154-I158 HydrophobicContact CB-CG2 4.43Å; L154-I158 HydrophobicContact CD1-CG2 4.22Å; L154-I158 HydrophobicContact CD2-CD1 4.49Å; L154-I158 HydrophobicContact CD2-CG2 4.22Å; L154-Q159 HydrophobicContact CB-CG 3.94Å; L154-Q159 PolarHBondContact O-NE2 2.81Å; L154-L162 HydrophobicContact CD1-CD1 3.95Å
155	P	67.2	Low	69.9	Low	25 Å²	25	70 Å²	70	16%	0.162	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-48	145.9	169.5	-28	30.9	0	0	0	112.6	L113 F157 I158 Q159	L113-P155 HydrophobicContact CD2-CG 4.04Å; P155-F157 VanDerWaalsContact C-N 3.29Å; P155-F157 HydrophobicContact CB-CD1 3.53Å; P155-F157 HydrophobicContact CB-CE1 3.32Å; P155-F157 HydrophobicContact CB-CZ 4.24Å; P155-F157 HydrophobicContact CG-CE1 3.92Å; P155-F157 PolarHBondContact O-N 3.48Å; P155-I158 HydrophobicContact CB-CD1 4.4Å; P155-I158 HydrophobicContact CB-CG1 4.28Å; P155-I158 HydrophobicContact CG-CD1 4.08Å; P155-I158 HydrophobicContact CG-CG1 4.49Å; P155-I158 WeakPolarHBondContact O-CB 3.1Å; P155-I158 PolarHBondContact O-N 3.15Å; P155-Q159 PolarHBondContact O-N 3.24Å
156	S	65.8	Low	69.2	Low	69 Å²	69	71.7 Å²	71.7	48%	0.483	36%	0.363	S	S	.	.	H	α-helix	trans	-56	-41	-175.6	58	0	0	0	0	113	I158 Q159 E160	S156-I158 PolarHBondContact O-N 3.1Å; S156-Q159 WeakPolarHBondContact O-CB 3.14Å; S156-Q159 PolarHBondContact O-N 2.98Å; S156-E160 WeakPolarHBondContact O-CG 3.25Å; S156-E160 PolarHBondContact O-N 3.33Å
157	F	65.5	Low	68.5	Low	69 Å²	69	71 Å²	71	30%	0.303	36%	0.364	S	S	.	.	H	α-helix	trans	-62	-28.3	178.6	78.1	-91.8	0	0	0	113.2	L113 P155 R161	L113-F157 HydrophobicContact CD1-CZ 4.03Å; L113-F157 HydrophobicContact CD2-CE1 4.01Å; L113-F157 HydrophobicContact CD2-CZ 4.14Å; P155-F157 VanDerWaalsContact C-N 3.29Å; P155-F157 HydrophobicContact CB-CD1 3.53Å; P155-F157 HydrophobicContact CB-CE1 3.32Å; P155-F157 HydrophobicContact CB-CZ 4.24Å; P155-F157 HydrophobicContact CG-CE1 3.92Å; P155-F157 PolarHBondContact O-N 3.48Å; F157-R161 WeakPolarHBondContact O-CB 3.47Å; F157-R161 PolarHBondContact O-N 3.03Å
158	I	70.5	Confident	67.7	Low	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-75.5	-43.6	174.9	-59.6	-174	0	0	0	109.6	I51 L69 L154 P155 S156 R161 L162	I51-I158 HydrophobicContact CB-CD1 4.46Å; I51-I158 HydrophobicContact CD1-CD1 3.25Å; I51-I158 HydrophobicContact CG1-CD1 4.4Å; I51-I158 HydrophobicContact CG2-CD1 4.25Å; L69-I158 HydrophobicContact CD2-CG1 4.48Å; L69-I158 HydrophobicContact CD2-CG2 3.78Å; L154-I158 HydrophobicContact CB-CB 4.47Å; L154-I158 HydrophobicContact CB-CG2 4.43Å; L154-I158 HydrophobicContact CD1-CG2 4.22Å; L154-I158 HydrophobicContact CD2-CD1 4.49Å; L154-I158 HydrophobicContact CD2-CG2 4.22Å; P155-I158 HydrophobicContact CB-CD1 4.4Å; P155-I158 HydrophobicContact CB-CG1 4.28Å; P155-I158 HydrophobicContact CG-CD1 4.08Å; P155-I158 HydrophobicContact CG-CG1 4.49Å; P155-I158 WeakPolarHBondContact O-CB 3.1Å; P155-I158 PolarHBondContact O-N 3.15Å; S156-I158 PolarHBondContact O-N 3.1Å; I158-R161 PolarHBondContact O-N 3.42Å; I158-L162 HydrophobicContact CG2-CD1 4.18Å; I158-L162 HydrophobicContact CG2-CG 4.45Å; I158-L162 VanDerWaalsContact O-CG 3.32Å; I158-L162 WeakPolarHBondContact O-CG 3.33Å; I158-L162 PolarHBondContact O-N 3.27Å
159	Q	72.7	Confident	66.9	Low	92 Å²	92	61.9 Å²	61.9	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-60.4	-48.3	177.3	-63.3	-177.4	13.9	0	0	110.8	L154 P155 S156 R161 L162 D163	L154-Q159 HydrophobicContact CB-CG 3.94Å; L154-Q159 PolarHBondContact O-NE2 2.81Å; P155-Q159 PolarHBondContact O-N 3.24Å; S156-Q159 WeakPolarHBondContact O-CB 3.14Å; S156-Q159 PolarHBondContact O-N 2.98Å; Q159-R161 VanDerWaalsContact C-N 3.27Å; Q159-R161 PolarHBondContact O-N 2.77Å; Q159-L162 PolarHBondContact O-N 3.36Å; Q159-D163 PolarHBondContact O-N 3.23Å
160	E	69.6	Low	66.4	Low	69 Å²	69	64.9 Å²	64.9	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-54.7	-43.2	175.2	-73.2	170.9	-152	0	0	111.7	S156 D163 E164 I200	S156-E160 WeakPolarHBondContact O-CG 3.25Å; S156-E160 PolarHBondContact O-N 3.33Å; E160-D163 PolarHBondContact O-N 3.34Å; E160-E164 WeakPolarHBondContact O-CG 3.46Å; E160-E164 PolarHBondContact O-N 2.8Å; E160-I200 WeakPolarHBondContact OE2-CD1 3.45Å
161	R	70.6	Confident	66.3	Low	58 Å²	58	66.9 Å²	66.9	22%	0.219	34%	0.344	C	S	.	.	H	α-helix	trans	-67.5	-36.7	178.3	-177	59.1	-173.5	149.8	8.9	112.9	F157 I158 Q159 E164 I165	F157-R161 WeakPolarHBondContact O-CB 3.47Å; F157-R161 PolarHBondContact O-N 3.03Å; I158-R161 PolarHBondContact O-N 3.42Å; Q159-R161 VanDerWaalsContact C-N 3.27Å; Q159-R161 PolarHBondContact O-N 2.77Å; R161-E164 WeakPolarHBondContact CD-OE2 3.26Å; R161-E164 IonicContact CZ-OE2 2.68Å; R161-E164 IonicContact NH1-OE2 2.69Å; R161-E164 PolarHBondContact NH1-OE2 3.14Å; R161-E164 PolarHBondContact O-N 3.38Å; R161-I165 HydrophobicContact CG-CD1 4.29Å; R161-I165 VanDerWaalsContact O-CG1 3.3Å; R161-I165 WeakPolarHBondContact O-CG1 3.19Å; R161-I165 PolarHBondContact O-N 3.1Å; R161-I165 VanDerWaalsContact O-N 3.14Å
162	L	70.7	Confident	66	Low	5 Å²	5	65.8 Å²	65.8	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-66.4	-41.5	175	-66.8	172.8	0	0	0	110.9	I53 C58 L76 L154 I158 Q159 E164 I165 L166	I53-L162 HydrophobicContact CB-CD1 4.42Å; I53-L162 HydrophobicContact CB-CD2 4.47Å; I53-L162 HydrophobicContact CD1-CD2 3.67Å; I53-L162 HydrophobicContact CG2-CD1 4.15Å; I53-L162 HydrophobicContact CG2-CD2 4.28Å; C58-L162 HydrophobicContact CB-CD2 4.26Å; L76-L162 HydrophobicContact CD1-CD2 4.48Å; L76-L162 HydrophobicContact CD2-CD2 4.26Å; L154-L162 HydrophobicContact CD1-CD1 3.95Å; I158-L162 HydrophobicContact CG2-CD1 4.18Å; I158-L162 HydrophobicContact CG2-CG 4.45Å; I158-L162 VanDerWaalsContact O-CG 3.32Å; I158-L162 WeakPolarHBondContact O-CG 3.33Å; I158-L162 PolarHBondContact O-N 3.27Å; Q159-L162 PolarHBondContact O-N 3.36Å; L162-E164 PolarHBondContact O-N 3.38Å; L162-I165 PolarHBondContact O-N 2.73Å; L162-L166 WeakPolarHBondContact O-CB 3.47Å; L162-L166 PolarHBondContact O-N 3.4Å
163	D	73.2	Confident	65.1	Low	98 Å²	98	70 Å²	70	52%	0.524	36%	0.36	S	S	.	.	H	α-helix	trans	-63.1	-40.4	175.9	-66.1	-25.5	0	0	0	111.7	Q159 E160 I165 L166 S167	Q159-D163 PolarHBondContact O-N 3.23Å; E160-D163 PolarHBondContact O-N 3.34Å; D163-I165 PolarHBondContact O-N 3.21Å; D163-L166 PolarHBondContact O-N 2.82Å; D163-S167 WeakPolarHBondContact O-CB 3.42Å; D163-S167 PolarHBondContact O-N 3.12Å
164	E	69.8	Low	64.3	Low	85 Å²	85	71.1 Å²	71.1	40%	0.397	36%	0.361	S	S	.	.	H	α-helix	trans	-59.6	-45.7	173.1	-77.4	179.6	177.3	0	0	112.1	E160 R161 L162 S167 Q168	E160-E164 WeakPolarHBondContact O-CG 3.46Å; E160-E164 PolarHBondContact O-N 2.8Å; R161-E164 WeakPolarHBondContact CD-OE2 3.26Å; R161-E164 IonicContact CZ-OE2 2.68Å; R161-E164 IonicContact NH1-OE2 2.69Å; R161-E164 PolarHBondContact NH1-OE2 3.14Å; R161-E164 PolarHBondContact O-N 3.38Å; L162-E164 PolarHBondContact O-N 3.38Å; E164-S167 PolarHBondContact O-N 3.35Å; E164-S167 PolarHBondContact O-OG 2.78Å; E164-Q168 WeakPolarHBondContact O-CG 3.43Å; E164-Q168 PolarHBondContact O-N 3.3Å
165	I	66.9	Low	63.2	Low	23 Å²	23	76.8 Å²	76.8	12%	0.118	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-42.7	179.9	-68	168.6	0	0	0	110.2	C58 L76 R161 L162 D163 S167 Q168 A169	C58-I165 HydrophobicContact CB-CG2 4.01Å; L76-I165 HydrophobicContact CD1-CD1 3.59Å; L76-I165 HydrophobicContact CD1-CG2 3.98Å; L76-I165 HydrophobicContact CG-CD1 3.89Å; R161-I165 HydrophobicContact CG-CD1 4.29Å; R161-I165 VanDerWaalsContact O-CG1 3.3Å; R161-I165 WeakPolarHBondContact O-CG1 3.19Å; R161-I165 PolarHBondContact O-N 3.1Å; R161-I165 VanDerWaalsContact O-N 3.14Å; L162-I165 PolarHBondContact O-N 2.73Å; D163-I165 PolarHBondContact O-N 3.21Å; I165-S167 VanDerWaalsContact C-N 3.3Å; I165-S167 PolarHBondContact O-N 3.12Å; I165-Q168 WeakPolarHBondContact O-CB 3.15Å; I165-Q168 PolarHBondContact O-N 3.48Å; I165-Q168 VanDerWaalsContact O-N 3.09Å; I165-A169 PolarHBondContact O-N 3.24Å; I165-A169 VanDerWaalsContact O-N 3.09Å
166	L	72	Confident	61.7	Low	51 Å²	51	82.4 Å²	82.4	27%	0.267	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-43.5	175.1	-172.2	67.5	0	0	0	111.2	L162 D163 Q168 A169 D170	L162-L166 WeakPolarHBondContact O-CB 3.47Å; L162-L166 PolarHBondContact O-N 3.4Å; D163-L166 PolarHBondContact O-N 2.82Å; L166-Q168 PolarHBondContact O-N 2.92Å; L166-A169 PolarHBondContact O-N 2.74Å; L166-D170 PolarHBondContact O-N 2.66Å
167	S	69.2	Low	60.1	Low	52 Å²	52	82.4 Å²	82.4	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-20.1	177.4	81.5	0	0	0	0	114.4	D163 E164 I165 K171	D163-S167 WeakPolarHBondContact O-CB 3.42Å; D163-S167 PolarHBondContact O-N 3.12Å; E164-S167 PolarHBondContact O-N 3.35Å; E164-S167 PolarHBondContact O-OG 2.78Å; I165-S167 VanDerWaalsContact C-N 3.3Å; I165-S167 PolarHBondContact O-N 3.12Å; S167-K171 WeakPolarHBondContact O-CG 3.3Å
168	Q	65.1	Low	58.3	Low	93 Å²	93	84.4 Å²	84.4	44%	0.435	45%	0.445	S	S	.	.	H	α-helix	trans	-82.5	-42.5	174.1	-70	173.7	8.5	0	0	110.7	E164 I165 L166 D170 K171 E172	E164-Q168 WeakPolarHBondContact O-CG 3.43Å; E164-Q168 PolarHBondContact O-N 3.3Å; I165-Q168 WeakPolarHBondContact O-CB 3.15Å; I165-Q168 PolarHBondContact O-N 3.48Å; I165-Q168 VanDerWaalsContact O-N 3.09Å; L166-Q168 PolarHBondContact O-N 2.92Å; Q168-D170 VanDerWaalsContact C-N 3.35Å; Q168-D170 PolarHBondContact O-N 2.85Å; Q168-K171 PolarHBondContact O-N 2.97Å; Q168-K171 VanDerWaalsContact O-N 3.17Å; Q168-E172 PolarHBondContact O-N 2.93Å
169	A	59.6	Low	56.4	Low	33 Å²	33	90.4 Å²	90.4	27%	0.273	48%	0.481	S	S	.	.	H	α-helix	trans	-60.8	-42.4	175.7	0	0	0	0	0	112	I165 L166 K171 E172 E173	I165-A169 PolarHBondContact O-N 3.24Å; I165-A169 VanDerWaalsContact O-N 3.09Å; L166-A169 PolarHBondContact O-N 2.74Å; A169-K171 PolarHBondContact O-N 2.91Å; A169-E172 PolarHBondContact O-N 2.88Å; A169-E172 VanDerWaalsContact O-N 3.1Å; A169-E173 PolarHBondContact O-N 2.88Å; A169-E173 VanDerWaalsContact O-N 3.17Å
170	D	59.1	Low	54.3	Low	97 Å²	97	92.5 Å²	92.5	52%	0.519	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-29.5	176.9	-75.3	-12.1	0	0	0	112.8	L166 Q168	L166-D170 PolarHBondContact O-N 2.66Å; Q168-D170 VanDerWaalsContact C-N 3.35Å; Q168-D170 PolarHBondContact O-N 2.85Å
171	K	55.5	Low	52.3	Low	150 Å²	150	99.7 Å²	99.7	65%	0.652	52%	0.519	S	S	*	.	H	α-helix	trans	-77.7	-28.1	177.2	-71.8	173.7	-176.1	172	0	112.8	S167 Q168 A169	S167-K171 WeakPolarHBondContact O-CG 3.3Å; Q168-K171 PolarHBondContact O-N 2.97Å; Q168-K171 VanDerWaalsContact O-N 3.17Å; A169-K171 PolarHBondContact O-N 2.91Å
172	E	49.4	Very low	50.4	Low	133 Å²	133	105.6 Å²	105.6	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-76.4	-35.2	177	-68.6	178.6	-179.9	0	0	111.1	Q168 A169 D175 Q176	Q168-E172 PolarHBondContact O-N 2.93Å; A169-E172 PolarHBondContact O-N 2.88Å; A169-E172 VanDerWaalsContact O-N 3.1Å; E172-D175 PolarHBondContact O-N 2.91Å; E172-Q176 PolarHBondContact O-N 2.87Å
173	E	45.3	Very low	48.2	Very low	125 Å²	125	113.5 Å²	113.5	58%	0.584	59%	0.591	S	S	*	*	H	α-helix	trans	-68.1	-35.8	176	-76.3	-165.3	161.5	0	0	113.7	A169 D175 Q176 G177	A169-E173 PolarHBondContact O-N 2.88Å; A169-E173 VanDerWaalsContact O-N 3.17Å; E173-D175 PolarHBondContact O-N 2.84Å; E173-Q176 PolarHBondContact O-N 2.79Å; E173-G177 PolarHBondContact O-N 3.15Å
174	D	45.6	Very low	46.1	Very low	146 Å²	146	114.2 Å²	114.2	78%	0.781	60%	0.604	S	S	*	*	H	α-helix	trans	-65.9	-28.1	176.5	-140.5	23.2	0	0	0	111.4
175	D	43.2	Very low	44	Very low	139 Å²	139	117.8 Å²	117.8	74%	0.743	62%	0.624	S	S	*	*	H	α-helix	trans	-80.2	-30.7	173.3	-111	-0.9	0	0	0	112.5	E172 E173	E172-D175 PolarHBondContact O-N 2.91Å; E173-D175 PolarHBondContact O-N 2.84Å
176	Q	37.2	Very low	42.1	Very low	144 Å²	144	121.7 Å²	121.7	67%	0.673	65%	0.651	S	S	*	*	H	α-helix	trans	-81.4	-14.1	-176.1	-138.7	82.8	23.7	0	0	114.2	E172 E173 T178	E172-Q176 PolarHBondContact O-N 2.87Å; E173-Q176 PolarHBondContact O-N 2.79Å; Q176-T178 VanDerWaalsContact C-N 3.27Å; Q176-T178 PolarHBondContact O-N 2.77Å
177	G	31.3	Very low	39.9	Very low	68 Å²	68	125.6 Å²	125.6	70%	0.701	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-9.1	178.8	0	0	0	0	0	115.6	E173	E173-G177 PolarHBondContact O-N 3.15Å
178	T	28.6	Very low	37.9	Very low	112 Å²	112	131.2 Å²	131.2	69%	0.687	70%	0.701	S	S	*	*			trans	-121.9	56.8	-174.5	-39.2	0	0	0	0	111.5	Q176 D180	Q176-T178 VanDerWaalsContact C-N 3.27Å; Q176-T178 PolarHBondContact O-N 2.77Å; T178-D180 PolarHBondContact O-N 3.21Å; T178-D180 VanDerWaalsContact O-N 3.16Å
179	V	30.2	Very low	35.9	Very low	125 Å²	125	134.7 Å²	134.7	76%	0.758	72%	0.718	S	S	*	*			trans	-85.6	63	166.1	-168.8	0	0	0	0	109.1
180	D	27.9	Very low	34.3	Very low	136 Å²	136	139.1 Å²	139.1	73%	0.727	74%	0.743	S	S	*	*	S	Bend	trans	-160.2	129.4	150.6	-133.7	-19.6	0	0	0	110.2	T178	T178-D180 PolarHBondContact O-N 3.21Å; T178-D180 VanDerWaalsContact O-N 3.16Å
181	R	27.4	Very low	32.7	Very low	220 Å²	220	140.5 Å²	140.5	83%	0.83	76%	0.755	S	S	*	*			trans	75.2	85	177.1	-59.9	-177.2	166.8	-177.6	-6.1	116.9	E183	R181-E183 PolarHBondContact O-N 3.13Å
182	L	30.3	Very low	31.3	Very low	183 Å²	183	144.4 Å²	144.4	96%	0.958	77%	0.766	S	S	*	*			trans	-57.4	61	152.5	-157.7	86.5	0	0	0	112
183	E	26.3	Very low	30.4	Very low	170 Å²	170	147.2 Å²	147.2	79%	0.794	78%	0.776	S	S	*	*	S	Bend	trans	-151.7	125.7	167.5	-103.9	173.4	-160.1	0	0	108.1	R181	R181-E183 PolarHBondContact O-N 3.13Å
184	S	28	Very low	29.5	Very low	114 Å²	114	148 Å²	148	80%	0.797	78%	0.784	S	S	*	*			trans	70.7	88.3	-178.7	44.2	0	0	0	0	117.6	P186	S184-P186 VanDerWaalsContact O-CD 3.22Å; S184-P186 WeakPolarHBondContact O-CD 3.38Å
185	I	27	Very low	28.5	Very low	160 Å²	160	148.9 Å²	148.9	82%	0.821	79%	0.789	S	S	*	*			trans	-75.7	111.2	158.7	-61.2	172	0	0	0	107.9
186	P	26.5	Very low	27.8	Very low	105 Å²	105	148.2 Å²	148.2	68%	0.682	79%	0.794	S	S	*	*			trans	-81.4	129.2	168.5	0.1	20.7	0	0	0	108.6	S184 L188	S184-P186 VanDerWaalsContact O-CD 3.22Å; S184-P186 WeakPolarHBondContact O-CD 3.38Å; P186-L188 PolarHBondContact O-N 3.44Å; P186-L188 VanDerWaalsContact O-N 3.07Å
187	V	26	Very low	27.4	Very low	133 Å²	133	146.6 Å²	146.6	81%	0.806	80%	0.795	S	S	*	*			trans	-65.2	104.9	175.6	179.2	0	0	0	0	108.6	E189	V187-E189 PolarHBondContact O-N 2.94Å
188	L	25.6	Very low	27.2	Very low	169 Å²	169	148.3 Å²	148.3	89%	0.885	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-77.7	116.8	169.9	-75.7	167.5	0	0	0	109.4	P186	P186-L188 PolarHBondContact O-N 3.44Å; P186-L188 VanDerWaalsContact O-N 3.07Å
189	E	23.5	Very low	27.3	Very low	167 Å²	167	147.6 Å²	147.6	78%	0.78	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.9	151.6	173.4	-70.9	-172.5	148.6	0	0	111.7	V187 V191	V187-E189 PolarHBondContact O-N 2.94Å; E189-V191 PolarHBondContact O-N 2.83Å
190	P	27.2	Very low	27.5	Very low	125 Å²	125	146.5 Å²	146.5	81%	0.812	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-79.8	116.6	-165.2	3.4	13.3	0	0	0	111.3	R192	P190-R192 PolarHBondContact O-N 2.91Å
191	V	25.7	Very low	27.5	Very low	126 Å²	126	148 Å²	148	76%	0.764	79%	0.786	S	S	*	*			trans	-71.3	112.2	168.2	177.9	0	0	0	0	108.7	E189 K193	E189-V191 PolarHBondContact O-N 2.83Å; V191-K193 HydrophobicContact CG1-CG 4.43Å; V191-K193 PolarHBondContact O-N 2.75Å
192	R	26.1	Very low	28.3	Very low	232 Å²	232	142 Å²	142	88%	0.875	78%	0.776	S	S	*	*			trans	-65.2	120.6	164.5	-66	178.4	177.4	158.2	-0.2	108.6	P190	P190-R192 PolarHBondContact O-N 2.91Å
193	K	29.5	Very low	29.4	Very low	193 Å²	193	139.3 Å²	139.3	84%	0.839	76%	0.756	S	S	*	*			trans	-131.3	118.5	161.4	-94.8	-174.6	176.3	178.4	0	109.6	V191	V191-K193 HydrophobicContact CG1-CG 4.43Å; V191-K193 PolarHBondContact O-N 2.75Å
194	D	25.8	Very low	31.6	Very low	142 Å²	142	139.5 Å²	139.5	76%	0.759	75%	0.754	S	S	*	*			trans	-68.7	159.1	170.5	-61	-60.9	0	0	0	111.9
195	D	26.4	Very low	34.4	Very low	164 Å²	164	136 Å²	136	88%	0.877	72%	0.724	S	S	*	*			trans	72.1	97	159.9	-58.4	-31.5	0	0	0	120.7
196	C	27	Very low	37.3	Very low	125 Å²	125	128.5 Å²	128.5	85%	0.845	69%	0.686	S	S	*	*			trans	-157.4	141.1	142.7	-154	0	0	0	0	110.5
197	P	30	Very low	40.2	Very low	109 Å²	109	126.5 Å²	126.5	71%	0.708	67%	0.672	S	S	*	*			trans	-90.5	137.3	-156.2	33.1	-29	0	0	0	114.3
198	S	26.2	Very low	43.1	Very low	105 Å²	105	122.9 Å²	122.9	73%	0.734	65%	0.648	S	S	*	*			trans	53.5	58.9	156.8	58.3	0	0	0	0	117	I200	S198-I200 PolarHBondContact O-N 2.75Å
199	T	30.4	Very low	46	Very low	96 Å²	96	117.8 Å²	117.8	59%	0.589	63%	0.625	S	S	*	*			trans	-46.5	131.6	144	-47.4	0	0	0	0	108.4	M201	T199-M201 PolarHBondContact O-N 3.03Å
200	I	34.8	Very low	49.1	Very low	103 Å²	103	116.7 Å²	116.7	53%	0.528	62%	0.624	S	S	.	*			trans	-51.3	96.8	165.7	-65.3	171.8	0	0	0	106.5	E160 S198 P202	E160-I200 WeakPolarHBondContact OE2-CD1 3.45Å; S198-I200 PolarHBondContact O-N 2.75Å; I200-P202 WeakPolarHBondContact O-CD 3.34Å
201	M	29	Very low	52	Low	166 Å²	166	114.4 Å²	114.4	82%	0.818	60%	0.603	S	S	*	*			trans	-61.7	116.9	-170.5	-70	-147	118.3	0	0	107.1	T199 K203	T199-M201 PolarHBondContact O-N 3.03Å; M201-K203 PolarHBondContact O-N 3.47Å
202	P	42.6	Very low	55	Low	96 Å²	96	108.5 Å²	108.5	62%	0.623	57%	0.567	S	S	*	*			trans	-56.2	117.8	169.9	21.7	-29.3	0	0	0	105.6	I200 K204	I200-P202 WeakPolarHBondContact O-CD 3.34Å; P202-K204 PolarHBondContact O-N 3.37Å
203	K	54	Low	58	Low	125 Å²	125	103.2 Å²	103.2	54%	0.543	55%	0.548	S	S	.	.			trans	-39.4	118	179.2	-78.1	-175.9	177.6	174.2	0	108	M201 R205 C219	M201-K203 PolarHBondContact O-N 3.47Å; K203-R205 PolarHBondContact O-N 2.83Å; K203-C219 HydrophobicContact CB-CB 4.13Å; K203-C219 HydrophobicContact CD-CB 3.93Å
204	K	72.2	Confident	60.8	Low	174 Å²	174	96 Å²	96	76%	0.757	53%	0.529	S	S	*	.			trans	-45.6	116.1	-172.4	-170.8	178	-179.1	-177.7	0	108.1	P202 S220	P202-K204 PolarHBondContact O-N 3.37Å; K204-S220 WeakPolarHBondContact O-CB 3.36Å; K204-S220 PolarHBondContact O-OG 3.22Å
205	R	86.5	Confident	64	Low	40 Å²	40	93.3 Å²	93.3	15%	0.151	51%	0.507	C	S	.	.			trans	-61.4	153.8	177.4	-67.7	-173.7	179.5	177.3	3.1	109.5	K203 T207 S220 D307 C308 T311 F312	K203-R205 PolarHBondContact O-N 2.83Å; R205-T207 HydrophobicContact CB-CG2 4.47Å; R205-T207 PolarHBondContact O-N 3.08Å; R205-S220 PolarHBondContact O-OG 3.3Å; R205-D307 IonicContact CZ-OD2 3.81Å; R205-D307 IonicContact NE-OD2 3.17Å; R205-D307 IonicContact NH1-OD2 3.79Å; R205-D307 PolarHBondContact NH1-OD2 3.35Å; R205-D307 VanDerWaalsContact NH1-OD2 3.09Å; R205-D307 IonicContact NH2-OD2 2.75Å; R205-D307 PolarHBondContact NH2-OD2 3.16Å; R205-C308 PolarHBondContact NH1-SG 3.43Å; R205-T311 HydrophobicContact CB-CG2 4.38Å; R205-F312 HydrophobicContact CB-CZ 3.97Å; R205-F312 HydrophobicContact CG-CZ 4.49Å
206	C	87.5	Confident	67.2	Low	3 Å²	3	85.5 Å²	85.5	2%	0.02	47%	0.466	C	S	.	.			trans	-79.5	91.6	-178.5	-171	0	0	0	0	109.3	V217 S220	C206-V217 PolarHBondContact N-O 3.38Å; C206-S220 WeakPolarHBondContact CA-OG 3.41Å; C206-S220 WeakPolarHBondContact CB-OG 3.27Å; C206-S220 PolarHBondContact N-OG 2.86Å
207	T	88.4	Confident	70.3	Confident	64 Å²	64	79.5 Å²	79.5	39%	0.393	43%	0.425	S	S	.	.			trans	-99.6	0.5	-179.4	59.5	0	0	0	0	113.2	R205 P209 T311 F312 I339	R205-T207 HydrophobicContact CB-CG2 4.47Å; R205-T207 PolarHBondContact O-N 3.08Å; T207-P209 WeakPolarHBondContact O-CD 3.38Å; T207-T311 HydrophobicContact CG2-CG2 3.75Å; T207-F312 HydrophobicContact CG2-CE1 4.32Å; T207-I339 WeakPolarHBondContact O-CD1 3.23Å
208	N	87.3	Confident	73.2	Confident	56 Å²	56	74.8 Å²	74.8	30%	0.299	39%	0.394	S	S	.	.			trans	-83	118.8	174.4	-176.7	-5.6	0	0	0	109.5	D210 E211 I212	N208-D210 PolarHBondContact O-N 3.1Å; N208-D210 PolarHBondContact OD1-N 3Å; N208-E211 HydrophobicContact CB-CB 4.12Å; N208-E211 HydrophobicContact CB-CG 4.24Å; N208-E211 PolarHBondContact ND2-OE1 3.18Å; N208-E211 PolarHBondContact O-N 3.27Å; N208-E211 VanDerWaalsContact O-N 3.15Å; N208-I212 PolarHBondContact O-N 3.02Å; N208-I212 VanDerWaalsContact O-N 3.1Å
209	P	86.4	Confident	76.1	Confident	62 Å²	62	70.6 Å²	70.6	40%	0.403	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-34.8	176.1	-25.2	33.7	0	0	0	114.1	T207 E211 I212 I339	T207-P209 WeakPolarHBondContact O-CD 3.38Å; P209-E211 VanDerWaalsContact C-N 3.32Å; P209-E211 PolarHBondContact O-N 3.18Å; P209-I212 WeakPolarHBondContact O-CG2 3.2Å; P209-I339 HydrophobicContact CG-CB 4.32Å; P209-I339 HydrophobicContact CG-CD1 4.41Å; P209-I339 HydrophobicContact CG-CG2 3.85Å
210	D	87.6	Confident	78.9	Confident	145 Å²	145	67.5 Å²	67.5	78%	0.775	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.2	-176.7	-62.5	-32.9	0	0	0	112.2	N208	N208-D210 PolarHBondContact O-N 3.1Å; N208-D210 PolarHBondContact OD1-N 3Å
211	E	89.1	Confident	81.5	Confident	77 Å²	77	64.1 Å²	64.1	36%	0.36	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-17.6	-176.6	-67.9	176	-136.7	0	0	113.5	N208 P209 Y213 G214 R215	N208-E211 HydrophobicContact CB-CB 4.12Å; N208-E211 HydrophobicContact CB-CG 4.24Å; N208-E211 PolarHBondContact ND2-OE1 3.18Å; N208-E211 PolarHBondContact O-N 3.27Å; N208-E211 VanDerWaalsContact O-N 3.15Å; P209-E211 VanDerWaalsContact C-N 3.32Å; P209-E211 PolarHBondContact O-N 3.18Å; E211-Y213 PolarHBondContact O-N 2.89Å; E211-Y213 VanDerWaalsContact O-N 3.1Å; E211-G214 PolarHBondContact O-N 3.46Å; E211-R215 HydrophobicContact CB-CG 4.33Å; E211-R215 PolarHBondContact O-N 3.42Å; E211-R215 VanDerWaalsContact O-N 3.08Å; E211-R215 VanDerWaalsContact OE2-CD 3.28Å; E211-R215 WeakPolarHBondContact OE2-CD 3.46Å; E211-R215 IonicContact OE2-NE 3.42Å; E211-R215 IonicContact OE2-NH1 2.69Å
212	I	88.3	Confident	84.3	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.4	-169.5	-155.7	160.6	0	0	0	114.1	N208 P209 A237 I339 L340	N208-I212 PolarHBondContact O-N 3.02Å; N208-I212 VanDerWaalsContact O-N 3.1Å; P209-I212 WeakPolarHBondContact O-CG2 3.2Å; I212-A237 HydrophobicContact CG1-CB 4.32Å; I212-I339 HydrophobicContact CD1-CD1 3.66Å; I212-I339 HydrophobicContact CD1-CG1 3.95Å; I212-L340 HydrophobicContact CD1-CD2 3.43Å; I212-L340 VanDerWaalsContact CD1-CD2 3.43Å; I212-L340 HydrophobicContact CD1-CG 4.18Å; I212-L340 HydrophobicContact CG1-CD2 4.27Å
213	Y	89.1	Confident	86.2	Confident	122 Å²	122	59.5 Å²	59.5	48%	0.478	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-18.7	178.8	-57.1	-68.5	0	0	0	113.5	E211 F236 K238	E211-Y213 PolarHBondContact O-N 2.89Å; E211-Y213 VanDerWaalsContact O-N 3.1Å; Y213-F236 HydrophobicContact CE1-CB 3.85Å; Y213-F236 VanDerWaalsContact CE1-O 3.25Å; Y213-F236 WeakPolarHBondContact CE1-O 3.35Å; Y213-K238 WeakPolarHBondContact O-CE 3.37Å; Y213-K238 VanDerWaalsContact O-CG 3.27Å; Y213-K238 WeakPolarHBondContact O-CG 3.43Å
214	G	89.4	Confident	87.4	Confident	42 Å²	42	57.7 Å²	57.7	43%	0.433	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	0.9	-177.1	0	0	0	0	0	114.5	E211 L229	E211-G214 PolarHBondContact O-N 3.46Å; G214-L229 VanDerWaalsContact O-CD1 3.26Å; G214-L229 WeakPolarHBondContact O-CD1 3.17Å
215	R	92.7	Very high	87.4	Confident	84 Å²	84	59.6 Å²	59.6	32%	0.317	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-135.5	156	-179	-55.4	-171.2	105.5	94.1	2.1	111.5	E211 V217 S220 S221	E211-R215 HydrophobicContact CB-CG 4.33Å; E211-R215 PolarHBondContact O-N 3.42Å; E211-R215 VanDerWaalsContact O-N 3.08Å; E211-R215 VanDerWaalsContact OE2-CD 3.28Å; E211-R215 WeakPolarHBondContact OE2-CD 3.46Å; E211-R215 IonicContact OE2-NE 3.42Å; E211-R215 IonicContact OE2-NH1 2.69Å; R215-V217 PolarHBondContact O-N 2.93Å; R215-S220 PolarHBondContact NE-O 3.14Å; R215-S221 WeakPolarHBondContact CA-O 3.35Å
216	C	92.6	Very high	86.6	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-63.6	125.5	175.6	179.4	0	0	0	0	111.5	L218 C219 S220 S221 L229 K238 C240	C216-L218 PolarHBondContact O-N 2.78Å; C216-L218 PolarHBondContact SG-N 2.88Å; C216-C219 PolarHBondContact O-N 3.09Å; C216-C219 VanDerWaalsContact SG-SG 3.67Å; C216-S220 WeakPolarHBondContact O-CA 3.36Å; C216-S220 PolarHBondContact O-N 2.69Å; C216-S221 WeakPolarHBondContact CB-OG 3.28Å; C216-S221 PolarHBondContact N-O 3.11Å; C216-L229 HydrophobicContact CB-CD2 4.23Å; C216-K238 CarbonylContact C-O 3.57Å; C216-K238 WeakPolarHBondContact CA-O 3.2Å; C216-C240 HydrophobicContact CB-CB 3.87Å; C216-C240 PolarHBondContact SG-N 3.29Å; C216-C240 VanDerWaalsContact SG-N 3.38Å
217	V	93.4	Very high	85.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-29.5	179.7	68.2	0	0	0	0	113.3	C206 R215 A237 K238 L239 F312 L340	C206-V217 PolarHBondContact N-O 3.38Å; R215-V217 PolarHBondContact O-N 2.93Å; V217-A237 HydrophobicContact CB-CB 4.01Å; V217-A237 HydrophobicContact CG1-CB 4.33Å; V217-A237 HydrophobicContact CG2-CB 4.21Å; V217-K238 WeakPolarHBondContact CG1-O 3.16Å; V217-K238 PolarHBondContact N-O 3.14Å; V217-L239 HydrophobicContact CG1-CD2 3.96Å; V217-F312 HydrophobicContact CG2-CE1 3.82Å; V217-F312 HydrophobicContact CG2-CZ 3.61Å; V217-L340 HydrophobicContact CG2-CD2 4.2Å
218	L	89.6	Confident	85.6	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.052	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-18.5	-173.7	-56.1	-173.9	0	0	0	114.9	C216 L239 C243 K264 Y267 C286	C216-L218 PolarHBondContact O-N 2.78Å; C216-L218 PolarHBondContact SG-N 2.88Å; L218-L239 HydrophobicContact CD1-CD2 3.55Å; L218-L239 HydrophobicContact CG-CD2 3.7Å; L218-C243 HydrophobicContact CB-CB 4.37Å; L218-C243 HydrophobicContact CD1-CB 4.22Å; L218-K264 PolarHBondContact O-NZ 3.36Å; L218-K264 VanDerWaalsContact O-NZ 3.15Å; L218-Y267 HydrophobicContact CD1-CD2 4.38Å; L218-C286 HydrophobicContact CD2-CB 3.62Å
219	C	87.7	Confident	85.8	Confident	17 Å²	17	60.4 Å²	60.4	12%	0.115	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145	-0	-176.3	74.2	0	0	0	0	115.4	K203 C216 S221	K203-C219 HydrophobicContact CB-CB 4.13Å; K203-C219 HydrophobicContact CD-CB 3.93Å; C216-C219 PolarHBondContact O-N 3.09Å; C216-C219 VanDerWaalsContact SG-SG 3.67Å; C219-S221 PolarHBondContact O-N 3.05Å; C219-S221 VanDerWaalsContact O-N 3.13Å; C219-S221 PolarHBondContact SG-OG 2.83Å
220	S	89.8	Confident	86	Confident	30 Å²	30	59.3 Å²	59.3	21%	0.21	33%	0.333	C	S	.	.			trans	59.1	14.4	-177.8	-55.9	0	0	0	0	115.9	K204 R205 C206 R215 C216	K204-S220 WeakPolarHBondContact O-CB 3.36Å; K204-S220 PolarHBondContact O-OG 3.22Å; R205-S220 PolarHBondContact O-OG 3.3Å; C206-S220 WeakPolarHBondContact CA-OG 3.41Å; C206-S220 WeakPolarHBondContact CB-OG 3.27Å; C206-S220 PolarHBondContact N-OG 2.86Å; R215-S220 PolarHBondContact NE-O 3.14Å; C216-S220 WeakPolarHBondContact O-CA 3.36Å; C216-S220 PolarHBondContact O-N 2.69Å
221	S	87.6	Confident	86.2	Confident	32 Å²	32	54.9 Å²	54.9	22%	0.224	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-65.6	134.8	174.8	66.5	0	0	0	0	110.2	R215 C216 C219 C240	R215-S221 WeakPolarHBondContact CA-O 3.35Å; C216-S221 WeakPolarHBondContact CB-OG 3.28Å; C216-S221 PolarHBondContact N-O 3.11Å; C219-S221 PolarHBondContact O-N 3.05Å; C219-S221 VanDerWaalsContact O-N 3.13Å; C219-S221 PolarHBondContact SG-OG 2.83Å; S221-C240 WeakPolarHBondContact OG-CB 3.42Å; S221-C240 PolarHBondContact OG-SG 2.9Å
222	P	87.9	Confident	86.4	Confident	52 Å²	52	51.2 Å²	51.2	34%	0.338	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-68.1	170.4	171	32	-34	0	0	0	110.9
223	E	83	Confident	86.7	Confident	114 Å²	114	51.1 Å²	51.1	53%	0.533	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-65.3	137	164.6	-172.7	157.4	-139.6	0	0	110.5	P228 L229	E223-P228 WeakPolarHBondContact OE1-CA 3.49Å; E223-L229 HydrophobicContact CB-CD1 3.9Å; E223-L229 HydrophobicContact CB-CG 3.86Å; E223-L229 HydrophobicContact CG-CG 4.3Å; E223-L229 PolarHBondContact OE1-N 3.45Å
224	N	79.4	Confident	86.9	Confident	87 Å²	87	45.3 Å²	45.3	47%	0.465	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-123.3	149.1	176.3	-59.9	-33.5	0	0	0	108.8	G226 S227	N224-G226 PolarHBondContact O-N 3.18Å; N224-S227 CarbonylContact O-C 3.5Å; N224-S227 PolarHBondContact O-N 3.45Å
225	E	71.7	Confident	87.1	Confident	213 Å²	213	43.3 Å²	43.3	100%	0.995	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-28	-176.8	-66.4	-174.7	168	0	0	114.3
226	G	70.7	Confident	87.2	Confident	70 Å²	70	42.9 Å²	42.9	72%	0.722	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-2.3	177.9	0	0	0	0	0	115.9	N224	N224-G226 PolarHBondContact O-N 3.18Å
227	S	73.1	Confident	87.2	Confident	12 Å²	12	43 Å²	43	8%	0.084	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-146.6	83.7	-178.5	65.8	0	0	0	0	110	N224	N224-S227 CarbonylContact O-C 3.5Å; N224-S227 PolarHBondContact O-N 3.45Å
228	P	82.4	Confident	87.2	Confident	82 Å²	82	45.5 Å²	45.5	53%	0.532	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-63.7	154.9	-178.6	26.3	-33.9	0	0	0	111.6	E223	E223-P228 WeakPolarHBondContact OE1-CA 3.49Å
229	L	90.3	Very high	87.4	Confident	16 Å²	16	45 Å²	45	8%	0.084	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-86	118.3	177.4	-74.1	-176.8	0	0	0	111	G214 C216 E223 K238 C240	G214-L229 VanDerWaalsContact O-CD1 3.26Å; G214-L229 WeakPolarHBondContact O-CD1 3.17Å; C216-L229 HydrophobicContact CB-CD2 4.23Å; E223-L229 HydrophobicContact CB-CD1 3.9Å; E223-L229 HydrophobicContact CB-CG 3.86Å; E223-L229 HydrophobicContact CG-CG 4.3Å; E223-L229 PolarHBondContact OE1-N 3.45Å; L229-K238 HydrophobicContact CB-CB 3.99Å; L229-K238 HydrophobicContact CB-CD 4.16Å; L229-K238 HydrophobicContact CB-CG 4.17Å; L229-K238 HydrophobicContact CD1-CB 3.93Å; L229-K238 HydrophobicContact CD1-CG 4.14Å; L229-K238 HydrophobicContact CD2-CB 4.4Å; L229-K238 HydrophobicContact CG-CB 4.33Å; L229-C240 HydrophobicContact CD2-CB 3.65Å
230	S	90.1	Very high	87.5	Confident	40 Å²	40	44.4 Å²	44.4	28%	0.28	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	154.7	173.3	-45.7	0	0	0	0	111.1	K238 L239 Q244	S230-K238 CarbonylContact O-C 3.55Å; S230-K238 WeakPolarHBondContact O-CA 3.35Å; S230-L239 PolarHBondContact N-O 3.05Å; S230-L239 PolarHBondContact O-N 3.03Å; S230-Q244 PolarHBondContact OG-NE2 2.89Å; S230-Q244 PolarHBondContact OG-OE1 3.43Å
231	D	92.8	Very high	87.2	Confident	51 Å²	51	46.3 Å²	46.3	27%	0.273	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.1	175.4	-82.1	-10.7	0	0	0	111.6	K238 R343	D231-K238 WeakPolarHBondContact OD1-CD 3.32Å; D231-K238 WeakPolarHBondContact OD1-CE 3.43Å; D231-K238 IonicContact OD1-NZ 2.63Å; D231-K238 PolarHBondContact OD1-NZ 3.42Å; D231-R343 IonicContact OD1-CZ 3.8Å; D231-R343 IonicContact OD1-NH2 3.03Å; D231-R343 PolarHBondContact OD1-NH2 3.16Å; D231-R343 IonicContact OD2-CZ 2.76Å; D231-R343 VanDerWaalsContact OD2-CZ 3.28Å; D231-R343 IonicContact OD2-NH1 2.63Å; D231-R343 PolarHBondContact OD2-NH1 2.97Å; D231-R343 IonicContact OD2-NH2 3.97Å; D231-R343 PolarHBondContact OD2-NH2 3.3Å; D231-R343 VanDerWaalsContact OD2-NH2 3.09Å
232	H	94.1	Very high	87	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-67.6	136.2	167.2	-175.2	-79.1	0	0	0	109.4	F234 F235 A237 L239 Y267 L285 R343	H232-F234 AromaticContact CE1-CD2 3.93Å; H232-F234 PolarHBondContact ND1-N 3.07Å; H232-F234 PolarHBondContact O-N 3.2Å; H232-F235 AromaticContact CE1-CD2 3.59Å; H232-F235 AromaticContact ND1-CD2 3.63Å; H232-F235 PolarHBondContact ND1-N 3.25Å; H232-F235 VanDerWaalsContact O-O 3.09Å; H232-A237 HydrophobicContact CB-CB 4.25Å; H232-A237 WeakPolarHBondContact CB-O 3.41Å; H232-A237 PolarHBondContact N-O 3.31Å; H232-L239 HydrophobicContact CB-CD1 4.44Å; H232-L239 HydrophobicContact CB-CG 4.25Å; H232-Y267 AromaticContact NE2-CE2 3.74Å; H232-Y267 AromaticContact NE2-CZ 3.75Å; H232-Y267 PolarHBondContact NE2-OH 2.88Å; H232-L285 PolarHBondContact NE2-O 3.34Å; H232-R343 WeakPolarHBondContact O-CD 3.17Å; H232-R343 PolarHBondContact O-NE 3.31Å
233	P	92.7	Very high	86.9	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-63	-42.6	-169.3	21.7	-32.7	0	0	0	112.8	Y267 W346 L350 L353	P233-Y267 HydrophobicContact CG-CE1 3.95Å; P233-Y267 WeakPolarHBondContact CG-OH 3.3Å; P233-W346 WeakPolarHBondContact O-CA 3.43Å; P233-W346 WeakPolarHBondContact O-CB 3.49Å; P233-L350 HydrophobicContact CB-CB 4.02Å; P233-L350 HydrophobicContact CB-CD1 3.78Å; P233-L350 HydrophobicContact CG-CD1 4.23Å; P233-L353 HydrophobicContact CG-CD2 4.25Å
234	F	94	Very high	87	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-98.5	-15.2	-173.6	-56.4	-69.9	0	0	0	116	H232 Y271 A284 N331 V342 R343 W346	H232-F234 AromaticContact CE1-CD2 3.93Å; H232-F234 PolarHBondContact ND1-N 3.07Å; H232-F234 PolarHBondContact O-N 3.2Å; F234-Y271 AromaticContact CE2-CE2 3.63Å; F234-Y271 HydrophobicContact CE2-CE2 3.63Å; F234-Y271 AromaticContact CZ-CE2 3.69Å; F234-Y271 HydrophobicContact CZ-CE2 3.69Å; F234-Y271 WeakPolarHBondContact CZ-OH 3.15Å; F234-A284 HydrophobicContact CD2-CB 4.23Å; F234-A284 HydrophobicContact CE2-CB 3.85Å; F234-N331 HydrophobicContact CD1-CB 4.32Å; F234-V342 CarbonylContact O-C 3.54Å; F234-V342 WeakPolarHBondContact O-CA 3.37Å; F234-R343 PolarHBondContact O-N 3.29Å; F234-W346 HydrophobicContact CD1-CB 4.04Å; F234-W346 HydrophobicContact CD1-CD2 4.01Å; F234-W346 AromaticContact CD1-CE3 3.84Å; F234-W346 HydrophobicContact CD1-CE3 3.84Å; F234-W346 HydrophobicContact CD1-CG 4.12Å; F234-W346 AromaticContact CE1-CD2 3.84Å; F234-W346 HydrophobicContact CE1-CD2 3.84Å; F234-W346 AromaticContact CE1-CE3 3.31Å; F234-W346 HydrophobicContact CE1-CE3 3.31Å; F234-W346 HydrophobicContact CE1-CG 4.43Å; F234-W346 AromaticContact CE1-CZ3 3.73Å; F234-W346 HydrophobicContact CE1-CZ3 3.73Å; F234-W346 HydrophobicContact CZ-CE3 4.23Å; F234-W346 HydrophobicContact CZ-CZ3 4.37Å
235	F	94.7	Very high	87	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-134.2	148.9	-170.4	-60.8	-81.7	0	0	0	110.2	H232 A237 L285 Y304 F330 L337 L340 V341 V342 R343	H232-F235 AromaticContact CE1-CD2 3.59Å; H232-F235 AromaticContact ND1-CD2 3.63Å; H232-F235 PolarHBondContact ND1-N 3.25Å; H232-F235 VanDerWaalsContact O-O 3.09Å; F235-A237 HydrophobicContact CB-CB 4.5Å; F235-A237 PolarHBondContact O-N 3.34Å; F235-L285 HydrophobicContact CD2-CD1 3.51Å; F235-L285 HydrophobicContact CE2-CB 4.2Å; F235-L285 HydrophobicContact CE2-CD1 3.7Å; F235-L285 HydrophobicContact CE2-CG 4.41Å; F235-L285 HydrophobicContact CG-CD1 4.42Å; F235-Y304 AromaticContact CE2-CE1 3.8Å; F235-Y304 HydrophobicContact CE2-CE1 3.8Å; F235-Y304 AromaticContact CZ-CE1 3.74Å; F235-Y304 HydrophobicContact CZ-CE1 3.74Å; F235-F330 HydrophobicContact CE1-CB 4.12Å; F235-F330 HydrophobicContact CZ-CB 4.14Å; F235-F330 HydrophobicContact CZ-CD2 4.27Å; F235-F330 HydrophobicContact CZ-CG 4.44Å; F235-L337 HydrophobicContact CE1-CB 4Å; F235-L337 HydrophobicContact CZ-CB 4.41Å; F235-L337 HydrophobicContact CZ-CD2 4.31Å; F235-L340 HydrophobicContact CB-CB 4.41Å; F235-L340 HydrophobicContact CB-CD2 4.22Å; F235-L340 HydrophobicContact CD1-CB 3.7Å; F235-L340 HydrophobicContact CE1-CB 4.2Å; F235-L340 HydrophobicContact CG-CB 4.16Å; F235-V341 CarbonylContact C-O 3.43Å; F235-V341 WeakPolarHBondContact CA-O 3.46Å; F235-V342 HydrophobicContact CD1-CG2 4.07Å; F235-V342 HydrophobicContact CE1-CG2 3.77Å; F235-R343 PolarHBondContact O-NE 3.23Å
236	F	93.4	Very high	86.9	Confident	75 Å²	75	31 Å²	31	33%	0.329	19%	0.193	S	C	.	.	S	Bend	trans	-70.6	75.4	170.7	-71.1	-82.8	0	0	0	110	Y213 V341 R343	Y213-F236 HydrophobicContact CE1-CB 3.85Å; Y213-F236 VanDerWaalsContact CE1-O 3.25Å; Y213-F236 WeakPolarHBondContact CE1-O 3.35Å; F236-V341 HydrophobicContact CD2-CB 3.92Å; F236-V341 HydrophobicContact CD2-CG1 3.83Å; F236-V341 HydrophobicContact CE2-CG1 4.2Å; F236-V341 PolarHBondContact N-O 3.29Å; F236-R343 HydrophobicContact CD1-CG 4.14Å; F236-R343 HydrophobicContact CD2-CG 3.88Å; F236-R343 HydrophobicContact CE1-CG 4.19Å; F236-R343 HydrophobicContact CE2-CB 4.46Å; F236-R343 HydrophobicContact CE2-CG 3.95Å; F236-R343 HydrophobicContact CG-CG 3.99Å; F236-R343 HydrophobicContact CZ-CG 4.1Å
237	A	93.8	Very high	86.1	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.008	18%	0.18	C	C	.	.			trans	-150.8	172.5	179.4	0	0	0	0	0	108.9	I212 V217 H232 F235 L340	I212-A237 HydrophobicContact CG1-CB 4.32Å; V217-A237 HydrophobicContact CB-CB 4.01Å; V217-A237 HydrophobicContact CG1-CB 4.33Å; V217-A237 HydrophobicContact CG2-CB 4.21Å; H232-A237 HydrophobicContact CB-CB 4.25Å; H232-A237 WeakPolarHBondContact CB-O 3.41Å; H232-A237 PolarHBondContact N-O 3.31Å; F235-A237 HydrophobicContact CB-CB 4.5Å; F235-A237 PolarHBondContact O-N 3.34Å; A237-L340 HydrophobicContact CB-CD2 3.85Å
238	K	93.6	Very high	84.9	Confident	54 Å²	54	36.1 Å²	36.1	24%	0.235	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.5	-175.8	-62.9	-63.1	-171.6	171	0	113.5	Y213 C216 V217 L229 S230 D231	Y213-K238 WeakPolarHBondContact O-CE 3.37Å; Y213-K238 VanDerWaalsContact O-CG 3.27Å; Y213-K238 WeakPolarHBondContact O-CG 3.43Å; C216-K238 CarbonylContact C-O 3.57Å; C216-K238 WeakPolarHBondContact CA-O 3.2Å; V217-K238 WeakPolarHBondContact CG1-O 3.16Å; V217-K238 PolarHBondContact N-O 3.14Å; L229-K238 HydrophobicContact CB-CB 3.99Å; L229-K238 HydrophobicContact CB-CD 4.16Å; L229-K238 HydrophobicContact CB-CG 4.17Å; L229-K238 HydrophobicContact CD1-CB 3.93Å; L229-K238 HydrophobicContact CD1-CG 4.14Å; L229-K238 HydrophobicContact CD2-CB 4.4Å; L229-K238 HydrophobicContact CG-CB 4.33Å; S230-K238 CarbonylContact O-C 3.55Å; S230-K238 WeakPolarHBondContact O-CA 3.35Å; D231-K238 WeakPolarHBondContact OD1-CD 3.32Å; D231-K238 WeakPolarHBondContact OD1-CE 3.43Å; D231-K238 IonicContact OD1-NZ 2.63Å; D231-K238 PolarHBondContact OD1-NZ 3.42Å
239	L	91.9	Very high	83	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.2	172.8	-68.4	174.6	0	0	0	109.8	V217 L218 S230 H232 Q244 Y267 L353	V217-L239 HydrophobicContact CG1-CD2 3.96Å; L218-L239 HydrophobicContact CD1-CD2 3.55Å; L218-L239 HydrophobicContact CG-CD2 3.7Å; S230-L239 PolarHBondContact N-O 3.05Å; S230-L239 PolarHBondContact O-N 3.03Å; H232-L239 HydrophobicContact CB-CD1 4.44Å; H232-L239 HydrophobicContact CB-CG 4.25Å; L239-Q244 HydrophobicContact CB-CG 3.75Å; L239-Q244 HydrophobicContact CD1-CG 4.4Å; L239-Q244 PolarHBondContact O-NE2 3.34Å; L239-Y267 HydrophobicContact CD1-CD1 3.88Å; L239-Y267 HydrophobicContact CD1-CE1 4.12Å; L239-Y267 HydrophobicContact CD1-CG 4.09Å; L239-L353 HydrophobicContact CD1-CD2 4.36Å
240	C	90.1	Very high	80.6	Confident	4 Å²	4	41 Å²	41	3%	0.027	22%	0.222	C	C	.	.			trans	-81.3	155.2	171	69.2	0	0	0	0	111.5	C216 S221 L229 N242 C243 Q244	C216-C240 HydrophobicContact CB-CB 3.87Å; C216-C240 PolarHBondContact SG-N 3.29Å; C216-C240 VanDerWaalsContact SG-N 3.38Å; S221-C240 WeakPolarHBondContact OG-CB 3.42Å; S221-C240 PolarHBondContact OG-SG 2.9Å; L229-C240 HydrophobicContact CD2-CB 3.65Å; C240-N242 PolarHBondContact O-N 3.41Å; C240-C243 PolarHBondContact O-N 3.05Å; C240-Q244 WeakPolarHBondContact O-CG 3.34Å; C240-Q244 PolarHBondContact O-N 2.9Å
241	E	84.6	Confident	78.2	Confident	69 Å²	69	41 Å²	41	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-49.1	-45.6	178.1	-172.7	-174.4	-158.1	0	0	112.1	C243 Q244 V245 K247	E241-C243 VanDerWaalsContact C-N 3.28Å; E241-C243 PolarHBondContact O-N 3.04Å; E241-Q244 WeakPolarHBondContact O-CA 3.38Å; E241-Q244 WeakPolarHBondContact O-CB 3.35Å; E241-Q244 PolarHBondContact O-N 3.48Å; E241-V245 HydrophobicContact CG-CG2 3.83Å; E241-V245 VanDerWaalsContact O-CG2 3.29Å; E241-V245 WeakPolarHBondContact O-CG2 3.27Å; E241-V245 PolarHBondContact O-N 2.77Å; E241-K247 WeakPolarHBondContact OE2-CE 3.34Å; E241-K247 IonicContact OE2-NZ 2.66Å; E241-K247 PolarHBondContact OE2-NZ 2.94Å
242	N	83.3	Confident	75.2	Confident	60 Å²	60	46.6 Å²	46.6	32%	0.321	25%	0.251	S	S	.	.	I	π-helix	trans	-60	-35.9	-179.8	-65.2	9.9	0	0	0	113.1	C240 G246 K247	C240-N242 PolarHBondContact O-N 3.41Å; N242-G246 WeakPolarHBondContact O-CA 3.24Å; N242-G246 PolarHBondContact O-N 2.91Å; N242-K247 WeakPolarHBondContact OD1-CD 3.46Å; N242-K247 VanDerWaalsContact OD1-CE 3.23Å; N242-K247 WeakPolarHBondContact OD1-CE 3.45Å; N242-K247 WeakPolarHBondContact OD1-CG 3.41Å
243	C	86	Confident	72.7	Confident	17 Å²	17	50.1 Å²	50.1	12%	0.115	27%	0.272	C	S	.	.	I	π-helix	trans	-80.9	-23.5	175.3	-66.4	0	0	0	0	112.4	L218 C240 E241 Y267	L218-C243 HydrophobicContact CB-CB 4.37Å; L218-C243 HydrophobicContact CD1-CB 4.22Å; C240-C243 PolarHBondContact O-N 3.05Å; E241-C243 VanDerWaalsContact C-N 3.28Å; E241-C243 PolarHBondContact O-N 3.04Å; C243-Y267 WeakPolarHBondContact O-CB 3.37Å; C243-Y267 PolarHBondContact O-N 3.24Å
244	Q	85.3	Confident	70.4	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.028	31%	0.311	C	S	.	.	I	π-helix	trans	-76.7	-51.5	178.5	-69.5	177.9	50.1	0	0	112.6	S230 L239 C240 E241 P266 Y267 K268 L353	S230-Q244 PolarHBondContact OG-NE2 2.89Å; S230-Q244 PolarHBondContact OG-OE1 3.43Å; L239-Q244 HydrophobicContact CB-CG 3.75Å; L239-Q244 HydrophobicContact CD1-CG 4.4Å; L239-Q244 PolarHBondContact O-NE2 3.34Å; C240-Q244 WeakPolarHBondContact O-CG 3.34Å; C240-Q244 PolarHBondContact O-N 2.9Å; E241-Q244 WeakPolarHBondContact O-CA 3.38Å; E241-Q244 WeakPolarHBondContact O-CB 3.35Å; E241-Q244 PolarHBondContact O-N 3.48Å; Q244-P266 CarbonylContact O-C 3.44Å; Q244-P266 WeakPolarHBondContact O-CB 3.33Å; Q244-Y267 PolarHBondContact O-N 2.99Å; Q244-K268 HydrophobicContact CB-CD 4.34Å; Q244-K268 HydrophobicContact CB-CG 4.32Å; Q244-K268 WeakPolarHBondContact O-CB 3.41Å; Q244-K268 PolarHBondContact O-N 3.47Å; Q244-K268 VanDerWaalsContact OE1-CE 3.27Å; Q244-L353 HydrophobicContact CG-CD1 4.22Å; Q244-L353 VanDerWaalsContact OE1-CD1 3.28Å
245	V	78.5	Confident	68	Low	65 Å²	65	64.9 Å²	64.9	39%	0.394	35%	0.351	S	S	.	.	I	π-helix	trans	-110.8	-9.5	-172.6	-60.5	0	0	0	0	114	E241 P266 K268	E241-V245 HydrophobicContact CG-CG2 3.83Å; E241-V245 VanDerWaalsContact O-CG2 3.29Å; E241-V245 WeakPolarHBondContact O-CG2 3.27Å; E241-V245 PolarHBondContact O-N 2.77Å; V245-P266 WeakPolarHBondContact O-CB 3.38Å; V245-K268 HydrophobicContact CG1-CD 4.1Å
246	G	68.7	Low	65.2	Low	29 Å²	29	72.4 Å²	72.4	30%	0.299	38%	0.384	S	S	.	.	I	π-helix	trans	71.1	100.3	179.4	0	0	0	0	0	109.7	N242	N242-G246 WeakPolarHBondContact O-CA 3.24Å; N242-G246 PolarHBondContact O-N 2.91Å
247	K	55.5	Low	62.4	Low	102 Å²	102	72.3 Å²	72.3	44%	0.443	40%	0.397	S	S	.	.			trans	-82.9	128	165.6	-72.2	-167.1	-171.4	164.4	0	108.2	E241 N242 D249	E241-K247 WeakPolarHBondContact OE2-CE 3.34Å; E241-K247 IonicContact OE2-NZ 2.66Å; E241-K247 PolarHBondContact OE2-NZ 2.94Å; N242-K247 WeakPolarHBondContact OD1-CD 3.46Å; N242-K247 VanDerWaalsContact OD1-CE 3.23Å; N242-K247 WeakPolarHBondContact OD1-CE 3.45Å; N242-K247 WeakPolarHBondContact OD1-CG 3.41Å; K247-D249 VanDerWaalsContact C-N 3.3Å; K247-D249 PolarHBondContact O-N 3.15Å
248	I	47.3	Very low	59.9	Low	88 Å²	88	75.7 Å²	75.7	45%	0.451	41%	0.414	S	S	.	.			trans	-68.9	93.9	166.5	-56.8	174	0	0	0	106.4	V250	I248-V250 VanDerWaalsContact C-N 3.33Å; I248-V250 HydrophobicContact CG2-CG1 4.08Å; I248-V250 PolarHBondContact O-N 3.04Å; I248-V250 VanDerWaalsContact O-N 3.09Å
249	D	42.1	Very low	57.3	Low	107 Å²	107	75.8 Å²	75.8	57%	0.572	42%	0.419	S	S	*	.			trans	-74.1	93.4	163.9	-91.5	-31.2	0	0	0	107.5	K247 G251	K247-D249 VanDerWaalsContact C-N 3.3Å; K247-D249 PolarHBondContact O-N 3.15Å; D249-G251 PolarHBondContact O-N 2.9Å
250	V	40.8	Very low	54.7	Low	92 Å²	92	80.1 Å²	80.1	56%	0.558	44%	0.442	S	S	*	.			trans	-72.6	81.7	164.7	-93.7	0	0	0	0	108.5	I248 F252 V259	I248-V250 VanDerWaalsContact C-N 3.33Å; I248-V250 HydrophobicContact CG2-CG1 4.08Å; I248-V250 PolarHBondContact O-N 3.04Å; I248-V250 VanDerWaalsContact O-N 3.09Å; V250-F252 PolarHBondContact O-N 2.96Å; V250-V259 HydrophobicContact CG1-CG1 4.32Å
251	G	38.2	Very low	52.2	Low	41 Å²	41	81.6 Å²	81.6	42%	0.423	45%	0.451	S	S	.	.			trans	-78.8	109.1	168.5	0	0	0	0	0	110.5	D249 V253	D249-G251 PolarHBondContact O-N 2.9Å; G251-V253 PolarHBondContact O-N 2.78Å
252	F	31.5	Very low	50.2	Low	169 Å²	169	82.9 Å²	82.9	74%	0.741	47%	0.467	S	S	*	.	B	Isolated β-bridge	trans	-77.3	105.1	166	-80.9	-96.7	0	0	0	109	V250 S254	V250-F252 PolarHBondContact O-N 2.96Å; F252-S254 PolarHBondContact O-N 3.23Å
253	V	40.4	Very low	48.4	Very low	74 Å²	74	83.3 Å²	83.3	45%	0.448	47%	0.469	S	S	.	.			trans	-75.8	119.8	164.6	-89.7	0	0	0	0	109.1	G251 F255 F256 I258	G251-V253 PolarHBondContact O-N 2.78Å; V253-F255 PolarHBondContact O-N 3.39Å; V253-F256 PolarHBondContact O-N 2.95Å; V253-I258 HydrophobicContact CG2-CB 3.74Å; V253-I258 HydrophobicContact CG2-CG1 4.44Å; V253-I258 WeakPolarHBondContact CG2-O 3.23Å
254	S	43.8	Very low	46.8	Very low	116 Å²	116	87.3 Å²	87.3	81%	0.811	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	14	-159.5	-167.5	0	0	0	0	118.6	F252	F252-S254 PolarHBondContact O-N 3.23Å
255	F	44.4	Very low	45.7	Very low	194 Å²	194	90.2 Å²	90.2	85%	0.851	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.7	-15.8	177.2	-113.2	-86.1	0	0	0	116.1	V253	V253-F255 PolarHBondContact O-N 3.39Å
256	F	35.4	Very low	45.6	Very low	158 Å²	158	87.9 Å²	87.9	69%	0.693	48%	0.481	S	S	*	.	S	Bend	trans	-132.7	126.3	165.9	-75.2	-92.4	0	0	0	105	V253 I258	V253-F256 PolarHBondContact O-N 2.95Å; F256-I258 HydrophobicContact CB-CD1 4.2Å; F256-I258 HydrophobicContact CB-CG1 3.98Å; F256-I258 PolarHBondContact O-N 3.3Å
257	A	35.7	Very low	46.4	Very low	72 Å²	72	86.6 Å²	86.6	60%	0.595	47%	0.467	S	S	*	.			trans	-67.7	64.8	177.6	0	0	0	0	0	110.8	M116 V259	M116-A257 WeakPolarHBondContact CE-O 3.39Å; A257-V259 PolarHBondContact O-N 3.36Å
258	I	40.5	Very low	47.9	Very low	72 Å²	72	84 Å²	84	37%	0.369	46%	0.456	S	S	.	.			trans	-85	102.2	170.8	-57.2	174.6	0	0	0	105	V253 F256 L260	V253-I258 HydrophobicContact CG2-CB 3.74Å; V253-I258 HydrophobicContact CG2-CG1 4.44Å; V253-I258 WeakPolarHBondContact CG2-O 3.23Å; F256-I258 HydrophobicContact CB-CD1 4.2Å; F256-I258 HydrophobicContact CB-CG1 3.98Å; F256-I258 PolarHBondContact O-N 3.3Å; I258-L260 VanDerWaalsContact C-N 3.3Å; I258-L260 HydrophobicContact CG2-CD2 3.93Å; I258-L260 HydrophobicContact CG2-CG 3.86Å; I258-L260 PolarHBondContact O-N 2.68Å
259	V	38.4	Very low	49.4	Very low	56 Å²	56	83.4 Å²	83.4	34%	0.339	45%	0.452	S	S	.	.	B	Isolated β-bridge	trans	-72.2	94.4	163.1	-173.1	0	0	0	0	106.1	V250 A257 V261	V250-V259 HydrophobicContact CG1-CG1 4.32Å; A257-V259 PolarHBondContact O-N 3.36Å; V259-V261 HydrophobicContact CB-CG2 4.49Å; V259-V261 HydrophobicContact CG1-CG2 3.5Å; V259-V261 PolarHBondContact O-N 3.04Å
260	L	37.3	Very low	51.3	Low	92 Å²	92	78.5 Å²	78.5	48%	0.482	43%	0.426	S	S	.	.			trans	-72.5	80.7	164.3	-73.5	174.8	0	0	0	107.5	I258 S262	I258-L260 VanDerWaalsContact C-N 3.3Å; I258-L260 HydrophobicContact CG2-CD2 3.93Å; I258-L260 HydrophobicContact CG2-CG 3.86Å; I258-L260 PolarHBondContact O-N 2.68Å; L260-S262 VanDerWaalsContact C-N 3.3Å; L260-S262 PolarHBondContact O-N 3.5Å
261	V	39.2	Very low	53.4	Low	35 Å²	35	75 Å²	75	21%	0.212	40%	0.402	C	S	.	.			trans	-66	100.8	162.2	-172	0	0	0	0	105.3	V259 L263	V259-V261 HydrophobicContact CB-CG2 4.49Å; V259-V261 HydrophobicContact CG1-CG2 3.5Å; V259-V261 PolarHBondContact O-N 3.04Å; V261-L263 HydrophobicContact CB-CG 4.13Å; V261-L263 HydrophobicContact CG1-CD2 3.81Å; V261-L263 HydrophobicContact CG1-CG 3.7Å; V261-L263 PolarHBondContact O-N 3.27Å
262	S	42	Very low	55.5	Low	95 Å²	95	79.2 Å²	79.2	66%	0.664	41%	0.409	S	S	*	.			trans	-64.1	87.8	161.7	-74.3	0	0	0	0	107	L260 K264	L260-S262 VanDerWaalsContact C-N 3.3Å; L260-S262 PolarHBondContact O-N 3.5Å; S262-K264 PolarHBondContact O-N 3.49Å
263	L	45.2	Very low	57.8	Low	69 Å²	69	73.6 Å²	73.6	36%	0.361	39%	0.389	S	S	.	.			trans	-68.9	38.1	-179	-83.1	166.3	0	0	0	112.4	I109 V261 R265	I109-L263 HydrophobicContact CD1-CD1 4.16Å; I109-L263 HydrophobicContact CD1-CD2 3.68Å; I109-L263 HydrophobicContact CD1-CG 4.3Å; V261-L263 HydrophobicContact CB-CG 4.13Å; V261-L263 HydrophobicContact CG1-CD2 3.81Å; V261-L263 HydrophobicContact CG1-CG 3.7Å; V261-L263 PolarHBondContact O-N 3.27Å; L263-R265 VanDerWaalsContact C-N 3.3Å; L263-R265 PolarHBondContact O-N 2.64Å
264	K	52	Low	59.8	Low	102 Å²	102	73.7 Å²	73.7	44%	0.443	39%	0.389	S	S	.	.			trans	-64.3	101.3	163.1	-83.6	-165.2	175	-174.3	0	106.2	L218 S262	L218-K264 PolarHBondContact O-NZ 3.36Å; L218-K264 VanDerWaalsContact O-NZ 3.15Å; S262-K264 PolarHBondContact O-N 3.49Å
265	R	62.1	Low	61.5	Low	67 Å²	67	70.7 Å²	70.7	25%	0.253	36%	0.364	S	S	.	.			trans	-55.2	137.5	177.2	-71.8	-175.3	177.4	-161	-3.4	109.3	G72 D73 L263 Y267 T270	G72-R265 VanDerWaalsContact O-CZ 3.29Å; G72-R265 PolarHBondContact O-NE 3.3Å; G72-R265 PolarHBondContact O-NH2 3Å; D73-R265 VanDerWaalsContact N-NH2 3.2Å; L263-R265 VanDerWaalsContact C-N 3.3Å; L263-R265 PolarHBondContact O-N 2.64Å; R265-Y267 PolarHBondContact O-N 3.11Å; R265-T270 HydrophobicContact CB-CG2 3.55Å; R265-T270 HydrophobicContact CG-CG2 4.46Å
266	P	77.5	Confident	62.9	Low	15 Å²	15	68.8 Å²	68.8	10%	0.097	36%	0.358	C	S	.	.			trans	-56.3	131.2	174.7	12	-23.3	0	0	0	112.9	Q244 V245 K268 E269 T270	Q244-P266 CarbonylContact O-C 3.44Å; Q244-P266 WeakPolarHBondContact O-CB 3.33Å; V245-P266 WeakPolarHBondContact O-CB 3.38Å; P266-K268 PolarHBondContact O-N 3.14Å; P266-E269 HydrophobicContact CB-CB 4.44Å; P266-E269 HydrophobicContact CB-CG 4.16Å; P266-E269 HydrophobicContact CG-CB 3.91Å; P266-E269 HydrophobicContact CG-CG 3.57Å; P266-E269 WeakPolarHBondContact CG-OE2 3.35Å; P266-E269 PolarHBondContact O-N 3.03Å; P266-E269 VanDerWaalsContact O-N 3.14Å; P266-T270 WeakPolarHBondContact O-CG2 3.2Å; P266-T270 PolarHBondContact O-N 3.1Å; P266-T270 PolarHBondContact O-OG1 3.15Å
267	Y	85.8	Confident	65.1	Low	2 Å²	2	67.9 Å²	67.9	1%	0.008	36%	0.36	C	S	.	.	H	α-helix	trans	-51.6	-42.2	176.2	-176.9	-88.9	0	0	0	111.5	L218 H232 P233 L239 C243 Q244 R265 E269 T270 Y271 A284 L353	L218-Y267 HydrophobicContact CD1-CD2 4.38Å; H232-Y267 AromaticContact NE2-CE2 3.74Å; H232-Y267 AromaticContact NE2-CZ 3.75Å; H232-Y267 PolarHBondContact NE2-OH 2.88Å; P233-Y267 HydrophobicContact CG-CE1 3.95Å; P233-Y267 WeakPolarHBondContact CG-OH 3.3Å; L239-Y267 HydrophobicContact CD1-CD1 3.88Å; L239-Y267 HydrophobicContact CD1-CE1 4.12Å; L239-Y267 HydrophobicContact CD1-CG 4.09Å; C243-Y267 WeakPolarHBondContact O-CB 3.37Å; C243-Y267 PolarHBondContact O-N 3.24Å; Q244-Y267 PolarHBondContact O-N 2.99Å; R265-Y267 PolarHBondContact O-N 3.11Å; Y267-E269 PolarHBondContact O-N 3.2Å; Y267-T270 PolarHBondContact O-N 3.07Å; Y267-T270 PolarHBondContact O-OG1 3.06Å; Y267-Y271 HydrophobicContact CE1-CD2 4.3Å; Y267-Y271 PolarHBondContact O-N 3.31Å; Y267-Y271 VanDerWaalsContact O-N 3.11Å; Y267-A284 PolarHBondContact OH-O 2.86Å; Y267-L353 HydrophobicContact CD1-CD2 3.98Å; Y267-L353 HydrophobicContact CE1-CD2 3.77Å
268	K	85.5	Confident	67.3	Low	47 Å²	47	66.3 Å²	66.3	20%	0.204	35%	0.351	C	S	.	.	H	α-helix	trans	-62.3	-40.1	-178.3	-73.5	-174.8	171.5	-174.1	0	113.3	Q244 V245 P266 L353 F354	Q244-K268 HydrophobicContact CB-CD 4.34Å; Q244-K268 HydrophobicContact CB-CG 4.32Å; Q244-K268 WeakPolarHBondContact O-CB 3.41Å; Q244-K268 PolarHBondContact O-N 3.47Å; Q244-K268 VanDerWaalsContact OE1-CE 3.27Å; V245-K268 HydrophobicContact CG1-CD 4.1Å; P266-K268 PolarHBondContact O-N 3.14Å; K268-L353 WeakPolarHBondContact CE-O 3.45Å; K268-L353 PolarHBondContact NZ-O 3.04Å; K268-F354 HydrophobicContact CB-CE1 3.71Å; K268-F354 HydrophobicContact CB-CZ 4.25Å; K268-F354 HydrophobicContact CG-CD1 4.38Å; K268-F354 HydrophobicContact CG-CE1 3.81Å; K268-F354 HydrophobicContact CG-CZ 4.17Å; K268-F354 WeakPolarHBondContact O-CE1 3.39Å
269	E	80.3	Confident	69.5	Low	77 Å²	77	64.5 Å²	64.5	36%	0.36	34%	0.34	S	S	.	.	H	α-helix	trans	-74.6	-31.5	179.3	-63	-174.5	177.8	0	0	112.2	P101 P266 Y267	P101-E269 WeakPolarHBondContact CB-OE1 3.47Å; P266-E269 HydrophobicContact CB-CB 4.44Å; P266-E269 HydrophobicContact CB-CG 4.16Å; P266-E269 HydrophobicContact CG-CB 3.91Å; P266-E269 HydrophobicContact CG-CG 3.57Å; P266-E269 WeakPolarHBondContact CG-OE2 3.35Å; P266-E269 PolarHBondContact O-N 3.03Å; P266-E269 VanDerWaalsContact O-N 3.14Å; Y267-E269 PolarHBondContact O-N 3.2Å
270	T	80.4	Confident	71.9	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-78.5	-25.1	-178.1	64.5	0	0	0	0	113.7	R265 P266 Y267 F272 V273 F282 G287	R265-T270 HydrophobicContact CB-CG2 3.55Å; R265-T270 HydrophobicContact CG-CG2 4.46Å; P266-T270 WeakPolarHBondContact O-CG2 3.2Å; P266-T270 PolarHBondContact O-N 3.1Å; P266-T270 PolarHBondContact O-OG1 3.15Å; Y267-T270 PolarHBondContact O-N 3.07Å; Y267-T270 PolarHBondContact O-OG1 3.06Å; T270-F272 PolarHBondContact O-N 3.3Å; T270-V273 PolarHBondContact O-N 2.87Å; T270-F282 HydrophobicContact CG2-CD1 3.93Å; T270-F282 HydrophobicContact CG2-CE1 4.21Å; T270-F282 HydrophobicContact CG2-CG 4.15Å; T270-F282 VanDerWaalsContact O-CD2 3.32Å; T270-F282 WeakPolarHBondContact O-CD2 3.5Å; T270-G287 WeakPolarHBondContact CG2-O 3.36Å; T270-G287 WeakPolarHBondContact OG1-CA 2.93Å
271	Y	86.1	Confident	74.1	Confident	18 Å²	18	60.7 Å²	60.7	7%	0.071	32%	0.316	C	S	.	.	H	α-helix	trans	-64.3	-38.5	-169.2	179	-98.7	0	0	0	114.4	F234 Y267 K280 L350 F354	F234-Y271 AromaticContact CE2-CE2 3.63Å; F234-Y271 HydrophobicContact CE2-CE2 3.63Å; F234-Y271 AromaticContact CZ-CE2 3.69Å; F234-Y271 HydrophobicContact CZ-CE2 3.69Å; F234-Y271 WeakPolarHBondContact CZ-OH 3.15Å; Y267-Y271 HydrophobicContact CE1-CD2 4.3Å; Y267-Y271 PolarHBondContact O-N 3.31Å; Y267-Y271 VanDerWaalsContact O-N 3.11Å; Y271-K280 VanDerWaalsContact CE2-CE 3.47Å; Y271-K280 WeakPolarHBondContact O-CD 3.37Å; Y271-K280 WeakPolarHBondContact O-CE 3.42Å; Y271-L350 HydrophobicContact CD1-CD1 4.09Å; Y271-L350 HydrophobicContact CE1-CD1 3.5Å; Y271-L350 VanDerWaalsContact CE1-CD1 3.5Å; Y271-L350 HydrophobicContact CE1-CD2 3.84Å; Y271-L350 HydrophobicContact CE1-CG 4.26Å; Y271-L350 HydrophobicContact CE2-CD1 4.01Å; Y271-L350 VanDerWaalsContact CZ-CD1 3.45Å; Y271-L350 WeakPolarHBondContact OH-CD2 3.41Å; Y271-F354 AromaticContact CD1-CE2 3.76Å; Y271-F354 HydrophobicContact CD1-CE2 3.76Å; Y271-F354 AromaticContact CD1-CZ 3.79Å; Y271-F354 HydrophobicContact CD1-CZ 3.79Å; Y271-F354 HydrophobicContact CE1-CE2 4.34Å; Y271-F354 HydrophobicContact CG-CE2 4.08Å; Y271-F354 AromaticContact CG-CZ 3.92Å; Y271-F354 HydrophobicContact CG-CZ 3.92Å
272	F	82.5	Confident	76.4	Confident	130 Å²	130	59.4 Å²	59.4	57%	0.57	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.2	-176.2	-69.4	-69.3	0	0	0	114.2	T270 V274 F354	T270-F272 PolarHBondContact O-N 3.3Å; F272-V274 PolarHBondContact O-N 3.33Å; F272-F354 HydrophobicContact CD2-CE1 4.03Å; F272-F354 HydrophobicContact CD2-CZ 4.29Å; F272-F354 AromaticContact CE2-CD1 3.57Å; F272-F354 HydrophobicContact CE2-CD1 3.57Å; F272-F354 HydrophobicContact CE2-CD2 4.21Å; F272-F354 AromaticContact CE2-CE1 3.42Å; F272-F354 HydrophobicContact CE2-CE1 3.42Å; F272-F354 VanDerWaalsContact CE2-CE1 3.42Å; F272-F354 HydrophobicContact CE2-CE2 4.12Å; F272-F354 AromaticContact CE2-CG 3.96Å; F272-F354 HydrophobicContact CE2-CG 3.96Å; F272-F354 AromaticContact CE2-CZ 3.73Å; F272-F354 HydrophobicContact CE2-CZ 3.73Å; F272-F354 HydrophobicContact CZ-CD1 4.29Å; F272-F354 HydrophobicContact CZ-CD2 4.24Å; F272-F354 HydrophobicContact CZ-CE1 4.34Å; F272-F354 HydrophobicContact CZ-CE2 4.33Å; F272-F354 HydrophobicContact CZ-CG 4.23Å; F272-F354 HydrophobicContact CZ-CZ 4.37Å
273	V	78.6	Confident	78.7	Confident	50 Å²	50	55 Å²	55	30%	0.303	28%	0.277	S	S	.	.			trans	-78.9	115.3	-179.8	-169.6	0	0	0	0	109.3	T270 K280 E281 F282	T270-V273 PolarHBondContact O-N 2.87Å; V273-K280 WeakPolarHBondContact O-CA 3.47Å; V273-E281 HydrophobicContact CG1-CB 4.13Å; V273-E281 HydrophobicContact CG1-CG 4.04Å; V273-E281 PolarHBondContact O-N 2.82Å; V273-F282 HydrophobicContact CB-CD2 3.75Å; V273-F282 HydrophobicContact CB-CE2 3.56Å; V273-F282 HydrophobicContact CG1-CD2 4.37Å; V273-F282 HydrophobicContact CG1-CE2 3.77Å; V273-F282 HydrophobicContact CG2-CD2 4.15Å; V273-F282 HydrophobicContact CG2-CE2 3.8Å
274	V	82.4	Confident	81	Confident	76 Å²	76	51.7 Å²	51.7	46%	0.461	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-116.1	148.2	176.3	-64.8	0	0	0	0	110.7	F272 K279 K280	F272-V274 PolarHBondContact O-N 3.33Å; V274-K279 CarbonylContact C-O 3.56Å; V274-K279 WeakPolarHBondContact CA-O 3.39Å; V274-K279 WeakPolarHBondContact CB-O 3.35Å; V274-K280 HydrophobicContact CG1-CG 4.24Å
275	D	80.2	Confident	82.9	Confident	54 Å²	54	46.9 Å²	46.9	29%	0.289	24%	0.239	S	C	.	.			trans	-80.2	-173.8	172.2	65.4	22.8	0	0	0	111.6	D277 G278 K279 E281	D275-D277 PolarHBondContact O-N 2.87Å; D275-D277 WeakPolarHBondContact OD1-CA 3.26Å; D275-D277 WeakPolarHBondContact OD1-CB 3.45Å; D275-D277 PolarHBondContact OD1-N 2.88Å; D275-G278 PolarHBondContact O-N 2.95Å; D275-G278 PolarHBondContact OD1-N 2.96Å; D275-G278 VanDerWaalsContact OD1-N 3.13Å; D275-K279 VanDerWaalsContact CG-O 3.26Å; D275-K279 PolarHBondContact N-O 3.21Å; D275-K279 PolarHBondContact OD1-N 3Å; D275-E281 HydrophobicContact CB-CG 4.09Å
276	Q	73.9	Confident	84.3	Confident	153 Å²	153	44 Å²	44	72%	0.715	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20	-178.9	-63	-176.9	-9.9	0	0	113.4	G278	Q276-G278 VanDerWaalsContact C-N 3.28Å
277	D	80.8	Confident	84.8	Confident	140 Å²	140	43.5 Å²	43.5	75%	0.749	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	3.4	178.1	-59.4	-35.7	0	0	0	111.4	D275 K279	D275-D277 PolarHBondContact O-N 2.87Å; D275-D277 WeakPolarHBondContact OD1-CA 3.26Å; D275-D277 WeakPolarHBondContact OD1-CB 3.45Å; D275-D277 PolarHBondContact OD1-N 2.88Å; D277-K279 HydrophobicContact CB-CG 4.39Å; D277-K279 PolarHBondContact O-N 2.82Å
278	G	82.5	Confident	84.6	Confident	38 Å²	38	45.9 Å²	45.9	39%	0.392	24%	0.243	S	C	.	.	S	Bend	trans	73.2	13.3	-177.5	0	0	0	0	0	113.4	D275 Q276 S301	D275-G278 PolarHBondContact O-N 2.95Å; D275-G278 PolarHBondContact OD1-N 2.96Å; D275-G278 VanDerWaalsContact OD1-N 3.13Å; Q276-G278 VanDerWaalsContact C-N 3.28Å; G278-S301 WeakPolarHBondContact O-CB 3.43Å
279	K	87.6	Confident	84.2	Confident	34 Å²	34	46.5 Å²	46.5	15%	0.148	25%	0.251	C	S	.	.			trans	-91.8	149.4	174.2	-57.4	-62.5	-179.7	172.5	0	109.2	V274 D275 D277 V294 C295 S297 C300 V303	V274-K279 CarbonylContact C-O 3.56Å; V274-K279 WeakPolarHBondContact CA-O 3.39Å; V274-K279 WeakPolarHBondContact CB-O 3.35Å; D275-K279 VanDerWaalsContact CG-O 3.26Å; D275-K279 PolarHBondContact N-O 3.21Å; D275-K279 PolarHBondContact OD1-N 3Å; D277-K279 HydrophobicContact CB-CG 4.39Å; D277-K279 PolarHBondContact O-N 2.82Å; K279-V294 HydrophobicContact CB-CG1 4.32Å; K279-V294 HydrophobicContact CD-CG1 3.71Å; K279-V294 HydrophobicContact CG-CG1 3.74Å; K279-C295 PolarHBondContact NZ-O 3.17Å; K279-S297 PolarHBondContact NZ-O 3.25Å; K279-C300 PolarHBondContact NZ-O 2.74Å; K279-V303 HydrophobicContact CB-CG1 4.22Å
280	K	87.4	Confident	83.9	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.052	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-67.2	142.2	179.2	-73.5	-176.4	177.1	81.5	0	110.4	Y271 V273 V274 F282 S301 N302 V303	Y271-K280 VanDerWaalsContact CE2-CE 3.47Å; Y271-K280 WeakPolarHBondContact O-CD 3.37Å; Y271-K280 WeakPolarHBondContact O-CE 3.42Å; V273-K280 WeakPolarHBondContact O-CA 3.47Å; V274-K280 HydrophobicContact CG1-CG 4.24Å; K280-F282 VanDerWaalsContact C-N 3.31Å; K280-S301 WeakPolarHBondContact CB-O 3.48Å; K280-S301 WeakPolarHBondContact CG-O 3.47Å; K280-S301 PolarHBondContact N-O 3.47Å; K280-S301 PolarHBondContact NZ-OG 3.26Å; K280-N302 PolarHBondContact NZ-OD1 3.49Å; K280-V303 HydrophobicContact CB-CG2 4.07Å; K280-V303 WeakPolarHBondContact O-CG1 3.3Å; K280-V303 WeakPolarHBondContact O-CG2 3.09Å
281	E	83.9	Confident	84	Confident	56 Å²	56	50 Å²	50	26%	0.262	29%	0.289	S	S	.	.	S	Bend	trans	-80.7	-14.2	172.8	-66.7	-163	162.2	0	0	113.1	V273 D275 L292	V273-E281 HydrophobicContact CG1-CB 4.13Å; V273-E281 HydrophobicContact CG1-CG 4.04Å; V273-E281 PolarHBondContact O-N 2.82Å; D275-E281 HydrophobicContact CB-CG 4.09Å; E281-L292 VanDerWaalsContact O-CD1 3.27Å; E281-L292 WeakPolarHBondContact O-CD1 3.38Å
282	F	87.1	Confident	84.1	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.035	30%	0.298	C	S	.	.	S	Bend	trans	-123.9	146.6	-175.7	-58.4	-91.2	0	0	0	111.2	T270 V273 K280 A284 G287 T289 V303	T270-F282 HydrophobicContact CG2-CD1 3.93Å; T270-F282 HydrophobicContact CG2-CE1 4.21Å; T270-F282 HydrophobicContact CG2-CG 4.15Å; T270-F282 VanDerWaalsContact O-CD2 3.32Å; T270-F282 WeakPolarHBondContact O-CD2 3.5Å; V273-F282 HydrophobicContact CB-CD2 3.75Å; V273-F282 HydrophobicContact CB-CE2 3.56Å; V273-F282 HydrophobicContact CG1-CD2 4.37Å; V273-F282 HydrophobicContact CG1-CE2 3.77Å; V273-F282 HydrophobicContact CG2-CD2 4.15Å; V273-F282 HydrophobicContact CG2-CE2 3.8Å; K280-F282 VanDerWaalsContact C-N 3.31Å; F282-A284 PolarHBondContact O-N 3.18Å; F282-G287 VanDerWaalsContact CD1-O 3.23Å; F282-G287 WeakPolarHBondContact CD1-O 3.46Å; F282-T289 HydrophobicContact CD1-CG2 3.63Å; F282-T289 HydrophobicContact CE1-CG2 3.38Å; F282-T289 HydrophobicContact CZ-CG2 4.14Å; F282-V303 VanDerWaalsContact O-CG2 3.24Å; F282-V303 WeakPolarHBondContact O-CG2 3.35Å
283	C	90.3	Very high	84.6	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.014	28%	0.276	C	S	.	.			trans	-56	126.2	177.2	175.8	0	0	0	0	111.7	L285 C286 G287 S288 L292 V303 C305 C308	C283-L285 PolarHBondContact O-N 3.43Å; C283-L285 VanDerWaalsContact O-N 3.12Å; C283-L285 PolarHBondContact SG-N 2.95Å; C283-C286 VanDerWaalsContact CB-SG 3.54Å; C283-C286 PolarHBondContact O-N 3.19Å; C283-G287 WeakPolarHBondContact O-CA 3.48Å; C283-G287 PolarHBondContact O-N 3.4Å; C283-S288 WeakPolarHBondContact CB-O 3.36Å; C283-S288 PolarHBondContact N-O 3.41Å; C283-L292 HydrophobicContact CB-CD2 4.23Å; C283-V303 WeakPolarHBondContact CA-O 3.29Å; C283-C305 HydrophobicContact CB-CB 3.98Å; C283-C305 PolarHBondContact SG-N 3.25Å; C283-C305 VanDerWaalsContact SG-SG 3.64Å; C283-C308 VanDerWaalsContact SG-SG 3.62Å
284	A	93.3	Very high	85.3	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.4	-179.9	0	0	0	0	0	113.8	F234 Y267 F282 N302 V303 Y304	F234-A284 HydrophobicContact CD2-CB 4.23Å; F234-A284 HydrophobicContact CE2-CB 3.85Å; Y267-A284 PolarHBondContact OH-O 2.86Å; F282-A284 PolarHBondContact O-N 3.18Å; A284-N302 HydrophobicContact CB-CB 4.15Å; A284-V303 WeakPolarHBondContact CB-O 3.5Å; A284-V303 PolarHBondContact N-O 3.34Å; A284-Y304 HydrophobicContact CB-CE1 4.19Å; A284-Y304 HydrophobicContact CB-CE2 4.14Å
285	L	93.7	Very high	85.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-43.2	175.9	177.6	62	0	0	0	113.3	H232 F235 C283 Y304 C308 F312 L337 L340	H232-L285 PolarHBondContact NE2-O 3.34Å; F235-L285 HydrophobicContact CD2-CD1 3.51Å; F235-L285 HydrophobicContact CE2-CB 4.2Å; F235-L285 HydrophobicContact CE2-CD1 3.7Å; F235-L285 HydrophobicContact CE2-CG 4.41Å; F235-L285 HydrophobicContact CG-CD1 4.42Å; C283-L285 PolarHBondContact O-N 3.43Å; C283-L285 VanDerWaalsContact O-N 3.12Å; C283-L285 PolarHBondContact SG-N 2.95Å; L285-Y304 HydrophobicContact CB-CD1 4.17Å; L285-Y304 HydrophobicContact CB-CE1 4.11Å; L285-C308 HydrophobicContact CB-CB 4.49Å; L285-C308 HydrophobicContact CD2-CB 3.82Å; L285-F312 HydrophobicContact CD2-CD2 3.51Å; L285-F312 HydrophobicContact CD2-CE2 3.66Å; L285-F312 HydrophobicContact CD2-CG 4.42Å; L285-L337 HydrophobicContact CD2-CD2 3.8Å; L285-L340 HydrophobicContact CD1-CD1 3.85Å; L285-L340 HydrophobicContact CD2-CD1 3.6Å; L285-L340 HydrophobicContact CG-CD1 4.43Å
286	C	90.3	Very high	86.6	Confident	8 Å²	8	45.1 Å²	45.1	5%	0.054	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-6.6	-169.6	68.7	0	0	0	0	115.5	L218 C283 S288 C305 C308	L218-C286 HydrophobicContact CD2-CB 3.62Å; C283-C286 VanDerWaalsContact CB-SG 3.54Å; C283-C286 PolarHBondContact O-N 3.19Å; C286-S288 PolarHBondContact O-N 3.39Å; C286-S288 WeakPolarHBondContact SG-CB 3.24Å; C286-S288 PolarHBondContact SG-N 3.43Å; C286-S288 VanDerWaalsContact SG-N 3.44Å; C286-S288 PolarHBondContact SG-OG 3.21Å; C286-C305 VanDerWaalsContact SG-SG 3.65Å; C286-C308 PolarHBondContact SG-SG 2.94Å
287	G	87.6	Confident	87.5	Confident	3 Å²	3	39.2 Å²	39.2	3%	0.031	24%	0.241	C	C	.	.			trans	67.1	11.6	-175.6	0	0	0	0	0	114.2	T270 F282 C283	T270-G287 WeakPolarHBondContact CG2-O 3.36Å; T270-G287 WeakPolarHBondContact OG1-CA 2.93Å; F282-G287 VanDerWaalsContact CD1-O 3.23Å; F282-G287 WeakPolarHBondContact CD1-O 3.46Å; C283-G287 WeakPolarHBondContact O-CA 3.48Å; C283-G287 PolarHBondContact O-N 3.4Å
288	S	82.8	Confident	87.9	Confident	53 Å²	53	38.3 Å²	38.3	37%	0.371	24%	0.242	S	C	.	.			trans	-95.5	154.8	179.8	-51.8	0	0	0	0	112	C283 C286	C283-S288 WeakPolarHBondContact CB-O 3.36Å; C283-S288 PolarHBondContact N-O 3.41Å; C286-S288 PolarHBondContact O-N 3.39Å; C286-S288 WeakPolarHBondContact SG-CB 3.24Å; C286-S288 PolarHBondContact SG-N 3.43Å; C286-S288 VanDerWaalsContact SG-N 3.44Å; C286-S288 PolarHBondContact SG-OG 3.21Å
289	T	76.9	Confident	88.2	Confident	60 Å²	60	44.5 Å²	44.5	37%	0.368	27%	0.267	S	S	.	.			trans	-83.5	-178.8	168.4	50	0	0	0	0	110.7	F282	F282-T289 HydrophobicContact CD1-CG2 3.63Å; F282-T289 HydrophobicContact CE1-CG2 3.38Å; F282-T289 HydrophobicContact CZ-CG2 4.14Å
290	G	72.8	Confident	88.5	Confident	58 Å²	58	43.5 Å²	43.5	60%	0.598	26%	0.264	S	S	*	.	S	Bend	trans	140.3	-152.6	176.7	0	0	0	0	0	110.2	L292	G290-L292 PolarHBondContact O-N 2.98Å
291	V	83.8	Confident	88.7	Confident	97 Å²	97	44.6 Å²	44.6	59%	0.588	27%	0.273	S	S	*	.	S	Bend	trans	-73.9	116.7	166.8	-175	0	0	0	0	107.9	C305 T306	V291-C305 CarbonylContact O-C 3.54Å; V291-C305 VanDerWaalsContact O-CA 3.27Å; V291-C305 WeakPolarHBondContact O-CA 3.38Å; V291-T306 HydrophobicContact CB-CG2 3.89Å; V291-T306 HydrophobicContact CG1-CG2 3.68Å; V291-T306 PolarHBondContact O-N 3.38Å
292	L	88.1	Confident	89.2	Confident	50 Å²	50	42.2 Å²	42.2	26%	0.262	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.8	-174.1	-62.8	168.9	0	0	0	110.1	E281 C283 G290 V303 C305	E281-L292 VanDerWaalsContact O-CD1 3.27Å; E281-L292 WeakPolarHBondContact O-CD1 3.38Å; C283-L292 HydrophobicContact CB-CD2 4.23Å; G290-L292 PolarHBondContact O-N 2.98Å; L292-V303 HydrophobicContact CB-CB 4.34Å; L292-V303 HydrophobicContact CB-CG2 4.39Å; L292-V303 HydrophobicContact CD1-CG2 4.08Å; L292-V303 HydrophobicContact CD2-CG2 4.07Å; L292-V303 HydrophobicContact CG-CG2 4.4Å; L292-C305 HydrophobicContact CD2-CB 3.84Å
293	V	92	Very high	89.5	Confident	16 Å²	16	42 Å²	42	10%	0.097	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.5	168.8	-170.2	0	0	0	0	108.6	V303 Y304 T306 I309 V321 L322 W327	V293-V303 CarbonylContact O-C 3.59Å; V293-V303 VanDerWaalsContact O-CA 3.24Å; V293-V303 WeakPolarHBondContact O-CA 3.32Å; V293-Y304 PolarHBondContact N-O 3.19Å; V293-Y304 PolarHBondContact O-N 2.77Å; V293-T306 HydrophobicContact CG2-CG2 4.26Å; V293-I309 HydrophobicContact CB-CD1 4.29Å; V293-I309 HydrophobicContact CG2-CD1 3.89Å; V293-V321 HydrophobicContact CB-CG1 4.34Å; V293-V321 HydrophobicContact CG1-CG1 3.64Å; V293-V321 HydrophobicContact CG2-CG1 4.22Å; V293-L322 HydrophobicContact CG2-CD2 4.15Å; V293-W327 HydrophobicContact CB-CH2 4.46Å; V293-W327 HydrophobicContact CB-CZ3 4.16Å; V293-W327 HydrophobicContact CG1-CD2 4Å; V293-W327 HydrophobicContact CG1-CE3 3.56Å; V293-W327 HydrophobicContact CG1-CH2 4.23Å; V293-W327 HydrophobicContact CG1-CZ3 3.7Å
294	V	93.5	Very high	89.7	Confident	64 Å²	64	41.9 Å²	41.9	39%	0.388	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.9	-172.7	-177.9	0	0	0	0	110.4	K279 E296 V303	K279-V294 HydrophobicContact CB-CG1 4.32Å; K279-V294 HydrophobicContact CD-CG1 3.71Å; K279-V294 HydrophobicContact CG-CG1 3.74Å; V294-E296 PolarHBondContact O-N 3.49Å; V294-V303 HydrophobicContact CB-CG1 4.35Å; V294-V303 HydrophobicContact CG1-CG1 4.28Å; V294-V303 HydrophobicContact CG2-CG1 3.99Å
295	C	95.5	Very high	89.5	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-67.3	127.8	172.4	-171.5	0	0	0	0	110.8	K279 S297 C300 N302 W327 C329	K279-C295 PolarHBondContact NZ-O 3.17Å; C295-S297 VanDerWaalsContact C-N 3.32Å; C295-S297 PolarHBondContact O-N 3.22Å; C295-C300 HydrophobicContact CB-CB 4.19Å; C295-C300 VanDerWaalsContact SG-SG 3.67Å; C295-N302 WeakPolarHBondContact CB-O 3.39Å; C295-N302 PolarHBondContact N-O 2.66Å; C295-N302 VanDerWaalsContact N-O 3.15Å; C295-W327 HydrophobicContact CB-CZ3 4.4Å; C295-C329 HydrophobicContact CB-CB 3.79Å; C295-C329 PolarHBondContact SG-N 2.86Å; C295-C329 VanDerWaalsContact SG-SG 3.67Å
296	E	94	Very high	89.2	Confident	95 Å²	95	43.8 Å²	43.8	44%	0.444	27%	0.272	S	S	.	.			trans	-88	2.8	179.4	-69.6	178.3	-125.9	0	0	113.8	V294 P326 W327	V294-E296 PolarHBondContact O-N 3.49Å; E296-P326 HydrophobicContact CB-CB 3.88Å; E296-P326 HydrophobicContact CG-CB 4.48Å; E296-P326 VanDerWaalsContact OE2-CA 3.28Å; E296-P326 WeakPolarHBondContact OE2-CA 3.1Å; E296-P326 WeakPolarHBondContact OE2-CB 3.4Å; E296-W327 PolarHBondContact N-O 2.72Å; E296-W327 PolarHBondContact OE1-N 3.48Å; E296-W327 VanDerWaalsContact OE1-N 3.13Å
297	S	93.6	Very high	89.1	Confident	29 Å²	29	47 Å²	47	20%	0.203	29%	0.289	C	S	.	.			trans	-65.3	130.8	171.9	-169.5	0	0	0	0	110.7	K279 C295 N299 C300	K279-S297 PolarHBondContact NZ-O 3.25Å; C295-S297 VanDerWaalsContact C-N 3.32Å; C295-S297 PolarHBondContact O-N 3.22Å; S297-N299 VanDerWaalsContact C-N 3.28Å; S297-N299 PolarHBondContact O-N 3.19Å; S297-N299 VanDerWaalsContact O-N 3.17Å; S297-C300 PolarHBondContact O-N 3.02Å; S297-C300 VanDerWaalsContact O-N 3.09Å
298	P	89	Confident	89.3	Confident	120 Å²	120	46.8 Å²	46.8	78%	0.779	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-35.4	-174.1	-28.3	34.2	0	0	0	114.9
299	N	88.8	Confident	89.8	Confident	168 Å²	168	44.3 Å²	44.3	90%	0.898	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	14.8	-176.6	-63.3	-27.2	0	0	0	113	S297	S297-N299 VanDerWaalsContact C-N 3.28Å; S297-N299 PolarHBondContact O-N 3.19Å; S297-N299 VanDerWaalsContact O-N 3.17Å
300	C	93.5	Very high	90.4	Very high	13 Å²	13	44.5 Å²	44.5	9%	0.088	27%	0.273	C	S	.	.			trans	-112.1	124.5	-179.2	-168.5	0	0	0	0	111.1	K279 C295 S297 N302	K279-C300 PolarHBondContact NZ-O 2.74Å; C295-C300 HydrophobicContact CB-CB 4.19Å; C295-C300 VanDerWaalsContact SG-SG 3.67Å; S297-C300 PolarHBondContact O-N 3.02Å; S297-C300 VanDerWaalsContact O-N 3.09Å; C300-N302 PolarHBondContact SG-N 3.45Å; C300-N302 VanDerWaalsContact SG-N 3.43Å
301	S	92.5	Very high	91.3	Very high	36 Å²	36	44.1 Å²	44.1	25%	0.252	26%	0.26	S	S	.	.			trans	-92.6	-2	172.3	59.8	0	0	0	0	113.5	G278 K280	G278-S301 WeakPolarHBondContact O-CB 3.43Å; K280-S301 WeakPolarHBondContact CB-O 3.48Å; K280-S301 WeakPolarHBondContact CG-O 3.47Å; K280-S301 PolarHBondContact N-O 3.47Å; K280-S301 PolarHBondContact NZ-OG 3.26Å
302	N	95.1	Very high	91.7	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.032	23%	0.233	C	C	.	.			trans	-71.2	136.6	-171.9	-70	-18.6	0	0	0	112.4	K280 A284 C295 C300 Y304	K280-N302 PolarHBondContact NZ-OD1 3.49Å; A284-N302 HydrophobicContact CB-CB 4.15Å; C295-N302 WeakPolarHBondContact CB-O 3.39Å; C295-N302 PolarHBondContact N-O 2.66Å; C295-N302 VanDerWaalsContact N-O 3.15Å; C300-N302 PolarHBondContact SG-N 3.45Å; C300-N302 VanDerWaalsContact SG-N 3.43Å; N302-Y304 HydrophobicContact CB-CE2 4Å
303	V	93.4	Very high	91.6	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	155.2	169	-52.7	0	0	0	0	109.2	K279 K280 F282 C283 A284 L292 V293 V294	K279-V303 HydrophobicContact CB-CG1 4.22Å; K280-V303 HydrophobicContact CB-CG2 4.07Å; K280-V303 WeakPolarHBondContact O-CG1 3.3Å; K280-V303 WeakPolarHBondContact O-CG2 3.09Å; F282-V303 VanDerWaalsContact O-CG2 3.24Å; F282-V303 WeakPolarHBondContact O-CG2 3.35Å; C283-V303 WeakPolarHBondContact CA-O 3.29Å; A284-V303 WeakPolarHBondContact CB-O 3.5Å; A284-V303 PolarHBondContact N-O 3.34Å; L292-V303 HydrophobicContact CB-CB 4.34Å; L292-V303 HydrophobicContact CB-CG2 4.39Å; L292-V303 HydrophobicContact CD1-CG2 4.08Å; L292-V303 HydrophobicContact CD2-CG2 4.07Å; L292-V303 HydrophobicContact CG-CG2 4.4Å; V293-V303 CarbonylContact O-C 3.59Å; V293-V303 VanDerWaalsContact O-CA 3.24Å; V293-V303 WeakPolarHBondContact O-CA 3.32Å; V294-V303 HydrophobicContact CB-CG1 4.35Å; V294-V303 HydrophobicContact CG1-CG1 4.28Å; V294-V303 HydrophobicContact CG2-CG1 3.99Å
304	Y	94.1	Very high	91.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.4	179.2	-72	-98	0	0	0	110.1	F235 A284 L285 V293 N302 W327 C329 F330	F235-Y304 AromaticContact CE2-CE1 3.8Å; F235-Y304 HydrophobicContact CE2-CE1 3.8Å; F235-Y304 AromaticContact CZ-CE1 3.74Å; F235-Y304 HydrophobicContact CZ-CE1 3.74Å; A284-Y304 HydrophobicContact CB-CE1 4.19Å; A284-Y304 HydrophobicContact CB-CE2 4.14Å; L285-Y304 HydrophobicContact CB-CD1 4.17Å; L285-Y304 HydrophobicContact CB-CE1 4.11Å; V293-Y304 PolarHBondContact N-O 3.19Å; V293-Y304 PolarHBondContact O-N 2.77Å; N302-Y304 HydrophobicContact CB-CE2 4Å; Y304-W327 AromaticContact CD2-CH2 3.84Å; Y304-W327 HydrophobicContact CD2-CH2 3.84Å; Y304-W327 HydrophobicContact CG-CH2 4.43Å; Y304-C329 HydrophobicContact CD2-CB 4.09Å; Y304-C329 HydrophobicContact CE2-CB 3.64Å; Y304-F330 HydrophobicContact CD1-CD2 4.01Å; Y304-F330 HydrophobicContact CD1-CE2 4.09Å; Y304-F330 HydrophobicContact CD2-CD2 4.33Å; Y304-F330 AromaticContact CE1-CD2 3.83Å; Y304-F330 HydrophobicContact CE1-CD2 3.83Å; Y304-F330 HydrophobicContact CE1-CE2 4.37Å; Y304-F330 HydrophobicContact CE2-CD2 4.18Å; Y304-F330 HydrophobicContact CG-CD2 4.26Å; Y304-F330 HydrophobicContact CG-CE2 4.18Å; Y304-F330 AromaticContact CZ-CD2 3.91Å
305	C	88	Confident	90.6	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.027	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.1	174.9	67.3	0	0	0	0	111.2	C283 C286 V291 L292 D307 C308 I309	C283-C305 HydrophobicContact CB-CB 3.98Å; C283-C305 PolarHBondContact SG-N 3.25Å; C283-C305 VanDerWaalsContact SG-SG 3.64Å; C286-C305 VanDerWaalsContact SG-SG 3.65Å; V291-C305 CarbonylContact O-C 3.54Å; V291-C305 VanDerWaalsContact O-CA 3.27Å; V291-C305 WeakPolarHBondContact O-CA 3.38Å; L292-C305 HydrophobicContact CD2-CB 3.84Å; C305-D307 PolarHBondContact O-N 3.4Å; C305-C308 WeakPolarHBondContact O-CB 3.49Å; C305-C308 PolarHBondContact O-N 3.49Å; C305-C308 VanDerWaalsContact SG-CB 3.56Å; C305-C308 PolarHBondContact SG-N 3.45Å; C305-C308 VanDerWaalsContact SG-N 3.36Å; C305-C308 PolarHBondContact SG-SG 2.93Å; C305-I309 PolarHBondContact O-N 3.17Å
306	T	88.3	Confident	90.2	Very high	36 Å²	36	49.9 Å²	49.9	22%	0.221	29%	0.29	C	S	.	.	H	α-helix	trans	-55.7	-37.4	177.6	53.2	0	0	0	0	111.6	V291 V293 C308 I309 S310 L318	V291-T306 HydrophobicContact CB-CG2 3.89Å; V291-T306 HydrophobicContact CG1-CG2 3.68Å; V291-T306 PolarHBondContact O-N 3.38Å; V293-T306 HydrophobicContact CG2-CG2 4.26Å; T306-C308 PolarHBondContact O-N 2.95Å; T306-I309 PolarHBondContact O-N 2.98Å; T306-I309 VanDerWaalsContact O-N 3.15Å; T306-S310 WeakPolarHBondContact O-CB 3.4Å; T306-S310 PolarHBondContact O-N 3.09Å; T306-S310 PolarHBondContact O-OG 3.08Å; T306-S310 VanDerWaalsContact O-OG 3.09Å; T306-L318 HydrophobicContact CG2-CD1 3.96Å
307	D	87.7	Confident	90.1	Very high	75 Å²	75	45.7 Å²	45.7	40%	0.401	27%	0.27	S	S	.	.	H	α-helix	trans	-60.1	-39.5	175.6	175.9	67.9	0	0	0	113.5	R205 C305 S310 T311	R205-D307 IonicContact CZ-OD2 3.81Å; R205-D307 IonicContact NE-OD2 3.17Å; R205-D307 IonicContact NH1-OD2 3.79Å; R205-D307 PolarHBondContact NH1-OD2 3.35Å; R205-D307 VanDerWaalsContact NH1-OD2 3.09Å; R205-D307 IonicContact NH2-OD2 2.75Å; R205-D307 PolarHBondContact NH2-OD2 3.16Å; C305-D307 PolarHBondContact O-N 3.4Å; D307-S310 WeakPolarHBondContact CA-OG 3.29Å; D307-S310 PolarHBondContact O-OG 2.78Å; D307-S310 VanDerWaalsContact O-OG 3.07Å; D307-T311 WeakPolarHBondContact O-CB 3.22Å; D307-T311 PolarHBondContact O-N 3.17Å; D307-T311 PolarHBondContact O-OG1 3.49Å
308	C	91.9	Very high	90	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-43.5	172.7	-85.4	0	0	0	0	111.8	R205 C283 L285 C286 C305 T306 T311 F312	R205-C308 PolarHBondContact NH1-SG 3.43Å; C283-C308 VanDerWaalsContact SG-SG 3.62Å; L285-C308 HydrophobicContact CB-CB 4.49Å; L285-C308 HydrophobicContact CD2-CB 3.82Å; C286-C308 PolarHBondContact SG-SG 2.94Å; C305-C308 WeakPolarHBondContact O-CB 3.49Å; C305-C308 PolarHBondContact O-N 3.49Å; C305-C308 VanDerWaalsContact SG-CB 3.56Å; C305-C308 PolarHBondContact SG-N 3.45Å; C305-C308 VanDerWaalsContact SG-N 3.36Å; C305-C308 PolarHBondContact SG-SG 2.93Å; T306-C308 PolarHBondContact O-N 2.95Å; C308-T311 PolarHBondContact O-N 3.05Å; C308-F312 WeakPolarHBondContact O-CD2 3.37Å; C308-F312 PolarHBondContact O-N 2.97Å; C308-F312 VanDerWaalsContact O-N 3.09Å
309	I	92.9	Very high	90.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-41.9	-178.8	-60.3	173.6	0	0	0	110.3	V293 C305 T306 G313 L317 L318 V321 F330	V293-I309 HydrophobicContact CB-CD1 4.29Å; V293-I309 HydrophobicContact CG2-CD1 3.89Å; C305-I309 PolarHBondContact O-N 3.17Å; T306-I309 PolarHBondContact O-N 2.98Å; T306-I309 VanDerWaalsContact O-N 3.15Å; I309-G313 WeakPolarHBondContact O-CA 3.44Å; I309-G313 PolarHBondContact O-N 2.75Å; I309-L317 HydrophobicContact CG2-CD2 4.15Å; I309-L317 HydrophobicContact CG2-CG 4.06Å; I309-L318 HydrophobicContact CB-CD1 4.27Å; I309-L318 HydrophobicContact CD1-CD1 4.4Å; I309-L318 HydrophobicContact CG2-CB 3.97Å; I309-L318 HydrophobicContact CG2-CD1 4.11Å; I309-V321 HydrophobicContact CD1-CG1 4.18Å; I309-V321 HydrophobicContact CG2-CG2 4.39Å; I309-F330 HydrophobicContact CG1-CE2 4.18Å; I309-F330 HydrophobicContact CG1-CZ 4.25Å
310	S	90.7	Very high	90.4	Very high	64 Å²	64	40.9 Å²	40.9	45%	0.448	23%	0.228	S	C	.	.	H	α-helix	trans	-72.7	-36.6	178	61.3	0	0	0	0	113.1	T306 D307	T306-S310 WeakPolarHBondContact O-CB 3.4Å; T306-S310 PolarHBondContact O-N 3.09Å; T306-S310 PolarHBondContact O-OG 3.08Å; T306-S310 VanDerWaalsContact O-OG 3.09Å; D307-S310 WeakPolarHBondContact CA-OG 3.29Å; D307-S310 PolarHBondContact O-OG 2.78Å; D307-S310 VanDerWaalsContact O-OG 3.07Å
311	T	90.6	Very high	90.3	Very high	50 Å²	50	40.4 Å²	40.4	31%	0.307	23%	0.225	S	C	.	.	H	α-helix	trans	-72.7	-40.8	-177.8	-62.4	0	0	0	0	112.5	R205 T207 D307 C308	R205-T311 HydrophobicContact CB-CG2 4.38Å; T207-T311 HydrophobicContact CG2-CG2 3.75Å; D307-T311 WeakPolarHBondContact O-CB 3.22Å; D307-T311 PolarHBondContact O-N 3.17Å; D307-T311 PolarHBondContact O-OG1 3.49Å; C308-T311 PolarHBondContact O-N 3.05Å
312	F	92	Very high	90.3	Very high	7 Å²	7	44.1 Å²	44.1	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-102.2	-20	-174.9	-65.5	-74.3	0	0	0	113.5	R205 T207 V217 L285 C308 L337 G338 I339 L340	R205-F312 HydrophobicContact CB-CZ 3.97Å; R205-F312 HydrophobicContact CG-CZ 4.49Å; T207-F312 HydrophobicContact CG2-CE1 4.32Å; V217-F312 HydrophobicContact CG2-CE1 3.82Å; V217-F312 HydrophobicContact CG2-CZ 3.61Å; L285-F312 HydrophobicContact CD2-CD2 3.51Å; L285-F312 HydrophobicContact CD2-CE2 3.66Å; L285-F312 HydrophobicContact CD2-CG 4.42Å; C308-F312 WeakPolarHBondContact O-CD2 3.37Å; C308-F312 PolarHBondContact O-N 2.97Å; C308-F312 VanDerWaalsContact O-N 3.09Å; F312-L337 HydrophobicContact CB-CD1 4.18Å; F312-L337 HydrophobicContact CB-CD2 4.14Å; F312-L337 HydrophobicContact CB-CG 3.79Å; F312-G338 VanDerWaalsContact O-CA 3.26Å; F312-G338 WeakPolarHBondContact O-CA 3.4Å; F312-I339 HydrophobicContact CD1-CG1 4.49Å; F312-L340 HydrophobicContact CB-CD1 3.8Å; F312-L340 HydrophobicContact CB-CG 4.34Å; F312-L340 HydrophobicContact CD1-CD1 3.69Å; F312-L340 HydrophobicContact CD1-CG 4.03Å; F312-L340 HydrophobicContact CD2-CD1 3.84Å; F312-L340 HydrophobicContact CE1-CD1 4.17Å; F312-L340 HydrophobicContact CE2-CD1 4.31Å; F312-L340 HydrophobicContact CG-CD1 3.5Å; F312-L340 VanDerWaalsContact CG-CD1 3.5Å; F312-L340 HydrophobicContact CG-CG 4.22Å; F312-L340 HydrophobicContact CZ-CD1 4.46Å
313	G	87.4	Confident	90.2	Very high	16 Å²	16	52.6 Å²	52.6	17%	0.165	27%	0.273	C	S	.	.	S	Bend	trans	-78.9	168.5	175.9	0	0	0	0	0	113.4	I309	I309-G313 WeakPolarHBondContact O-CA 3.44Å; I309-G313 PolarHBondContact O-N 2.75Å
314	Y	84.1	Confident	90.1	Very high	120 Å²	120	54.3 Å²	54.3	47%	0.471	29%	0.285	S	S	.	.			trans	-77.3	165.1	166.9	54.1	-90.4	0	0	0	110.8	D316 L317 E320	Y314-D316 HydrophobicContact CE2-CB 4.47Å; Y314-D316 PolarHBondContact O-N 3.07Å; Y314-L317 HydrophobicContact CD1-CB 4.15Å; Y314-L317 HydrophobicContact CD2-CB 4.13Å; Y314-L317 HydrophobicContact CE1-CB 3.92Å; Y314-L317 HydrophobicContact CE1-CD1 3.82Å; Y314-L317 HydrophobicContact CE1-CD2 4.37Å; Y314-L317 HydrophobicContact CE1-CG 4.24Å; Y314-L317 HydrophobicContact CE2-CB 3.88Å; Y314-L317 HydrophobicContact CG-CB 4.25Å; Y314-L317 WeakPolarHBondContact O-CB 3.31Å; Y314-L317 PolarHBondContact O-N 3.08Å; Y314-L317 WeakPolarHBondContact OH-CD1 3.23Å; Y314-E320 PolarHBondContact OH-OE2 3.12Å
315	S	79.9	Confident	89.9	Confident	120 Å²	120	61.1 Å²	61.1	84%	0.839	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-19.1	-167.6	-57.4	0	0	0	0	117.2
316	D	87.2	Confident	90.1	Very high	86 Å²	86	64.2 Å²	64.2	46%	0.46	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-0.1	179.6	-67.6	-53.5	0	0	0	114.5	Y314 L318 K319 E320	Y314-D316 HydrophobicContact CE2-CB 4.47Å; Y314-D316 PolarHBondContact O-N 3.07Å; D316-L318 VanDerWaalsContact C-N 3.33Å; D316-L318 PolarHBondContact O-N 2.97Å; D316-K319 PolarHBondContact O-N 3.26Å; D316-K319 IonicContact OD1-NZ 2.97Å; D316-K319 PolarHBondContact OD1-NZ 2.86Å; D316-E320 PolarHBondContact O-N 2.89Å
317	L	91	Very high	90.5	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-43.3	-175.4	-179.2	63.8	0	0	0	111.7	I309 Y314 K319 E320 V321 F330 L337	I309-L317 HydrophobicContact CG2-CD2 4.15Å; I309-L317 HydrophobicContact CG2-CG 4.06Å; Y314-L317 HydrophobicContact CD1-CB 4.15Å; Y314-L317 HydrophobicContact CD2-CB 4.13Å; Y314-L317 HydrophobicContact CE1-CB 3.92Å; Y314-L317 HydrophobicContact CE1-CD1 3.82Å; Y314-L317 HydrophobicContact CE1-CD2 4.37Å; Y314-L317 HydrophobicContact CE1-CG 4.24Å; Y314-L317 HydrophobicContact CE2-CB 3.88Å; Y314-L317 HydrophobicContact CG-CB 4.25Å; Y314-L317 WeakPolarHBondContact O-CB 3.31Å; Y314-L317 PolarHBondContact O-N 3.08Å; Y314-L317 WeakPolarHBondContact OH-CD1 3.23Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 3.21Å; L317-E320 PolarHBondContact O-N 2.99Å; L317-V321 HydrophobicContact CD1-CG2 4.26Å; L317-V321 HydrophobicContact CG-CG2 4.33Å; L317-V321 WeakPolarHBondContact O-CB 3.44Å; L317-V321 VanDerWaalsContact O-CG2 3.23Å; L317-V321 WeakPolarHBondContact O-CG2 3.5Å; L317-V321 PolarHBondContact O-N 3.1Å; L317-F330 HydrophobicContact CD2-CE1 4.09Å; L317-F330 HydrophobicContact CD2-CZ 4.23Å; L317-L337 HydrophobicContact CD2-CD1 3.42Å; L317-L337 VanDerWaalsContact CD2-CD1 3.42Å
318	L	92.2	Very high	90.9	Very high	45 Å²	45	63.6 Å²	63.6	24%	0.236	33%	0.333	C	S	.	.	H	α-helix	trans	-60.1	-40.1	177.5	178.7	59.5	0	0	0	111.5	T306 I309 D316 V321 L322	T306-L318 HydrophobicContact CG2-CD1 3.96Å; I309-L318 HydrophobicContact CB-CD1 4.27Å; I309-L318 HydrophobicContact CD1-CD1 4.4Å; I309-L318 HydrophobicContact CG2-CB 3.97Å; I309-L318 HydrophobicContact CG2-CD1 4.11Å; D316-L318 VanDerWaalsContact C-N 3.33Å; D316-L318 PolarHBondContact O-N 2.97Å; L318-V321 PolarHBondContact O-N 3.19Å; L318-L322 HydrophobicContact CD1-CD1 4.04Å; L318-L322 HydrophobicContact CD1-CG 4.08Å; L318-L322 HydrophobicContact CG-CD1 4.05Å; L318-L322 HydrophobicContact CG-CG 4.47Å; L318-L322 VanDerWaalsContact O-CG 3.27Å; L318-L322 WeakPolarHBondContact O-CG 3.13Å; L318-L322 PolarHBondContact O-N 2.8Å
319	K	92.7	Very high	91	Very high	102 Å²	102	63.6 Å²	63.6	44%	0.443	33%	0.333	S	S	.	.	H	α-helix	trans	-69.3	-37.1	177.6	-59.7	175.8	-168.1	153.9	0	111.9	D316 L317 R323	D316-K319 PolarHBondContact O-N 3.26Å; D316-K319 IonicContact OD1-NZ 2.97Å; D316-K319 PolarHBondContact OD1-NZ 2.86Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 3.21Å; K319-R323 WeakPolarHBondContact O-CB 3.23Å; K319-R323 VanDerWaalsContact O-CG 3.23Å; K319-R323 WeakPolarHBondContact O-CG 3.33Å; K319-R323 PolarHBondContact O-N 3.35Å; K319-R323 VanDerWaalsContact O-N 3.15Å
320	E	92.4	Very high	91.2	Very high	68 Å²	68	63.8 Å²	63.8	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-47.7	172	-179.4	-173.5	150.6	0	0	110.6	Y314 D316 L317 L322 R323 S324 K335	Y314-E320 PolarHBondContact OH-OE2 3.12Å; D316-E320 PolarHBondContact O-N 2.89Å; L317-E320 PolarHBondContact O-N 2.99Å; E320-L322 PolarHBondContact O-N 3.3Å; E320-R323 PolarHBondContact O-N 3.27Å; E320-S324 PolarHBondContact O-N 2.91Å; E320-S324 PolarHBondContact O-OG 3.29Å; E320-K335 IonicContact OE1-NZ 2.82Å; E320-K335 PolarHBondContact OE1-NZ 3.12Å
321	V	93	Very high	91.3	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.024	32%	0.315	C	S	.	.	H	α-helix	trans	-58.7	-48.7	179.7	167.3	0	0	0	0	110.9	V293 I309 L317 L318 R323 S324 W327	V293-V321 HydrophobicContact CB-CG1 4.34Å; V293-V321 HydrophobicContact CG1-CG1 3.64Å; V293-V321 HydrophobicContact CG2-CG1 4.22Å; I309-V321 HydrophobicContact CD1-CG1 4.18Å; I309-V321 HydrophobicContact CG2-CG2 4.39Å; L317-V321 HydrophobicContact CD1-CG2 4.26Å; L317-V321 HydrophobicContact CG-CG2 4.33Å; L317-V321 WeakPolarHBondContact O-CB 3.44Å; L317-V321 VanDerWaalsContact O-CG2 3.23Å; L317-V321 WeakPolarHBondContact O-CG2 3.5Å; L317-V321 PolarHBondContact O-N 3.1Å; L318-V321 PolarHBondContact O-N 3.19Å; V321-R323 VanDerWaalsContact C-N 3.27Å; V321-R323 PolarHBondContact O-N 3.1Å; V321-S324 WeakPolarHBondContact O-CB 3.4Å; V321-S324 PolarHBondContact O-N 3.36Å; V321-W327 HydrophobicContact CG1-CD2 3.94Å; V321-W327 HydrophobicContact CG1-CG 4.08Å; V321-W327 HydrophobicContact CG1-CZ2 3.95Å; V321-W327 HydrophobicContact CG2-CZ2 4.34Å
322	L	91	Very high	91.5	Very high	114 Å²	114	61.3 Å²	61.3	60%	0.597	32%	0.317	S	S	*	.	H	α-helix	trans	-69.5	-21	-179.1	-66.7	175	0	0	0	114	V293 L318 E320	V293-L322 HydrophobicContact CG2-CD2 4.15Å; L318-L322 HydrophobicContact CD1-CD1 4.04Å; L318-L322 HydrophobicContact CD1-CG 4.08Å; L318-L322 HydrophobicContact CG-CD1 4.05Å; L318-L322 HydrophobicContact CG-CG 4.47Å; L318-L322 VanDerWaalsContact O-CG 3.27Å; L318-L322 WeakPolarHBondContact O-CG 3.13Å; L318-L322 PolarHBondContact O-N 2.8Å; E320-L322 PolarHBondContact O-N 3.3Å
323	R	93	Very high	91.5	Very high	184 Å²	184	63.1 Å²	63.1	69%	0.694	33%	0.331	S	S	*	.	H	α-helix	trans	-91.3	-9.1	174.4	-70	178.6	-167.3	128.7	-2.6	113.4	K319 E320 V321	K319-R323 WeakPolarHBondContact O-CB 3.23Å; K319-R323 VanDerWaalsContact O-CG 3.23Å; K319-R323 WeakPolarHBondContact O-CG 3.33Å; K319-R323 PolarHBondContact O-N 3.35Å; K319-R323 VanDerWaalsContact O-N 3.15Å; E320-R323 PolarHBondContact O-N 3.27Å; V321-R323 VanDerWaalsContact C-N 3.27Å; V321-R323 PolarHBondContact O-N 3.1Å
324	S	91.7	Very high	91.7	Very high	38 Å²	38	67.9 Å²	67.9	27%	0.266	35%	0.347	S	S	.	.			trans	-77.1	131.4	-179.1	-63.5	0	0	0	0	109.7	E320 V321	E320-S324 PolarHBondContact O-N 2.91Å; E320-S324 PolarHBondContact O-OG 3.29Å; V321-S324 WeakPolarHBondContact O-CB 3.4Å; V321-S324 PolarHBondContact O-N 3.36Å
325	D	90.5	Very high	92	Very high	144 Å²	144	67.5 Å²	67.5	77%	0.77	35%	0.348	S	S	*	.	S	Bend	trans	-143.8	107.7	175.4	-178.7	8.9	0	0	0	108.8
326	P	93	Very high	92.6	Very high	68 Å²	68	66.9 Å²	66.9	44%	0.442	33%	0.331	S	S	.	.	S	Bend	cis	-79.1	144	-2.6	31.7	-35.8	0	0	0	112.9	E296	E296-P326 HydrophobicContact CB-CB 3.88Å; E296-P326 HydrophobicContact CG-CB 4.48Å; E296-P326 VanDerWaalsContact OE2-CA 3.28Å; E296-P326 WeakPolarHBondContact OE2-CA 3.1Å; E296-P326 WeakPolarHBondContact OE2-CB 3.4Å
327	W	95.5	Very high	92.8	Very high	15 Å²	15	62.8 Å²	62.8	6%	0.057	31%	0.309	C	S	.	.			trans	-84.7	125.4	172.3	-176.7	71.8	0	0	0	113.2	V293 C295 E296 Y304 V321 C329 F330	V293-W327 HydrophobicContact CB-CH2 4.46Å; V293-W327 HydrophobicContact CB-CZ3 4.16Å; V293-W327 HydrophobicContact CG1-CD2 4Å; V293-W327 HydrophobicContact CG1-CE3 3.56Å; V293-W327 HydrophobicContact CG1-CH2 4.23Å; V293-W327 HydrophobicContact CG1-CZ3 3.7Å; C295-W327 HydrophobicContact CB-CZ3 4.4Å; E296-W327 PolarHBondContact N-O 2.72Å; E296-W327 PolarHBondContact OE1-N 3.48Å; E296-W327 VanDerWaalsContact OE1-N 3.13Å; Y304-W327 AromaticContact CD2-CH2 3.84Å; Y304-W327 HydrophobicContact CD2-CH2 3.84Å; Y304-W327 HydrophobicContact CG-CH2 4.43Å; V321-W327 HydrophobicContact CG1-CD2 3.94Å; V321-W327 HydrophobicContact CG1-CG 4.08Å; V321-W327 HydrophobicContact CG1-CZ2 3.95Å; V321-W327 HydrophobicContact CG2-CZ2 4.34Å; W327-C329 HydrophobicContact CH2-CB 3.67Å; W327-C329 HydrophobicContact CZ2-CB 4.21Å; W327-C329 HydrophobicContact CZ3-CB 3.88Å; W327-F330 HydrophobicContact CZ2-CE2 4.1Å; W327-F330 HydrophobicContact CZ2-CZ 4.28Å
328	H	96	Very high	92.8	Very high	83 Å²	83	63.7 Å²	63.7	38%	0.384	32%	0.321	S	S	.	.			trans	-106.5	122.1	174	-62	99.8	0	0	0	110.8	C332 S333	H328-C332 HydrophobicContact CB-CB 4.28Å; H328-S333 PolarHBondContact O-OG 3.3Å
329	C	95.6	Very high	92.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.323	C	S	.	.			trans	-59.4	163.5	-178	79.2	0	0	0	0	113.6	C295 Y304 W327 N331 C332 S333	C295-C329 HydrophobicContact CB-CB 3.79Å; C295-C329 PolarHBondContact SG-N 2.86Å; C295-C329 VanDerWaalsContact SG-SG 3.67Å; Y304-C329 HydrophobicContact CD2-CB 4.09Å; Y304-C329 HydrophobicContact CE2-CB 3.64Å; W327-C329 HydrophobicContact CH2-CB 3.67Å; W327-C329 HydrophobicContact CZ2-CB 4.21Å; W327-C329 HydrophobicContact CZ3-CB 3.88Å; C329-N331 PolarHBondContact O-N 3.03Å; C329-N331 VanDerWaalsContact O-N 3.1Å; C329-C332 PolarHBondContact O-N 3.48Å; C329-S333 PolarHBondContact O-N 2.85Å; C329-S333 PolarHBondContact O-OG 3.01Å
330	F	95	Very high	92.6	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-51.6	-37	-178.2	-53.1	-71.2	0	0	0	113.4	F235 Y304 I309 L317 W327 K334 K335 L337 V342	F235-F330 HydrophobicContact CE1-CB 4.12Å; F235-F330 HydrophobicContact CZ-CB 4.14Å; F235-F330 HydrophobicContact CZ-CD2 4.27Å; F235-F330 HydrophobicContact CZ-CG 4.44Å; Y304-F330 HydrophobicContact CD1-CD2 4.01Å; Y304-F330 HydrophobicContact CD1-CE2 4.09Å; Y304-F330 HydrophobicContact CD2-CD2 4.33Å; Y304-F330 AromaticContact CE1-CD2 3.83Å; Y304-F330 HydrophobicContact CE1-CD2 3.83Å; Y304-F330 HydrophobicContact CE1-CE2 4.37Å; Y304-F330 HydrophobicContact CE2-CD2 4.18Å; Y304-F330 HydrophobicContact CG-CD2 4.26Å; Y304-F330 HydrophobicContact CG-CE2 4.18Å; Y304-F330 AromaticContact CZ-CD2 3.91Å; I309-F330 HydrophobicContact CG1-CE2 4.18Å; I309-F330 HydrophobicContact CG1-CZ 4.25Å; L317-F330 HydrophobicContact CD2-CE1 4.09Å; L317-F330 HydrophobicContact CD2-CZ 4.23Å; W327-F330 HydrophobicContact CZ2-CE2 4.1Å; W327-F330 HydrophobicContact CZ2-CZ 4.28Å; F330-K334 WeakPolarHBondContact O-CA 3.27Å; F330-K334 PolarHBondContact O-N 3.39Å; F330-K335 WeakPolarHBondContact CB-O 3.39Å; F330-K335 WeakPolarHBondContact CD1-O 3.47Å; F330-L337 HydrophobicContact CD1-CB 3.94Å; F330-L337 HydrophobicContact CD2-CB 4.27Å; F330-L337 HydrophobicContact CD2-CD2 4.34Å; F330-L337 HydrophobicContact CE1-CB 3.95Å; F330-L337 HydrophobicContact CE1-CD1 4.15Å; F330-L337 HydrophobicContact CE2-CB 4.28Å; F330-L337 HydrophobicContact CE2-CD1 4.25Å; F330-L337 HydrophobicContact CE2-CD2 4.01Å; F330-L337 HydrophobicContact CE2-CG 4.4Å; F330-L337 HydrophobicContact CG-CB 4.12Å; F330-L337 HydrophobicContact CZ-CB 4.13Å; F330-L337 HydrophobicContact CZ-CD1 3.76Å; F330-L337 HydrophobicContact CZ-CD2 4.36Å; F330-L337 HydrophobicContact CZ-CG 4.29Å; F330-V342 HydrophobicContact CB-CG2 3.84Å; F330-V342 WeakPolarHBondContact O-CG2 3.3Å
331	N	93.4	Very high	92.6	Very high	11 Å²	11	57.9 Å²	57.9	6%	0.059	30%	0.298	C	S	.	.	H	α-helix	trans	-72.3	-34	176.3	-169.9	39.9	0	0	0	113.8	F234 C329 K334 W346	F234-N331 HydrophobicContact CD1-CB 4.32Å; C329-N331 PolarHBondContact O-N 3.03Å; C329-N331 VanDerWaalsContact O-N 3.1Å; N331-K334 VanDerWaalsContact O-CD 3.3Å; N331-K334 WeakPolarHBondContact O-CD 3.23Å; N331-K334 WeakPolarHBondContact O-CE 3.44Å; N331-K334 PolarHBondContact O-NZ 3.23Å; N331-K334 PolarHBondContact OD1-NZ 2.97Å; N331-K334 VanDerWaalsContact OD1-NZ 3.15Å; N331-W346 PolarHBondContact ND2-NE1 3.31Å
332	C	94.4	Very high	92.7	Very high	51 Å²	51	58.4 Å²	58.4	35%	0.345	30%	0.301	S	S	.	.	H	α-helix	trans	-80.4	-44.1	179.9	-70.1	0	0	0	0	111.9	H328 C329 K334	H328-C332 HydrophobicContact CB-CB 4.28Å; C329-C332 PolarHBondContact O-N 3.48Å; C332-K334 VanDerWaalsContact C-N 3.33Å
333	S	93	Very high	92.8	Very high	46 Å²	46	53.9 Å²	53.9	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-82.2	-12.1	179.5	60	0	0	0	0	113.5	H328 C329 K335	H328-S333 PolarHBondContact O-OG 3.3Å; C329-S333 PolarHBondContact O-N 2.85Å; C329-S333 PolarHBondContact O-OG 3.01Å; S333-K335 PolarHBondContact O-N 2.98Å; S333-K335 VanDerWaalsContact O-N 3.08Å; S333-K335 PolarHBondContact OG-N 3.34Å
334	K	91.1	Very high	92.7	Very high	116 Å²	116	49.8 Å²	49.8	50%	0.504	27%	0.273	S	S	.	.			trans	56.5	17.4	-171.8	-53.1	-59.5	179.6	-166	0	113.6	F330 N331 C332 V342	F330-K334 WeakPolarHBondContact O-CA 3.27Å; F330-K334 PolarHBondContact O-N 3.39Å; N331-K334 VanDerWaalsContact O-CD 3.3Å; N331-K334 WeakPolarHBondContact O-CD 3.23Å; N331-K334 WeakPolarHBondContact O-CE 3.44Å; N331-K334 PolarHBondContact O-NZ 3.23Å; N331-K334 PolarHBondContact OD1-NZ 2.97Å; N331-K334 VanDerWaalsContact OD1-NZ 3.15Å; C332-K334 VanDerWaalsContact C-N 3.33Å; K334-V342 HydrophobicContact CD-CG1 4.45Å
335	K	91.2	Very high	92.6	Very high	112 Å²	112	50.9 Å²	50.9	49%	0.487	28%	0.276	S	S	.	.			trans	-74.1	139.1	170.7	-72.6	-174.8	171.2	-175.2	0	109.9	E320 F330 S333 V342	E320-K335 IonicContact OE1-NZ 2.82Å; E320-K335 PolarHBondContact OE1-NZ 3.12Å; F330-K335 WeakPolarHBondContact CB-O 3.39Å; F330-K335 WeakPolarHBondContact CD1-O 3.47Å; S333-K335 PolarHBondContact O-N 2.98Å; S333-K335 VanDerWaalsContact O-N 3.08Å; S333-K335 PolarHBondContact OG-N 3.34Å; K335-V342 VanDerWaalsContact O-CG2 3.31Å; K335-V342 WeakPolarHBondContact O-CG2 3.32Å
336	Q	91.1	Very high	92.6	Very high	106 Å²	106	46.6 Å²	46.6	50%	0.495	25%	0.249	S	C	.	.			trans	-73.1	150.6	174.5	-61.4	-177.7	-8.5	0	0	111.1	G338 V341	Q336-G338 PolarHBondContact O-N 3.25Å; Q336-V341 HydrophobicContact CG-CG1 4.42Å
337	L	92	Very high	92.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-96.8	82.3	171	169.8	51.9	0	0	0	108.3	F235 L285 F312 L317 F330 I339 L340	F235-L337 HydrophobicContact CE1-CB 4Å; F235-L337 HydrophobicContact CZ-CB 4.41Å; F235-L337 HydrophobicContact CZ-CD2 4.31Å; L285-L337 HydrophobicContact CD2-CD2 3.8Å; F312-L337 HydrophobicContact CB-CD1 4.18Å; F312-L337 HydrophobicContact CB-CD2 4.14Å; F312-L337 HydrophobicContact CB-CG 3.79Å; L317-L337 HydrophobicContact CD2-CD1 3.42Å; L317-L337 VanDerWaalsContact CD2-CD1 3.42Å; F330-L337 HydrophobicContact CD1-CB 3.94Å; F330-L337 HydrophobicContact CD2-CB 4.27Å; F330-L337 HydrophobicContact CD2-CD2 4.34Å; F330-L337 HydrophobicContact CE1-CB 3.95Å; F330-L337 HydrophobicContact CE1-CD1 4.15Å; F330-L337 HydrophobicContact CE2-CB 4.28Å; F330-L337 HydrophobicContact CE2-CD1 4.25Å; F330-L337 HydrophobicContact CE2-CD2 4.01Å; F330-L337 HydrophobicContact CE2-CG 4.4Å; F330-L337 HydrophobicContact CG-CB 4.12Å; F330-L337 HydrophobicContact CZ-CB 4.13Å; F330-L337 HydrophobicContact CZ-CD1 3.76Å; F330-L337 HydrophobicContact CZ-CD2 4.36Å; F330-L337 HydrophobicContact CZ-CG 4.29Å; L337-I339 PolarHBondContact O-N 3.25Å; L337-L340 HydrophobicContact CB-CB 4.14Å; L337-L340 HydrophobicContact CD2-CD1 4.13Å; L337-L340 HydrophobicContact CG-CD1 4.35Å; L337-L340 PolarHBondContact N-O 3.34Å; L337-L340 WeakPolarHBondContact O-CB 3.28Å; L337-L340 PolarHBondContact O-N 3.11Å
338	G	90.1	Very high	92.1	Very high	27 Å²	27	54.7 Å²	54.7	28%	0.278	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	-109.4	-172.3	0	0	0	0	0	111.7	F312 Q336 L340	F312-G338 VanDerWaalsContact O-CA 3.26Å; F312-G338 WeakPolarHBondContact O-CA 3.4Å; Q336-G338 PolarHBondContact O-N 3.25Å; G338-L340 VanDerWaalsContact C-N 3.32Å
339	I	88.9	Confident	91.8	Very high	53 Å²	53	51.2 Å²	51.2	27%	0.272	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.2	-179.9	69.7	174.6	0	0	0	113.4	T207 P209 I212 F312 L337 V341	T207-I339 WeakPolarHBondContact O-CD1 3.23Å; P209-I339 HydrophobicContact CG-CB 4.32Å; P209-I339 HydrophobicContact CG-CD1 4.41Å; P209-I339 HydrophobicContact CG-CG2 3.85Å; I212-I339 HydrophobicContact CD1-CD1 3.66Å; I212-I339 HydrophobicContact CD1-CG1 3.95Å; F312-I339 HydrophobicContact CD1-CG1 4.49Å; L337-I339 PolarHBondContact O-N 3.25Å; I339-V341 PolarHBondContact O-N 3.18Å
340	L	93.2	Very high	91.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-86.1	107.5	-179.2	-71.6	173.7	0	0	0	110.9	I212 V217 F235 A237 L285 F312 L337 G338	I212-L340 HydrophobicContact CD1-CD2 3.43Å; I212-L340 VanDerWaalsContact CD1-CD2 3.43Å; I212-L340 HydrophobicContact CD1-CG 4.18Å; I212-L340 HydrophobicContact CG1-CD2 4.27Å; V217-L340 HydrophobicContact CG2-CD2 4.2Å; F235-L340 HydrophobicContact CB-CB 4.41Å; F235-L340 HydrophobicContact CB-CD2 4.22Å; F235-L340 HydrophobicContact CD1-CB 3.7Å; F235-L340 HydrophobicContact CE1-CB 4.2Å; F235-L340 HydrophobicContact CG-CB 4.16Å; A237-L340 HydrophobicContact CB-CD2 3.85Å; L285-L340 HydrophobicContact CD1-CD1 3.85Å; L285-L340 HydrophobicContact CD2-CD1 3.6Å; L285-L340 HydrophobicContact CG-CD1 4.43Å; F312-L340 HydrophobicContact CB-CD1 3.8Å; F312-L340 HydrophobicContact CB-CG 4.34Å; F312-L340 HydrophobicContact CD1-CD1 3.69Å; F312-L340 HydrophobicContact CD1-CG 4.03Å; F312-L340 HydrophobicContact CD2-CD1 3.84Å; F312-L340 HydrophobicContact CE1-CD1 4.17Å; F312-L340 HydrophobicContact CE2-CD1 4.31Å; F312-L340 HydrophobicContact CG-CD1 3.5Å; F312-L340 VanDerWaalsContact CG-CD1 3.5Å; F312-L340 HydrophobicContact CG-CG 4.22Å; F312-L340 HydrophobicContact CZ-CD1 4.46Å; L337-L340 HydrophobicContact CB-CB 4.14Å; L337-L340 HydrophobicContact CD2-CD1 4.13Å; L337-L340 HydrophobicContact CG-CD1 4.35Å; L337-L340 PolarHBondContact N-O 3.34Å; L337-L340 WeakPolarHBondContact O-CB 3.28Å; L337-L340 PolarHBondContact O-N 3.11Å; G338-L340 VanDerWaalsContact C-N 3.32Å
341	V	92.6	Very high	91.1	Very high	40 Å²	40	58.5 Å²	58.5	24%	0.242	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-81.4	131.8	175.6	-174.4	0	0	0	0	110.3	F235 F236 Q336 I339	F235-V341 CarbonylContact C-O 3.43Å; F235-V341 WeakPolarHBondContact CA-O 3.46Å; F236-V341 HydrophobicContact CD2-CB 3.92Å; F236-V341 HydrophobicContact CD2-CG1 3.83Å; F236-V341 HydrophobicContact CE2-CG1 4.2Å; F236-V341 PolarHBondContact N-O 3.29Å; Q336-V341 HydrophobicContact CG-CG1 4.42Å; I339-V341 PolarHBondContact O-N 3.18Å
342	V	94.4	Very high	90.7	Very high	15 Å²	15	61.3 Å²	61.3	9%	0.091	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-72.2	136.1	178.5	176.3	0	0	0	0	110.7	F234 F235 F330 K334 K335	F234-V342 CarbonylContact O-C 3.54Å; F234-V342 WeakPolarHBondContact O-CA 3.37Å; F235-V342 HydrophobicContact CD1-CG2 4.07Å; F235-V342 HydrophobicContact CE1-CG2 3.77Å; F330-V342 HydrophobicContact CB-CG2 3.84Å; F330-V342 WeakPolarHBondContact O-CG2 3.3Å; K334-V342 HydrophobicContact CD-CG1 4.45Å; K335-V342 VanDerWaalsContact O-CG2 3.31Å; K335-V342 WeakPolarHBondContact O-CG2 3.32Å
343	R	93.2	Very high	90.4	Very high	19 Å²	19	59.1 Å²	59.1	7%	0.072	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-77.7	129.2	174.8	-73.6	-178.5	-176.4	-106.5	0.8	110.9	D231 H232 F234 F235 F236 W346	D231-R343 IonicContact OD1-CZ 3.8Å; D231-R343 IonicContact OD1-NH2 3.03Å; D231-R343 PolarHBondContact OD1-NH2 3.16Å; D231-R343 IonicContact OD2-CZ 2.76Å; D231-R343 VanDerWaalsContact OD2-CZ 3.28Å; D231-R343 IonicContact OD2-NH1 2.63Å; D231-R343 PolarHBondContact OD2-NH1 2.97Å; D231-R343 IonicContact OD2-NH2 3.97Å; D231-R343 PolarHBondContact OD2-NH2 3.3Å; D231-R343 VanDerWaalsContact OD2-NH2 3.09Å; H232-R343 WeakPolarHBondContact O-CD 3.17Å; H232-R343 PolarHBondContact O-NE 3.31Å; F234-R343 PolarHBondContact O-N 3.29Å; F235-R343 PolarHBondContact O-NE 3.23Å; F236-R343 HydrophobicContact CD1-CG 4.14Å; F236-R343 HydrophobicContact CD2-CG 3.88Å; F236-R343 HydrophobicContact CE1-CG 4.19Å; F236-R343 HydrophobicContact CE2-CB 4.46Å; F236-R343 HydrophobicContact CE2-CG 3.95Å; F236-R343 HydrophobicContact CG-CG 3.99Å; F236-R343 HydrophobicContact CZ-CG 4.1Å; R343-W346 HydrophobicContact CB-CB 4.37Å
344	P	90.3	Very high	90	Very high	98 Å²	98	59.5 Å²	59.5	64%	0.636	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-37.7	172.8	27.1	-32.1	0	0	0	111.4	W346	P344-W346 PolarHBondContact O-N 3.3Å
345	N	89.5	Confident	89.3	Confident	61 Å²	61	56.7 Å²	56.7	33%	0.326	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	38.9	-177.9	65.5	-32.2	0	0	0	113.2	E347 Q348 S349	N345-E347 PolarHBondContact O-N 2.95Å; N345-E347 VanDerWaalsContact O-N 3.14Å; N345-Q348 PolarHBondContact ND2-OE1 3.44Å; N345-Q348 PolarHBondContact O-N 3Å; N345-Q348 VanDerWaalsContact O-N 3.1Å; N345-S349 PolarHBondContact O-N 3.47Å
346	W	91.4	Very high	87.8	Confident	53 Å²	53	57.2 Å²	57.2	20%	0.201	31%	0.309	C	S	.	.	H	α-helix	trans	-57.5	-29.7	-175.6	71.1	-84.1	0	0	0	113.6	P233 F234 N331 R343 P344 S349 L350	P233-W346 WeakPolarHBondContact O-CA 3.43Å; P233-W346 WeakPolarHBondContact O-CB 3.49Å; F234-W346 HydrophobicContact CD1-CB 4.04Å; F234-W346 HydrophobicContact CD1-CD2 4.01Å; F234-W346 AromaticContact CD1-CE3 3.84Å; F234-W346 HydrophobicContact CD1-CE3 3.84Å; F234-W346 HydrophobicContact CD1-CG 4.12Å; F234-W346 AromaticContact CE1-CD2 3.84Å; F234-W346 HydrophobicContact CE1-CD2 3.84Å; F234-W346 AromaticContact CE1-CE3 3.31Å; F234-W346 HydrophobicContact CE1-CE3 3.31Å; F234-W346 HydrophobicContact CE1-CG 4.43Å; F234-W346 AromaticContact CE1-CZ3 3.73Å; F234-W346 HydrophobicContact CE1-CZ3 3.73Å; F234-W346 HydrophobicContact CZ-CE3 4.23Å; F234-W346 HydrophobicContact CZ-CZ3 4.37Å; N331-W346 PolarHBondContact ND2-NE1 3.31Å; R343-W346 HydrophobicContact CB-CB 4.37Å; P344-W346 PolarHBondContact O-N 3.3Å; W346-S349 PolarHBondContact O-N 3.44Å; W346-L350 HydrophobicContact CE3-CB 4.45Å; W346-L350 HydrophobicContact CE3-CD2 4.39Å; W346-L350 HydrophobicContact CZ3-CD2 3.85Å; W346-L350 VanDerWaalsContact O-CB 3.26Å; W346-L350 WeakPolarHBondContact O-CB 3.45Å; W346-L350 PolarHBondContact O-N 3.26Å
347	E	89.9	Confident	86	Confident	123 Å²	123	56 Å²	56	58%	0.575	31%	0.308	S	S	*	.	H	α-helix	trans	-61.7	-43	177.1	-71.9	141.2	-164.1	0	0	112	N345 L350 F351	N345-E347 PolarHBondContact O-N 2.95Å; N345-E347 VanDerWaalsContact O-N 3.14Å; E347-L350 PolarHBondContact O-N 3.29Å; E347-F351 WeakPolarHBondContact O-CB 3.5Å; E347-F351 PolarHBondContact O-N 3.4Å
348	Q	88.2	Confident	83.9	Confident	131 Å²	131	65.4 Å²	65.4	61%	0.612	35%	0.352	S	S	*	.	H	α-helix	trans	-68.7	-43.3	177.4	-65.8	173.2	-10.6	0	0	110.8	N345 L350 F351 A352	N345-Q348 PolarHBondContact ND2-OE1 3.44Å; N345-Q348 PolarHBondContact O-N 3Å; N345-Q348 VanDerWaalsContact O-N 3.1Å; Q348-L350 VanDerWaalsContact C-N 3.3Å; Q348-L350 PolarHBondContact O-N 3Å; Q348-F351 PolarHBondContact O-N 3.09Å; Q348-A352 WeakPolarHBondContact O-CB 3.34Å; Q348-A352 PolarHBondContact O-N 3.29Å
349	S	89.9	Confident	82	Confident	9 Å²	9	68.7 Å²	68.7	6%	0.063	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-36.7	176	-62.7	0	0	0	0	111.8	N345 W346 L353	N345-S349 PolarHBondContact O-N 3.47Å; W346-S349 PolarHBondContact O-N 3.44Å; S349-L353 WeakPolarHBondContact O-CB 3.28Å; S349-L353 PolarHBondContact O-N 2.99Å
350	L	89.5	Confident	80	Confident	27 Å²	27	69.5 Å²	69.5	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-65.6	-48.3	173.6	-175.7	72.2	0	0	0	111.1	P233 Y271 W346 E347 Q348 A352 L353 F354	P233-L350 HydrophobicContact CB-CB 4.02Å; P233-L350 HydrophobicContact CB-CD1 3.78Å; P233-L350 HydrophobicContact CG-CD1 4.23Å; Y271-L350 HydrophobicContact CD1-CD1 4.09Å; Y271-L350 HydrophobicContact CE1-CD1 3.5Å; Y271-L350 VanDerWaalsContact CE1-CD1 3.5Å; Y271-L350 HydrophobicContact CE1-CD2 3.84Å; Y271-L350 HydrophobicContact CE1-CG 4.26Å; Y271-L350 HydrophobicContact CE2-CD1 4.01Å; Y271-L350 VanDerWaalsContact CZ-CD1 3.45Å; Y271-L350 WeakPolarHBondContact OH-CD2 3.41Å; W346-L350 HydrophobicContact CE3-CB 4.45Å; W346-L350 HydrophobicContact CE3-CD2 4.39Å; W346-L350 HydrophobicContact CZ3-CD2 3.85Å; W346-L350 VanDerWaalsContact O-CB 3.26Å; W346-L350 WeakPolarHBondContact O-CB 3.45Å; W346-L350 PolarHBondContact O-N 3.26Å; E347-L350 PolarHBondContact O-N 3.29Å; Q348-L350 VanDerWaalsContact C-N 3.3Å; Q348-L350 PolarHBondContact O-N 3Å; L350-A352 VanDerWaalsContact C-N 3.34Å; L350-A352 PolarHBondContact O-N 2.9Å; L350-L353 WeakPolarHBondContact O-CB 3.47Å; L350-L353 PolarHBondContact O-N 3.26Å; L350-F354 HydrophobicContact CD1-CD2 3.72Å; L350-F354 HydrophobicContact CD1-CE2 3.49Å; L350-F354 VanDerWaalsContact CD1-CE2 3.49Å; L350-F354 HydrophobicContact CG-CD2 4.15Å; L350-F354 HydrophobicContact CG-CE2 4.39Å; L350-F354 WeakPolarHBondContact O-CD2 3.38Å; L350-F354 PolarHBondContact O-N 3.19Å; L350-F354 VanDerWaalsContact O-N 3.14Å
351	F	86	Confident	78	Confident	130 Å²	130	76.8 Å²	76.8	57%	0.57	41%	0.411	S	S	*	.	H	α-helix	trans	-57.2	-48.8	176.6	-177.5	-98.8	0	0	0	111.1	E347 Q348 L353 F354 N355	E347-F351 WeakPolarHBondContact O-CB 3.5Å; E347-F351 PolarHBondContact O-N 3.4Å; Q348-F351 PolarHBondContact O-N 3.09Å; F351-L353 VanDerWaalsContact C-N 3.3Å; F351-L353 PolarHBondContact O-N 3.04Å; F351-F354 PolarHBondContact O-N 3.44Å; F351-N355 HydrophobicContact CD1-CB 4.48Å; F351-N355 HydrophobicContact CE1-CB 4.25Å; F351-N355 WeakPolarHBondContact CE1-ND2 3.45Å; F351-N355 HydrophobicContact CZ-CB 4.48Å; F351-N355 VanDerWaalsContact O-CB 3.24Å; F351-N355 WeakPolarHBondContact O-CB 3.29Å; F351-N355 PolarHBondContact O-N 2.92Å
352	A	85.8	Confident	76	Confident	71 Å²	71	81.4 Å²	81.4	59%	0.587	44%	0.435	S	S	*	.	H	α-helix	trans	-61.2	-35.8	177.2	0	0	0	0	0	113.1	Q348 L350	Q348-A352 WeakPolarHBondContact O-CB 3.34Å; Q348-A352 PolarHBondContact O-N 3.29Å; L350-A352 VanDerWaalsContact C-N 3.34Å; L350-A352 PolarHBondContact O-N 2.9Å
353	L	86.6	Confident	74.2	Confident	5 Å²	5	85.9 Å²	85.9	3%	0.026	46%	0.457	C	S	.	.	H	α-helix	trans	-64.5	-40.3	176.8	-179.5	64.7	0	0	0	111.7	P233 L239 Q244 Y267 K268 S349 L350 F351	P233-L353 HydrophobicContact CG-CD2 4.25Å; L239-L353 HydrophobicContact CD1-CD2 4.36Å; Q244-L353 HydrophobicContact CG-CD1 4.22Å; Q244-L353 VanDerWaalsContact OE1-CD1 3.28Å; Y267-L353 HydrophobicContact CD1-CD2 3.98Å; Y267-L353 HydrophobicContact CE1-CD2 3.77Å; K268-L353 WeakPolarHBondContact CE-O 3.45Å; K268-L353 PolarHBondContact NZ-O 3.04Å; S349-L353 WeakPolarHBondContact O-CB 3.28Å; S349-L353 PolarHBondContact O-N 2.99Å; L350-L353 WeakPolarHBondContact O-CB 3.47Å; L350-L353 PolarHBondContact O-N 3.26Å; F351-L353 VanDerWaalsContact C-N 3.3Å; F351-L353 PolarHBondContact O-N 3.04Å
354	F	84.2	Confident	72.6	Confident	53 Å²	53	88.8 Å²	88.8	23%	0.232	47%	0.474	C	S	.	.	H	α-helix	trans	-95.9	-13.9	-174.6	-74.8	-79.5	0	0	0	114.5	K268 Y271 F272 L350 F351 T356	K268-F354 HydrophobicContact CB-CE1 3.71Å; K268-F354 HydrophobicContact CB-CZ 4.25Å; K268-F354 HydrophobicContact CG-CD1 4.38Å; K268-F354 HydrophobicContact CG-CE1 3.81Å; K268-F354 HydrophobicContact CG-CZ 4.17Å; K268-F354 WeakPolarHBondContact O-CE1 3.39Å; Y271-F354 AromaticContact CD1-CE2 3.76Å; Y271-F354 HydrophobicContact CD1-CE2 3.76Å; Y271-F354 AromaticContact CD1-CZ 3.79Å; Y271-F354 HydrophobicContact CD1-CZ 3.79Å; Y271-F354 HydrophobicContact CE1-CE2 4.34Å; Y271-F354 HydrophobicContact CG-CE2 4.08Å; Y271-F354 AromaticContact CG-CZ 3.92Å; Y271-F354 HydrophobicContact CG-CZ 3.92Å; F272-F354 HydrophobicContact CD2-CE1 4.03Å; F272-F354 HydrophobicContact CD2-CZ 4.29Å; F272-F354 AromaticContact CE2-CD1 3.57Å; F272-F354 HydrophobicContact CE2-CD1 3.57Å; F272-F354 HydrophobicContact CE2-CD2 4.21Å; F272-F354 AromaticContact CE2-CE1 3.42Å; F272-F354 HydrophobicContact CE2-CE1 3.42Å; F272-F354 VanDerWaalsContact CE2-CE1 3.42Å; F272-F354 HydrophobicContact CE2-CE2 4.12Å; F272-F354 AromaticContact CE2-CG 3.96Å; F272-F354 HydrophobicContact CE2-CG 3.96Å; F272-F354 AromaticContact CE2-CZ 3.73Å; F272-F354 HydrophobicContact CE2-CZ 3.73Å; F272-F354 HydrophobicContact CZ-CD1 4.29Å; F272-F354 HydrophobicContact CZ-CD2 4.24Å; F272-F354 HydrophobicContact CZ-CE1 4.34Å; F272-F354 HydrophobicContact CZ-CE2 4.33Å; F272-F354 HydrophobicContact CZ-CG 4.23Å; F272-F354 HydrophobicContact CZ-CZ 4.37Å; L350-F354 HydrophobicContact CD1-CD2 3.72Å; L350-F354 HydrophobicContact CD1-CE2 3.49Å; L350-F354 VanDerWaalsContact CD1-CE2 3.49Å; L350-F354 HydrophobicContact CG-CD2 4.15Å; L350-F354 HydrophobicContact CG-CE2 4.39Å; L350-F354 WeakPolarHBondContact O-CD2 3.38Å; L350-F354 PolarHBondContact O-N 3.19Å; L350-F354 VanDerWaalsContact O-N 3.14Å; F351-F354 PolarHBondContact O-N 3.44Å; F354-T356 PolarHBondContact O-N 3.29Å
355	N	77	Confident	71.4	Confident	58 Å²	58	90 Å²	90	31%	0.31	47%	0.474	S	S	.	.			trans	-75.9	106.3	175.4	-163.5	0	0	0	0	109.9	F351 V357	F351-N355 HydrophobicContact CD1-CB 4.48Å; F351-N355 HydrophobicContact CE1-CB 4.25Å; F351-N355 WeakPolarHBondContact CE1-ND2 3.45Å; F351-N355 HydrophobicContact CZ-CB 4.48Å; F351-N355 VanDerWaalsContact O-CB 3.24Å; F351-N355 WeakPolarHBondContact O-CB 3.29Å; F351-N355 PolarHBondContact O-N 2.92Å; N355-V357 VanDerWaalsContact C-N 3.32Å; N355-V357 PolarHBondContact ND2-O 3.38Å; N355-V357 PolarHBondContact OD1-N 3.44Å; N355-V357 PolarHBondContact OD1-O 3.05Å; N355-V357 VanDerWaalsContact OD1-O 3.1Å
356	T	59.1	Low	70.3	Confident	122 Å²	122	92.7 Å²	92.7	75%	0.748	49%	0.493	S	S	*	.			trans	-85.3	-7.5	177.8	50.9	0	0	0	0	113.1	F354	F354-T356 PolarHBondContact O-N 3.29Å
357	V	55.1	Low	69.1	Low	81 Å²	81	96.8 Å²	96.8	49%	0.491	52%	0.518	S	S	.	.	S	Bend	trans	-111.6	114.9	-177.3	-165	0	0	0	0	106.9	N355 I359	N355-V357 VanDerWaalsContact C-N 3.32Å; N355-V357 PolarHBondContact ND2-O 3.38Å; N355-V357 PolarHBondContact OD1-N 3.44Å; N355-V357 PolarHBondContact OD1-O 3.05Å; N355-V357 VanDerWaalsContact OD1-O 3.1Å; V357-I359 HydrophobicContact CB-CD1 4.39Å; V357-I359 HydrophobicContact CB-CG1 3.88Å; V357-I359 HydrophobicContact CG1-CD1 4.2Å; V357-I359 HydrophobicContact CG1-CG1 3.45Å; V357-I359 VanDerWaalsContact CG1-CG1 3.45Å; V357-I359 PolarHBondContact O-N 2.63Å
358	H	46.5	Very low	67.8	Low	198 Å²	198	94.6 Å²	94.6	92%	0.917	51%	0.51	S	S	*	.			trans	-64.6	62.2	160.3	-73.6	-84.5	0	0	0	109.2	S360	H358-S360 PolarHBondContact O-N 2.99Å
359	I	49.9	Very low	66.8	Low	96 Å²	96	92.6 Å²	92.6	49%	0.492	51%	0.508	S	S	.	.			trans	-67.8	100.4	155.7	-53.9	179.7	0	0	0	101.8	V357 D361 I363	V357-I359 HydrophobicContact CB-CD1 4.39Å; V357-I359 HydrophobicContact CB-CG1 3.88Å; V357-I359 HydrophobicContact CG1-CD1 4.2Å; V357-I359 HydrophobicContact CG1-CG1 3.45Å; V357-I359 VanDerWaalsContact CG1-CG1 3.45Å; V357-I359 PolarHBondContact O-N 2.63Å; I359-D361 PolarHBondContact O-N 2.63Å; I359-I363 HydrophobicContact CG2-CD1 4.12Å; I359-I363 HydrophobicContact CG2-CG1 4.38Å
360	S	47.9	Very low	65.7	Low	69 Å²	69	102 Å²	102	48%	0.483	55%	0.551	S	S	.	*			trans	-56.6	134.3	165.8	81.9	0	0	0	0	105.5	H358 D362	H358-S360 PolarHBondContact O-N 2.99Å; S360-D362 PolarHBondContact O-N 3.39Å; S360-D362 WeakPolarHBondContact OG-CB 3.5Å; S360-D362 PolarHBondContact OG-OD2 3.29Å
361	D	51.7	Low	64.9	Low	153 Å²	153	108.5 Å²	108.5	82%	0.818	58%	0.581	S	S	*	*	S	Bend	trans	-61.6	-0.7	176.3	-69.7	-43.8	0	0	0	111.8	I359 I363	I359-D361 PolarHBondContact O-N 2.63Å; D361-I363 PolarHBondContact O-N 3.06Å
362	D	49.6	Very low	64.3	Low	138 Å²	138	108.6 Å²	108.6	74%	0.738	58%	0.581	S	S	*	*			trans	-78.7	45.3	172.7	-46.4	-51.3	0	0	0	112.2	S360 D364	S360-D362 PolarHBondContact O-N 3.39Å; S360-D362 WeakPolarHBondContact OG-CB 3.5Å; S360-D362 PolarHBondContact OG-OD2 3.29Å; D362-D364 VanDerWaalsContact C-N 3.25Å; D362-D364 PolarHBondContact O-N 3.4Å
363	I	57.2	Low	64.2	Low	109 Å²	109	112.3 Å²	112.3	56%	0.559	59%	0.586	S	S	*	*			trans	-69.7	99.3	155.5	-61.2	176.3	0	0	0	105.1	I359 D361 L365	I359-I363 HydrophobicContact CG2-CD1 4.12Å; I359-I363 HydrophobicContact CG2-CG1 4.38Å; D361-I363 PolarHBondContact O-N 3.06Å; I363-L365 VanDerWaalsContact C-N 3.31Å; I363-L365 HydrophobicContact CG2-CD2 4.31Å; I363-L365 PolarHBondContact O-N 3.16Å
364	D	58.7	Low	64.3	Low	79 Å²	79	114.5 Å²	114.5	42%	0.422	60%	0.6	S	S	.	*			trans	-60.5	97.6	171.2	-176.1	-1.4	0	0	0	108.5	D362 T366 L367	D362-D364 VanDerWaalsContact C-N 3.25Å; D362-D364 PolarHBondContact O-N 3.4Å; D364-T366 PolarHBondContact O-N 3Å; D364-T366 VanDerWaalsContact OD1-CB 3.22Å; D364-T366 WeakPolarHBondContact OD1-CB 3.24Å; D364-T366 VanDerWaalsContact OD1-CG2 3.3Å; D364-T366 WeakPolarHBondContact OD1-CG2 3.45Å; D364-T366 PolarHBondContact OD1-N 3.43Å; D364-T366 PolarHBondContact OD1-OG1 2.95Å; D364-T366 PolarHBondContact OD2-OG1 2.95Å; D364-L367 HydrophobicContact CB-CD1 4.03Å; D364-L367 HydrophobicContact CB-CG 4.05Å; D364-L367 WeakPolarHBondContact O-CB 3.35Å; D364-L367 PolarHBondContact O-N 3.49Å
365	L	64.8	Low	64.6	Low	124 Å²	124	115 Å²	115	65%	0.649	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-60.8	-17.1	179.8	-62	175.5	0	0	0	111.5	I363 L367 I368	I363-L365 VanDerWaalsContact C-N 3.31Å; I363-L365 HydrophobicContact CG2-CD2 4.31Å; I363-L365 PolarHBondContact O-N 3.16Å; L365-L367 PolarHBondContact O-N 3.18Å; L365-I368 HydrophobicContact CB-CD1 4.49Å; L365-I368 HydrophobicContact CD2-CD1 3.57Å; L365-I368 WeakPolarHBondContact O-CB 3.32Å; L365-I368 PolarHBondContact O-N 3.3Å; L365-I368 VanDerWaalsContact O-N 3.1Å
366	T	66.9	Low	65.3	Low	118 Å²	118	118.7 Å²	118.7	72%	0.724	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-69.8	-17.3	173.9	75.9	0	0	0	0	112.9	D364 I368	D364-T366 PolarHBondContact O-N 3Å; D364-T366 VanDerWaalsContact OD1-CB 3.22Å; D364-T366 WeakPolarHBondContact OD1-CB 3.24Å; D364-T366 VanDerWaalsContact OD1-CG2 3.3Å; D364-T366 WeakPolarHBondContact OD1-CG2 3.45Å; D364-T366 PolarHBondContact OD1-N 3.43Å; D364-T366 PolarHBondContact OD1-OG1 2.95Å; D364-T366 PolarHBondContact OD2-OG1 2.95Å; T366-I368 VanDerWaalsContact C-N 3.27Å
367	L	66.5	Low	67	Low	138 Å²	138	114.2 Å²	114.2	72%	0.723	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-77.8	-12.7	171	-61.6	175.6	0	0	0	112.8	D364 L365 P369	D364-L367 HydrophobicContact CB-CD1 4.03Å; D364-L367 HydrophobicContact CB-CG 4.05Å; D364-L367 WeakPolarHBondContact O-CB 3.35Å; D364-L367 PolarHBondContact O-N 3.49Å; L365-L367 PolarHBondContact O-N 3.18Å; L367-P369 VanDerWaalsContact O-CD 3.28Å; L367-P369 WeakPolarHBondContact O-CD 3.26Å
368	I	62.2	Low	68.8	Low	77 Å²	77	113.5 Å²	113.5	40%	0.395	58%	0.58	S	S	.	*	S	Bend	trans	-79.9	114.3	175.3	-55.7	178.5	0	0	0	107.2	L365 T366 E370	L365-I368 HydrophobicContact CB-CD1 4.49Å; L365-I368 HydrophobicContact CD2-CD1 3.57Å; L365-I368 WeakPolarHBondContact O-CB 3.32Å; L365-I368 PolarHBondContact O-N 3.3Å; L365-I368 VanDerWaalsContact O-N 3.1Å; T366-I368 VanDerWaalsContact C-N 3.27Å; I368-E370 PolarHBondContact O-N 3.48Å
369	P	67	Low	71.1	Confident	89 Å²	89	105.2 Å²	105.2	58%	0.578	55%	0.545	S	S	*	.			trans	-57.6	140.4	179	-20.8	32.5	0	0	0	111.1	L367 E371	L367-P369 VanDerWaalsContact O-CD 3.28Å; L367-P369 WeakPolarHBondContact O-CD 3.26Å; P369-E371 PolarHBondContact O-N 3.37Å
370	E	68.4	Low	73.1	Confident	207 Å²	207	104.6 Å²	104.6	97%	0.967	54%	0.542	S	S	*	.	S	Bend	trans	-58.5	-36.8	175	-67.9	-174.4	166.9	0	0	111.3	I368	I368-E370 PolarHBondContact O-N 3.48Å
371	E	72.2	Confident	75.3	Confident	163 Å²	163	107.9 Å²	107.9	76%	0.762	55%	0.548	S	S	*	.	S	Bend	trans	-97.3	103.1	171.6	-71	-175	171.7	0	0	110.8	P369 Q373	P369-E371 PolarHBondContact O-N 3.37Å; E371-Q373 PolarHBondContact O-N 2.8Å
372	K	73	Confident	77.2	Confident	132 Å²	132	101.1 Å²	101.1	57%	0.574	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-74.5	123.1	174.7	-64.4	-175.4	-178.9	-180	0	109.9
373	Q	83.7	Confident	79.2	Confident	149 Å²	149	95.6 Å²	95.6	70%	0.696	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-62.2	143.7	170.2	-64.7	-61.3	-50.2	0	0	110	E371 I375	E371-Q373 PolarHBondContact O-N 2.8Å; Q373-I375 PolarHBondContact O-N 3.35Å
374	P	88.8	Confident	80.7	Confident	51 Å²	51	95 Å²	95	33%	0.331	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-51.2	136	170.4	-28.7	36.6	0	0	0	111.8	Q397 E399	P374-Q397 CarbonylContact C-O 3.45Å; P374-Q397 VanDerWaalsContact CA-O 3.26Å; P374-Q397 WeakPolarHBondContact CA-O 3.48Å; P374-Q397 HydrophobicContact CB-CB 4.22Å; P374-Q397 HydrophobicContact CG-CB 4.22Å; P374-E399 HydrophobicContact CB-CB 3.78Å
375	I	91	Very high	82.3	Confident	64 Å²	64	91.2 Å²	91.2	33%	0.328	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	146.4	-178.1	62.4	170.5	0	0	0	111.6	Q373 V377 L391 L396 Q397 I398 E399	Q373-I375 PolarHBondContact O-N 3.35Å; I375-V377 HydrophobicContact CD1-CG2 3.74Å; I375-V377 HydrophobicContact CG1-CG2 3.93Å; I375-L391 HydrophobicContact CD1-CD2 4.1Å; I375-L396 HydrophobicContact CD1-CB 4.44Å; I375-Q397 WeakPolarHBondContact CG1-O 3.35Å; I375-Q397 PolarHBondContact N-O 2.59Å; I375-I398 HydrophobicContact CG1-CG1 4.29Å; I375-I398 CarbonylContact O-C 3.49Å; I375-I398 WeakPolarHBondContact O-CA 3.35Å; I375-E399 PolarHBondContact O-N 3.28Å
376	R	91.6	Very high	83.5	Confident	135 Å²	135	89.5 Å²	89.5	51%	0.509	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.1	166	-61.5	-171	-59.6	-173	3.7	109	E399 R400 G439	R376-E399 WeakPolarHBondContact CD-OE2 3.33Å; R376-E399 HydrophobicContact CG-CB 3.99Å; R376-E399 HydrophobicContact CG-CG 4.4Å; R376-E399 VanDerWaalsContact CG-OE2 3.22Å; R376-E399 WeakPolarHBondContact CG-OE2 3.34Å; R376-R400 CarbonylContact C-O 3.51Å; R376-R400 WeakPolarHBondContact CA-O 3.32Å; R376-R400 HydrophobicContact CG-CB 4.22Å; R376-G439 PolarHBondContact NH1-OXT 2.86Å
377	V	93.4	Very high	84.6	Confident	28 Å²	28	85.5 Å²	85.5	17%	0.17	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.2	-173	-176.2	0	0	0	0	109.2	I375 L391 I398 R400 Y401 Y402	I375-V377 HydrophobicContact CD1-CG2 3.74Å; I375-V377 HydrophobicContact CG1-CG2 3.93Å; V377-L391 HydrophobicContact CB-CD1 4.43Å; V377-L391 HydrophobicContact CG1-CD1 4.09Å; V377-L391 HydrophobicContact CG2-CD1 3.69Å; V377-I398 HydrophobicContact CG2-CG2 4.35Å; V377-R400 PolarHBondContact N-O 3.48Å; V377-Y401 HydrophobicContact CB-CD2 3.56Å; V377-Y401 HydrophobicContact CB-CE2 3.94Å; V377-Y401 HydrophobicContact CB-CG 4.35Å; V377-Y401 HydrophobicContact CG1-CD2 3.65Å; V377-Y401 HydrophobicContact CG1-CE2 3.46Å; V377-Y401 VanDerWaalsContact CG1-CE2 3.46Å; V377-Y401 HydrophobicContact CG2-CD2 4.17Å; V377-Y402 PolarHBondContact O-N 3.09Å
378	L	93.6	Very high	85.8	Confident	67 Å²	67	79.1 Å²	79.1	35%	0.351	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	109	168.2	173	65.4	0	0	0	108	L380 Y402 L425 L431 V436	L378-L380 HydrophobicContact CD1-CD2 4.16Å; L378-L380 HydrophobicContact CD2-CD2 4.14Å; L378-L380 HydrophobicContact CG-CD2 3.94Å; L378-Y402 WeakPolarHBondContact CA-O 3.23Å; L378-L425 HydrophobicContact CD1-CD1 3.8Å; L378-L431 HydrophobicContact CD1-CD1 4.45Å; L378-L431 HydrophobicContact CD2-CD2 3.82Å; L378-V436 HydrophobicContact CD2-CG2 4.24Å
379	S	94.3	Very high	87.2	Confident	24 Å²	24	78.1 Å²	78.1	17%	0.168	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.7	177.7	-168.2	0	0	0	0	110	D382 Y401 Y402 C403 C404	S379-D382 WeakPolarHBondContact CB-OD1 3.44Å; S379-D382 PolarHBondContact OG-OD1 2.91Å; S379-Y401 VanDerWaalsContact CB-OH 3.32Å; S379-Y401 WeakPolarHBondContact CB-OH 3.49Å; S379-Y401 PolarHBondContact OG-OH 2.9Å; S379-Y402 PolarHBondContact N-O 3.1Å; S379-C403 WeakPolarHBondContact O-CA 3.47Å; S379-C404 PolarHBondContact O-N 3.43Å
380	L	93.6	Very high	88.4	Confident	83 Å²	83	78 Å²	78	44%	0.435	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.6	176.4	-55.5	-175.6	0	0	0	108.8	L378 C404 V428 L431	L378-L380 HydrophobicContact CD1-CD2 4.16Å; L378-L380 HydrophobicContact CD2-CD2 4.14Å; L378-L380 HydrophobicContact CG-CD2 3.94Å; L380-C404 HydrophobicContact CD2-CB 4.21Å; L380-V428 HydrophobicContact CD1-CG2 4.34Å; L380-V428 HydrophobicContact CD2-CG2 3.88Å; L380-L431 HydrophobicContact CD2-CD2 4.25Å
381	F	92.6	Very high	89.5	Confident	138 Å²	138	69.6 Å²	69.6	61%	0.605	36%	0.36	S	S	*	.	S	Bend	trans	62.2	55.1	-172.6	-43.2	-78.6	0	0	0	111.2	G383 C404 V428	F381-G383 PolarHBondContact O-N 3.43Å; F381-C404 VanDerWaalsContact CA-O 3.28Å; F381-C404 WeakPolarHBondContact CA-O 3.22Å; F381-C404 PolarHBondContact N-O 2.77Å; F381-V428 HydrophobicContact CE1-CG1 3.94Å; F381-V428 HydrophobicContact CZ-CG1 3.83Å
382	D	91.8	Very high	90.4	Very high	11 Å²	11	65.4 Å²	65.4	6%	0.059	34%	0.343	C	S	.	.			trans	-64.6	-25.9	-168.7	-166.5	42.6	0	0	0	113.8	S379 L384 A385 Y401 C403 C404 E405	S379-D382 WeakPolarHBondContact CB-OD1 3.44Å; S379-D382 PolarHBondContact OG-OD1 2.91Å; D382-L384 PolarHBondContact O-N 3.34Å; D382-A385 PolarHBondContact O-N 3.38Å; D382-A385 WeakPolarHBondContact OD2-CA 3.48Å; D382-A385 WeakPolarHBondContact OD2-CB 3.21Å; D382-Y401 PolarHBondContact OD1-OH 2.99Å; D382-C403 HydrophobicContact CB-CB 3.66Å; D382-C403 VanDerWaalsContact OD2-CB 3.31Å; D382-C403 WeakPolarHBondContact OD2-CB 3.33Å; D382-C404 PolarHBondContact N-O 3.47Å; D382-E405 HydrophobicContact CB-CB 4.46Å
383	G	91.6	Very high	91.1	Very high	22 Å²	22	65.6 Å²	65.6	23%	0.227	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	-122.3	-175.1	0	0	0	0	0	111.3	F381 A385 E405 S414	F381-G383 PolarHBondContact O-N 3.43Å; G383-A385 PolarHBondContact O-N 2.85Å; G383-E405 VanDerWaalsContact CA-OE2 3.3Å; G383-E405 WeakPolarHBondContact CA-OE2 3.39Å; G383-E405 PolarHBondContact N-OE2 2.9Å; G383-S414 PolarHBondContact O-OG 3.28Å
384	L	89.1	Confident	91.4	Very high	95 Å²	95	64.4 Å²	64.4	50%	0.497	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	23.3	-178.4	-54.3	-178.6	0	0	0	113.8	D382 T386 A410 V413	D382-L384 PolarHBondContact O-N 3.34Å; L384-T386 VanDerWaalsContact C-N 3.27Å; L384-T386 PolarHBondContact O-N 3.37Å; L384-A410 HydrophobicContact CD2-CB 3.99Å; L384-V413 HydrophobicContact CD2-CB 3.9Å; L384-V413 HydrophobicContact CD2-CG1 4Å; L384-V413 HydrophobicContact CD2-CG2 4.19Å
385	A	91.4	Very high	91.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	33.9	-176.7	0	0	0	0	0	114	D382 G383 G387 K388 V389 S414	D382-A385 PolarHBondContact O-N 3.38Å; D382-A385 WeakPolarHBondContact OD2-CA 3.48Å; D382-A385 WeakPolarHBondContact OD2-CB 3.21Å; G383-A385 PolarHBondContact O-N 2.85Å; A385-G387 VanDerWaalsContact C-N 3.27Å; A385-G387 PolarHBondContact O-N 2.92Å; A385-K388 HydrophobicContact CB-CB 4.16Å; A385-K388 WeakPolarHBondContact O-CB 3.4Å; A385-K388 PolarHBondContact O-N 2.96Å; A385-K388 VanDerWaalsContact O-N 3.09Å; A385-V389 PolarHBondContact O-N 3.35Å; A385-S414 WeakPolarHBondContact CB-OG 3.39Å; A385-S414 PolarHBondContact N-OG 3.4Å
386	T	90.2	Very high	91.1	Very high	89 Å²	89	64.5 Å²	64.5	55%	0.546	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-38.7	179.8	-53.9	0	0	0	0	111.8	L384 K388 V389 I390	L384-T386 VanDerWaalsContact C-N 3.27Å; L384-T386 PolarHBondContact O-N 3.37Å; T386-K388 VanDerWaalsContact C-N 3.31Å; T386-K388 PolarHBondContact O-N 3.34Å; T386-V389 PolarHBondContact O-N 2.8Å; T386-I390 HydrophobicContact CG2-CG1 4.42Å; T386-I390 WeakPolarHBondContact O-CG1 3.5Å; T386-I390 PolarHBondContact O-N 3.49Å
387	G	90.7	Very high	91	Very high	34 Å²	34	64.3 Å²	64.3	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-58.8	-42.7	175.9	0	0	0	0	0	112	A385 I390 L391	A385-G387 VanDerWaalsContact C-N 3.27Å; A385-G387 PolarHBondContact O-N 2.92Å; G387-I390 PolarHBondContact O-N 2.87Å; G387-L391 VanDerWaalsContact O-CG 3.24Å; G387-L391 WeakPolarHBondContact O-CG 3.27Å; G387-L391 PolarHBondContact O-N 3.38Å
388	K	92.3	Very high	90.8	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.017	37%	0.365	C	S	.	.	H	α-helix	trans	-59.5	-48.1	176.2	-178.7	61.4	174.5	73.2	0	111.8	A385 T386 I390 L391 D392 I398 Y401 V422	A385-K388 HydrophobicContact CB-CB 4.16Å; A385-K388 WeakPolarHBondContact O-CB 3.4Å; A385-K388 PolarHBondContact O-N 2.96Å; A385-K388 VanDerWaalsContact O-N 3.09Å; T386-K388 VanDerWaalsContact C-N 3.31Å; T386-K388 PolarHBondContact O-N 3.34Å; K388-I390 VanDerWaalsContact C-N 3.34Å; K388-I390 PolarHBondContact O-N 3.24Å; K388-L391 PolarHBondContact O-N 2.78Å; K388-D392 IonicContact NZ-OD1 3.2Å; K388-D392 PolarHBondContact NZ-OD1 3.19Å; K388-D392 IonicContact NZ-OD2 3.93Å; K388-D392 PolarHBondContact NZ-OD2 2.59Å; K388-D392 PolarHBondContact O-N 3.09Å; K388-I398 HydrophobicContact CD-CD1 3.57Å; K388-Y401 HydrophobicContact CB-CD2 4.22Å; K388-Y401 HydrophobicContact CB-CE1 4.1Å; K388-Y401 HydrophobicContact CB-CE2 3.74Å; K388-Y401 HydrophobicContact CD-CD1 4.46Å; K388-Y401 HydrophobicContact CD-CD2 3.57Å; K388-Y401 HydrophobicContact CD-CE2 3.95Å; K388-Y401 HydrophobicContact CD-CG 3.85Å; K388-Y401 HydrophobicContact CG-CD2 4.44Å; K388-Y401 HydrophobicContact CG-CE2 4.44Å; K388-Y401 PolarHBondContact N-OH 3.05Å; K388-V422 HydrophobicContact CG-CG2 4.25Å
389	V	90.9	Very high	90.7	Very high	56 Å²	56	66.8 Å²	66.8	34%	0.339	37%	0.373	S	S	.	.	H	α-helix	trans	-59	-45.5	179.4	175.5	0	0	0	0	111.2	A385 T386 D392 L393	A385-V389 PolarHBondContact O-N 3.35Å; T386-V389 PolarHBondContact O-N 2.8Å; V389-D392 PolarHBondContact O-N 3.04Å; V389-L393 HydrophobicContact CG1-CD1 3.96Å; V389-L393 HydrophobicContact CG1-CG 4.39Å; V389-L393 WeakPolarHBondContact O-CB 3.3Å; V389-L393 VanDerWaalsContact O-CG 3.32Å; V389-L393 WeakPolarHBondContact O-CG 3.31Å; V389-L393 PolarHBondContact O-N 2.88Å
390	I	92.4	Very high	90.4	Very high	86 Å²	86	69.5 Å²	69.5	44%	0.441	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-41.7	179.5	-64.2	-60.6	0	0	0	111.5	T386 G387 K388 D392 L393 L394	T386-I390 HydrophobicContact CG2-CG1 4.42Å; T386-I390 WeakPolarHBondContact O-CG1 3.5Å; T386-I390 PolarHBondContact O-N 3.49Å; G387-I390 PolarHBondContact O-N 2.87Å; K388-I390 VanDerWaalsContact C-N 3.34Å; K388-I390 PolarHBondContact O-N 3.24Å; I390-D392 VanDerWaalsContact C-N 3.32Å; I390-D392 PolarHBondContact O-N 2.92Å; I390-L393 HydrophobicContact CD1-CD1 4.33Å; I390-L393 PolarHBondContact O-N 2.88Å; I390-L394 HydrophobicContact CG2-CD1 3.89Å; I390-L394 HydrophobicContact CG2-CG 4.29Å; I390-L394 WeakPolarHBondContact O-CB 3.23Å; I390-L394 VanDerWaalsContact O-CG 3.26Å; I390-L394 WeakPolarHBondContact O-CG 3.28Å; I390-L394 PolarHBondContact O-N 3.41Å
391	L	92.3	Very high	90.4	Very high	31 Å²	31	65.6 Å²	65.6	16%	0.162	36%	0.36	C	S	.	.	H	α-helix	trans	-62	-40.2	177	-67.8	170.4	0	0	0	112.2	I375 V377 G387 K388 L394 G395 L396 I398 Y401	I375-L391 HydrophobicContact CD1-CD2 4.1Å; V377-L391 HydrophobicContact CB-CD1 4.43Å; V377-L391 HydrophobicContact CG1-CD1 4.09Å; V377-L391 HydrophobicContact CG2-CD1 3.69Å; G387-L391 VanDerWaalsContact O-CG 3.24Å; G387-L391 WeakPolarHBondContact O-CG 3.27Å; G387-L391 PolarHBondContact O-N 3.38Å; K388-L391 PolarHBondContact O-N 2.78Å; L391-L394 PolarHBondContact O-N 2.82Å; L391-G395 PolarHBondContact O-N 2.96Å; L391-L396 HydrophobicContact CD2-CD1 3.47Å; L391-L396 VanDerWaalsContact CD2-CD1 3.47Å; L391-L396 PolarHBondContact O-N 3.1Å; L391-I398 HydrophobicContact CB-CD1 3.65Å; L391-I398 HydrophobicContact CB-CG1 4.33Å; L391-I398 HydrophobicContact CD1-CD1 3.9Å; L391-I398 HydrophobicContact CD1-CG1 4.41Å; L391-I398 HydrophobicContact CG-CD1 4.46Å; L391-Y401 HydrophobicContact CD1-CD2 4.38Å; L391-Y401 HydrophobicContact CD1-CE2 4.02Å
392	D	89.6	Confident	90.4	Very high	75 Å²	75	59.2 Å²	59.2	40%	0.401	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-44	174.9	-68.3	-21.7	0	0	0	111.6	K388 V389 I390 L394 G395	K388-D392 IonicContact NZ-OD1 3.2Å; K388-D392 PolarHBondContact NZ-OD1 3.19Å; K388-D392 IonicContact NZ-OD2 3.93Å; K388-D392 PolarHBondContact NZ-OD2 2.59Å; K388-D392 PolarHBondContact O-N 3.09Å; V389-D392 PolarHBondContact O-N 3.04Å; I390-D392 VanDerWaalsContact C-N 3.32Å; I390-D392 PolarHBondContact O-N 2.92Å; D392-L394 VanDerWaalsContact C-N 3.27Å; D392-L394 PolarHBondContact O-N 3.06Å; D392-G395 PolarHBondContact O-N 3.42Å
393	L	89.2	Confident	90.5	Very high	136 Å²	136	58.7 Å²	58.7	71%	0.712	33%	0.329	S	S	*	.	H	α-helix	trans	-62.8	-33.2	176.6	-73.8	173.2	0	0	0	112.7	V389 I390 G395	V389-L393 HydrophobicContact CG1-CD1 3.96Å; V389-L393 HydrophobicContact CG1-CG 4.39Å; V389-L393 WeakPolarHBondContact O-CB 3.3Å; V389-L393 VanDerWaalsContact O-CG 3.32Å; V389-L393 WeakPolarHBondContact O-CG 3.31Å; V389-L393 PolarHBondContact O-N 2.88Å; I390-L393 HydrophobicContact CD1-CD1 4.33Å; I390-L393 PolarHBondContact O-N 2.88Å; L393-G395 PolarHBondContact O-N 2.98Å
394	L	89.2	Confident	90.6	Very high	123 Å²	123	57.9 Å²	57.9	64%	0.644	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.2	174.2	-68.5	173.8	0	0	0	113	I390 L391 D392 L396	I390-L394 HydrophobicContact CG2-CD1 3.89Å; I390-L394 HydrophobicContact CG2-CG 4.29Å; I390-L394 WeakPolarHBondContact O-CB 3.23Å; I390-L394 VanDerWaalsContact O-CG 3.26Å; I390-L394 WeakPolarHBondContact O-CG 3.28Å; I390-L394 PolarHBondContact O-N 3.41Å; L391-L394 PolarHBondContact O-N 2.82Å; D392-L394 VanDerWaalsContact C-N 3.27Å; D392-L394 PolarHBondContact O-N 3.06Å; L394-L396 VanDerWaalsContact C-N 3.25Å; L394-L396 HydrophobicContact CB-CD1 4.26Å; L394-L396 HydrophobicContact CB-CG 4.16Å; L394-L396 HydrophobicContact CD1-CD1 4.31Å; L394-L396 PolarHBondContact O-N 3.36Å
395	G	86.1	Confident	90.7	Very high	61 Å²	61	54.5 Å²	54.5	63%	0.629	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	22.2	-178.1	0	0	0	0	0	113.8	L391 D392 L393 Q397	L391-G395 PolarHBondContact O-N 2.96Å; D392-G395 PolarHBondContact O-N 3.42Å; L393-G395 PolarHBondContact O-N 2.98Å; G395-Q397 PolarHBondContact O-N 2.94Å
396	L	87.8	Confident	90.8	Very high	56 Å²	56	59.7 Å²	59.7	29%	0.293	33%	0.327	S	S	.	.			trans	-75.1	125	176.4	-67.9	171	0	0	0	109.1	I375 L391 L394 I398	I375-L396 HydrophobicContact CD1-CB 4.44Å; L391-L396 HydrophobicContact CD2-CD1 3.47Å; L391-L396 VanDerWaalsContact CD2-CD1 3.47Å; L391-L396 PolarHBondContact O-N 3.1Å; L394-L396 VanDerWaalsContact C-N 3.25Å; L394-L396 HydrophobicContact CB-CD1 4.26Å; L394-L396 HydrophobicContact CB-CG 4.16Å; L394-L396 HydrophobicContact CD1-CD1 4.31Å; L394-L396 PolarHBondContact O-N 3.36Å; L396-I398 PolarHBondContact O-N 3.12Å
397	Q	88.7	Confident	90.9	Very high	131 Å²	131	59 Å²	59	61%	0.612	32%	0.32	S	S	*	.			trans	-70	120.5	176.3	-65.7	-172.6	5.1	0	0	109.3	P374 I375 G395	P374-Q397 CarbonylContact C-O 3.45Å; P374-Q397 VanDerWaalsContact CA-O 3.26Å; P374-Q397 WeakPolarHBondContact CA-O 3.48Å; P374-Q397 HydrophobicContact CB-CB 4.22Å; P374-Q397 HydrophobicContact CG-CB 4.22Å; I375-Q397 WeakPolarHBondContact CG1-O 3.35Å; I375-Q397 PolarHBondContact N-O 2.59Å; G395-Q397 PolarHBondContact O-N 2.94Å
398	I	90.5	Very high	90.9	Very high	33 Å²	33	61.6 Å²	61.6	17%	0.169	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	116.9	179.1	-57.8	167.3	0	0	0	107.9	I375 V377 K388 L391 L396	I375-I398 HydrophobicContact CG1-CG1 4.29Å; I375-I398 CarbonylContact O-C 3.49Å; I375-I398 WeakPolarHBondContact O-CA 3.35Å; V377-I398 HydrophobicContact CG2-CG2 4.35Å; K388-I398 HydrophobicContact CD-CD1 3.57Å; L391-I398 HydrophobicContact CB-CD1 3.65Å; L391-I398 HydrophobicContact CB-CG1 4.33Å; L391-I398 HydrophobicContact CD1-CD1 3.9Å; L391-I398 HydrophobicContact CD1-CG1 4.41Å; L391-I398 HydrophobicContact CG-CD1 4.46Å; L396-I398 PolarHBondContact O-N 3.12Å
399	E	90.1	Very high	90.9	Very high	114 Å²	114	67 Å²	67	53%	0.533	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-46.4	171.4	-169.6	-169.5	161.5	0	0	110.3	P374 I375 R376	P374-E399 HydrophobicContact CB-CB 3.78Å; I375-E399 PolarHBondContact O-N 3.28Å; R376-E399 WeakPolarHBondContact CD-OE2 3.33Å; R376-E399 HydrophobicContact CG-CB 3.99Å; R376-E399 HydrophobicContact CG-CG 4.4Å; R376-E399 VanDerWaalsContact CG-OE2 3.22Å; R376-E399 WeakPolarHBondContact CG-OE2 3.34Å
400	R	89.3	Confident	90.9	Very high	81 Å²	81	64.6 Å²	64.6	31%	0.306	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	137.9	-174.2	-143.3	153.5	-175	168.9	0.9	111.2	R376 V377 Y402 E423 R438	R376-R400 CarbonylContact C-O 3.51Å; R376-R400 WeakPolarHBondContact CA-O 3.32Å; R376-R400 HydrophobicContact CG-CB 4.22Å; V377-R400 PolarHBondContact N-O 3.48Å; R400-Y402 HydrophobicContact CB-CE2 4.25Å; R400-Y402 WeakPolarHBondContact CD-OH 3.36Å; R400-Y402 HydrophobicContact CG-CE1 4.38Å; R400-Y402 HydrophobicContact CG-CE2 4.12Å; R400-E423 IonicContact CZ-OE1 3.21Å; R400-E423 IonicContact NE-OE1 2.7Å; R400-E423 PolarHBondContact NE-OE1 2.8Å; R400-E423 IonicContact NE-OE2 3.89Å; R400-E423 IonicContact NH2-OE1 2.82Å; R400-E423 PolarHBondContact NH2-OE1 3.43Å; R400-E423 IonicContact NH2-OE2 3.69Å; R400-R438 PolarHBondContact NH1-O 3.23Å
401	Y	93	Very high	90.8	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	114.6	177.9	-165.9	-85.9	0	0	0	109.8	V377 S379 D382 K388 L391 C403 N421 V422 E423	V377-Y401 HydrophobicContact CB-CD2 3.56Å; V377-Y401 HydrophobicContact CB-CE2 3.94Å; V377-Y401 HydrophobicContact CB-CG 4.35Å; V377-Y401 HydrophobicContact CG1-CD2 3.65Å; V377-Y401 HydrophobicContact CG1-CE2 3.46Å; V377-Y401 VanDerWaalsContact CG1-CE2 3.46Å; V377-Y401 HydrophobicContact CG2-CD2 4.17Å; S379-Y401 VanDerWaalsContact CB-OH 3.32Å; S379-Y401 WeakPolarHBondContact CB-OH 3.49Å; S379-Y401 PolarHBondContact OG-OH 2.9Å; D382-Y401 PolarHBondContact OD1-OH 2.99Å; K388-Y401 HydrophobicContact CB-CD2 4.22Å; K388-Y401 HydrophobicContact CB-CE1 4.1Å; K388-Y401 HydrophobicContact CB-CE2 3.74Å; K388-Y401 HydrophobicContact CD-CD1 4.46Å; K388-Y401 HydrophobicContact CD-CD2 3.57Å; K388-Y401 HydrophobicContact CD-CE2 3.95Å; K388-Y401 HydrophobicContact CD-CG 3.85Å; K388-Y401 HydrophobicContact CG-CD2 4.44Å; K388-Y401 HydrophobicContact CG-CE2 4.44Å; K388-Y401 PolarHBondContact N-OH 3.05Å; L391-Y401 HydrophobicContact CD1-CD2 4.38Å; L391-Y401 HydrophobicContact CD1-CE2 4.02Å; Y401-C403 HydrophobicContact CD1-CB 4.49Å; Y401-C403 HydrophobicContact CE1-CB 4.14Å; Y401-N421 VanDerWaalsContact CB-O 3.23Å; Y401-N421 WeakPolarHBondContact CB-O 3.15Å; Y401-V422 HydrophobicContact CD1-CB 4.39Å; Y401-V422 HydrophobicContact CD1-CG1 4.07Å; Y401-V422 HydrophobicContact CD1-CG2 3.9Å; Y401-V422 HydrophobicContact CE1-CG1 4.46Å; Y401-V422 HydrophobicContact CE1-CG2 4.45Å; Y401-E423 PolarHBondContact O-N 2.81Å
402	Y	93.1	Very high	90.7	Very high	4 Å²	4	66 Å²	66	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.2	173.8	-58.7	-75.7	0	0	0	109.4	V377 L378 S379 R400 E423 L425 V436	V377-Y402 PolarHBondContact O-N 3.09Å; L378-Y402 WeakPolarHBondContact CA-O 3.23Å; S379-Y402 PolarHBondContact N-O 3.1Å; R400-Y402 HydrophobicContact CB-CE2 4.25Å; R400-Y402 WeakPolarHBondContact CD-OH 3.36Å; R400-Y402 HydrophobicContact CG-CE1 4.38Å; R400-Y402 HydrophobicContact CG-CE2 4.12Å; Y402-E423 CarbonylContact C-O 3.55Å; Y402-E423 WeakPolarHBondContact CA-O 3.28Å; Y402-E423 HydrophobicContact CD1-CB 3.82Å; Y402-E423 HydrophobicContact CE1-CB 4.27Å; Y402-E423 WeakPolarHBondContact CE1-OE2 3.41Å; Y402-L425 HydrophobicContact CD1-CD1 4.05Å; Y402-L425 HydrophobicContact CD1-CD2 3.89Å; Y402-L425 HydrophobicContact CD1-CG 4.08Å; Y402-L425 HydrophobicContact CG-CD1 4.08Å; Y402-L425 HydrophobicContact CG-CG 4.46Å; Y402-V436 HydrophobicContact CD2-CG1 4.36Å; Y402-V436 HydrophobicContact CE2-CG1 4.34Å; Y402-V436 PolarHBondContact OH-O 3.35Å
403	C	92.6	Very high	90.6	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.9	176.9	63.2	0	0	0	0	111.1	S379 D382 Y401 V422 E423 F424 L425	S379-C403 WeakPolarHBondContact O-CA 3.47Å; D382-C403 HydrophobicContact CB-CB 3.66Å; D382-C403 VanDerWaalsContact OD2-CB 3.31Å; D382-C403 WeakPolarHBondContact OD2-CB 3.33Å; Y401-C403 HydrophobicContact CD1-CB 4.49Å; Y401-C403 HydrophobicContact CE1-CB 4.14Å; C403-V422 HydrophobicContact CB-CG1 4.09Å; C403-V422 WeakPolarHBondContact SG-CG1 3.3Å; C403-E423 PolarHBondContact N-O 2.81Å; C403-E423 PolarHBondContact SG-O 3.28Å; C403-E423 VanDerWaalsContact SG-O 3.38Å; C403-F424 WeakPolarHBondContact SG-CD1 3.26Å; C403-F424 VanDerWaalsContact SG-CE1 3.53Å; C403-F424 VanDerWaalsContact SG-CG 3.54Å; C403-L425 PolarHBondContact O-N 3.44Å
404	C	93.5	Very high	90.6	Very high	4 Å²	4	58.8 Å²	58.8	3%	0.027	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	104.7	165.8	-72.8	0	0	0	0	108	S379 L380 F381 D382 G426 V428	S379-C404 PolarHBondContact O-N 3.43Å; L380-C404 HydrophobicContact CD2-CB 4.21Å; F381-C404 VanDerWaalsContact CA-O 3.28Å; F381-C404 WeakPolarHBondContact CA-O 3.22Å; F381-C404 PolarHBondContact N-O 2.77Å; D382-C404 PolarHBondContact N-O 3.47Å; C404-G426 VanDerWaalsContact CA-O 3.31Å; C404-G426 WeakPolarHBondContact CA-O 3.16Å; C404-G426 WeakPolarHBondContact CB-O 3.37Å; C404-V428 HydrophobicContact CB-CB 4.21Å
405	E	92.8	Very high	90.6	Very high	24 Å²	24	59 Å²	59	11%	0.112	31%	0.31	C	S	.	.			trans	-141.4	141.2	172.8	-175.2	49.5	-102.1	0	0	108.4	D382 G383 D407 A410 M411	D382-E405 HydrophobicContact CB-CB 4.46Å; G383-E405 VanDerWaalsContact CA-OE2 3.3Å; G383-E405 WeakPolarHBondContact CA-OE2 3.39Å; G383-E405 PolarHBondContact N-OE2 2.9Å; E405-D407 HydrophobicContact CG-CB 4.48Å; E405-D407 WeakPolarHBondContact OE1-CB 3.4Å; E405-D407 PolarHBondContact OE1-N 3.37Å; E405-A410 HydrophobicContact CG-CB 4.02Å; E405-M411 HydrophobicContact CB-CG 4.11Å; E405-M411 HydrophobicContact CG-CG 4Å; E405-M411 VanDerWaalsContact O-SD 3.4Å
406	I	92.7	Very high	90.6	Very high	109 Å²	109	60.9 Å²	60.9	56%	0.559	31%	0.309	S	S	*	.			trans	-119.6	-12.8	-178	60.6	171.3	0	0	0	112.5	P408 D427	I406-P408 VanDerWaalsContact O-CD 3.32Å; I406-P408 WeakPolarHBondContact O-CD 3Å; I406-D427 HydrophobicContact CG2-CB 3.91Å
407	D	93	Very high	90.6	Very high	74 Å²	74	62.8 Å²	62.8	40%	0.396	32%	0.32	S	S	.	.			trans	-72.3	115.8	173.2	179.8	47.8	0	0	0	111	E405 D409 A410 M411	E405-D407 HydrophobicContact CG-CB 4.48Å; E405-D407 WeakPolarHBondContact OE1-CB 3.4Å; E405-D407 PolarHBondContact OE1-N 3.37Å; D407-D409 VanDerWaalsContact C-N 3.3Å; D407-D409 PolarHBondContact O-N 2.89Å; D407-A410 HydrophobicContact CB-CB 4Å; D407-A410 PolarHBondContact O-N 3.45Å; D407-A410 VanDerWaalsContact OD2-CB 3.28Å; D407-A410 WeakPolarHBondContact OD2-CB 3.22Å; D407-A410 PolarHBondContact OD2-N 3.06Å; D407-M411 VanDerWaalsContact O-CG 3.29Å; D407-M411 WeakPolarHBondContact O-CG 3.25Å; D407-M411 PolarHBondContact O-N 2.64Å
408	P	90.3	Very high	90.4	Very high	90 Å²	90	58 Å²	58	58%	0.584	30%	0.297	S	S	*	.	H	α-helix	trans	-61.3	-35.9	-175	-23.7	34.5	0	0	0	113.8	I406 L412	I406-P408 VanDerWaalsContact O-CD 3.32Å; I406-P408 WeakPolarHBondContact O-CD 3Å; P408-L412 WeakPolarHBondContact O-CB 2.89Å; P408-L412 PolarHBondContact O-N 3.24Å
409	D	92.2	Very high	89.4	Confident	117 Å²	117	61.1 Å²	61.1	63%	0.626	32%	0.32	S	S	*	.	H	α-helix	trans	-69.2	-45.9	-179.2	-69.7	-26.7	0	0	0	110.4	D407 M411 L412 V413	D407-D409 VanDerWaalsContact C-N 3.3Å; D407-D409 PolarHBondContact O-N 2.89Å; D409-M411 PolarHBondContact O-N 2.96Å; D409-L412 WeakPolarHBondContact O-CB 3.48Å; D409-L412 PolarHBondContact O-N 3.14Å; D409-V413 WeakPolarHBondContact O-CG2 3.48Å; D409-V413 PolarHBondContact O-N 3.16Å; D409-V413 VanDerWaalsContact O-N 3.11Å
410	A	90.8	Very high	88.4	Confident	6 Å²	6	63.7 Å²	63.7	5%	0.05	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-43.9	174.5	0	0	0	0	0	112.5	L384 E405 D407 L412 V413 S414	L384-A410 HydrophobicContact CD2-CB 3.99Å; E405-A410 HydrophobicContact CG-CB 4.02Å; D407-A410 HydrophobicContact CB-CB 4Å; D407-A410 PolarHBondContact O-N 3.45Å; D407-A410 VanDerWaalsContact OD2-CB 3.28Å; D407-A410 WeakPolarHBondContact OD2-CB 3.22Å; D407-A410 PolarHBondContact OD2-N 3.06Å; A410-L412 VanDerWaalsContact C-N 3.32Å; A410-L412 PolarHBondContact O-N 3.17Å; A410-V413 PolarHBondContact O-N 2.86Å; A410-S414 WeakPolarHBondContact O-CB 3.48Å; A410-S414 PolarHBondContact O-N 3.07Å; A410-S414 PolarHBondContact O-OG 2.6Å; A410-S414 VanDerWaalsContact O-OG 3.12Å
411	M	89.9	Confident	87.8	Confident	39 Å²	39	64.5 Å²	64.5	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-60	-40.3	175.4	-70.7	177.5	68.5	0	0	112.5	E405 D407 D409 S414 R415 F424	E405-M411 HydrophobicContact CB-CG 4.11Å; E405-M411 HydrophobicContact CG-CG 4Å; E405-M411 VanDerWaalsContact O-SD 3.4Å; D407-M411 VanDerWaalsContact O-CG 3.29Å; D407-M411 WeakPolarHBondContact O-CG 3.25Å; D407-M411 PolarHBondContact O-N 2.64Å; D409-M411 PolarHBondContact O-N 2.96Å; M411-S414 PolarHBondContact O-N 2.82Å; M411-R415 WeakPolarHBondContact O-CB 3.16Å; M411-R415 VanDerWaalsContact O-CG 3.28Å; M411-R415 WeakPolarHBondContact O-CG 3.31Å; M411-R415 PolarHBondContact O-N 2.82Å; M411-F424 HydrophobicContact CB-CD1 4.42Å; M411-F424 HydrophobicContact CB-CE1 3.91Å; M411-F424 HydrophobicContact CE-CB 4.36Å; M411-F424 HydrophobicContact CE-CD1 3.67Å; M411-F424 HydrophobicContact CE-CE1 4.27Å; M411-F424 HydrophobicContact CE-CG 4.14Å; M411-F424 HydrophobicContact CG-CD1 3.96Å; M411-F424 HydrophobicContact CG-CE1 3.8Å
412	L	89.7	Confident	87.4	Confident	108 Å²	108	65.2 Å²	65.2	57%	0.565	35%	0.349	S	S	*	.	H	α-helix	trans	-62.4	-48.7	178.3	178.6	64.5	0	0	0	111.1	P408 D409 A410 S414 R415 V416	P408-L412 WeakPolarHBondContact O-CB 2.89Å; P408-L412 PolarHBondContact O-N 3.24Å; D409-L412 WeakPolarHBondContact O-CB 3.48Å; D409-L412 PolarHBondContact O-N 3.14Å; A410-L412 VanDerWaalsContact C-N 3.32Å; A410-L412 PolarHBondContact O-N 3.17Å; L412-S414 VanDerWaalsContact C-N 3.33Å; L412-S414 PolarHBondContact O-N 3.48Å; L412-R415 PolarHBondContact O-N 2.82Å; L412-V416 HydrophobicContact CD1-CG2 4.36Å; L412-V416 WeakPolarHBondContact O-CG2 3.35Å; L412-V416 PolarHBondContact O-N 3.17Å
413	V	88.6	Confident	87.3	Confident	58 Å²	58	68.6 Å²	68.6	35%	0.352	37%	0.365	S	S	.	.	H	α-helix	trans	-59	-46.6	178.1	174.6	0	0	0	0	110.7	L384 D409 A410 R415 V416 N417	L384-V413 HydrophobicContact CD2-CB 3.9Å; L384-V413 HydrophobicContact CD2-CG1 4Å; L384-V413 HydrophobicContact CD2-CG2 4.19Å; D409-V413 WeakPolarHBondContact O-CG2 3.48Å; D409-V413 PolarHBondContact O-N 3.16Å; D409-V413 VanDerWaalsContact O-N 3.11Å; A410-V413 PolarHBondContact O-N 2.86Å; V413-R415 PolarHBondContact O-N 2.78Å; V413-V416 PolarHBondContact O-N 2.82Å; V413-N417 WeakPolarHBondContact CG1-ND2 3.31Å; V413-N417 WeakPolarHBondContact O-CB 3.39Å; V413-N417 PolarHBondContact O-N 3.38Å; V413-N417 PolarHBondContact O-ND2 2.85Å
414	S	88.4	Confident	87.1	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-40	178.9	-64.2	0	0	0	0	112.3	G383 A385 A410 M411 L412 H418	G383-S414 PolarHBondContact O-OG 3.28Å; A385-S414 WeakPolarHBondContact CB-OG 3.39Å; A385-S414 PolarHBondContact N-OG 3.4Å; A410-S414 WeakPolarHBondContact O-CB 3.48Å; A410-S414 PolarHBondContact O-N 3.07Å; A410-S414 PolarHBondContact O-OG 2.6Å; A410-S414 VanDerWaalsContact O-OG 3.12Å; M411-S414 PolarHBondContact O-N 2.82Å; L412-S414 VanDerWaalsContact C-N 3.33Å; L412-S414 PolarHBondContact O-N 3.48Å; S414-H418 WeakPolarHBondContact O-CA 3.44Å; S414-H418 WeakPolarHBondContact O-CB 3.37Å; S414-H418 PolarHBondContact O-N 2.82Å
415	R	88.6	Confident	87.1	Confident	127 Å²	127	71.6 Å²	71.6	48%	0.479	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-39.5	175.7	-75.5	175.2	-171.2	-88.4	-0.4	113.2	M411 L412 V413 P419 F424	M411-R415 WeakPolarHBondContact O-CB 3.16Å; M411-R415 VanDerWaalsContact O-CG 3.28Å; M411-R415 WeakPolarHBondContact O-CG 3.31Å; M411-R415 PolarHBondContact O-N 2.82Å; L412-R415 PolarHBondContact O-N 2.82Å; V413-R415 PolarHBondContact O-N 2.78Å; R415-P419 WeakPolarHBondContact O-CA 3.44Å; R415-F424 HydrophobicContact CG-CD2 4.29Å; R415-F424 HydrophobicContact CG-CE2 3.38Å; R415-F424 HydrophobicContact CG-CZ 3.6Å
416	V	87.3	Confident	86.9	Confident	101 Å²	101	71.6 Å²	71.6	61%	0.612	38%	0.384	S	S	*	.	H	α-helix	trans	-68.4	-43.3	179.3	170.9	0	0	0	0	110.6	L412 V413	L412-V416 HydrophobicContact CD1-CG2 4.36Å; L412-V416 WeakPolarHBondContact O-CG2 3.35Å; L412-V416 PolarHBondContact O-N 3.17Å; V413-V416 PolarHBondContact O-N 2.82Å
417	N	86.5	Confident	86.9	Confident	97 Å²	97	67.6 Å²	67.6	52%	0.519	36%	0.364	S	S	.	.	H	α-helix	trans	-81	-26.1	-176.3	-68.2	-23.4	0	0	0	113.3	V413	V413-N417 WeakPolarHBondContact CG1-ND2 3.31Å; V413-N417 WeakPolarHBondContact O-CB 3.39Å; V413-N417 PolarHBondContact O-N 3.38Å; V413-N417 PolarHBondContact O-ND2 2.85Å
418	H	85	Confident	86.8	Confident	30 Å²	30	66 Å²	66	14%	0.139	36%	0.357	C	S	.	.			trans	-133.1	58.6	-175.1	-50.9	-69.5	0	0	0	113	S414 M420 V422	S414-H418 WeakPolarHBondContact O-CA 3.44Å; S414-H418 WeakPolarHBondContact O-CB 3.37Å; S414-H418 PolarHBondContact O-N 2.82Å; H418-M420 VanDerWaalsContact C-N 3.28Å; H418-M420 PolarHBondContact O-N 3Å; H418-M420 VanDerWaalsContact O-N 3.12Å; H418-V422 HydrophobicContact CB-CB 4.36Å; H418-V422 HydrophobicContact CB-CG2 3.55Å
419	P	70.5	Confident	86.8	Confident	99 Å²	99	71.6 Å²	71.6	64%	0.643	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.6	-165.5	23.1	-34	0	0	0	115.4	R415	R415-P419 WeakPolarHBondContact O-CA 3.44Å
420	M	69	Low	86.7	Confident	167 Å²	167	71.9 Å²	71.9	82%	0.823	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-7.7	-170.3	-67	-61.7	-62.7	0	0	114.9	H418	H418-M420 VanDerWaalsContact C-N 3.28Å; H418-M420 PolarHBondContact O-N 3Å; H418-M420 VanDerWaalsContact O-N 3.12Å
421	N	75.4	Confident	86.6	Confident	98 Å²	98	74.2 Å²	74.2	52%	0.524	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	5.6	-166.4	-70.3	23.5	0	0	0	114.2	Y401	Y401-N421 VanDerWaalsContact CB-O 3.23Å; Y401-N421 WeakPolarHBondContact CB-O 3.15Å
422	V	85.5	Confident	86.4	Confident	18 Å²	18	74.9 Å²	74.9	11%	0.109	38%	0.384	C	S	.	.			trans	-125.5	116.2	-176.4	176.1	0	0	0	0	110.2	K388 Y401 C403 H418 F424	K388-V422 HydrophobicContact CG-CG2 4.25Å; Y401-V422 HydrophobicContact CD1-CB 4.39Å; Y401-V422 HydrophobicContact CD1-CG1 4.07Å; Y401-V422 HydrophobicContact CD1-CG2 3.9Å; Y401-V422 HydrophobicContact CE1-CG1 4.46Å; Y401-V422 HydrophobicContact CE1-CG2 4.45Å; C403-V422 HydrophobicContact CB-CG1 4.09Å; C403-V422 WeakPolarHBondContact SG-CG1 3.3Å; H418-V422 HydrophobicContact CB-CB 4.36Å; H418-V422 HydrophobicContact CB-CG2 3.55Å; V422-F424 HydrophobicContact CB-CE2 4.49Å; V422-F424 HydrophobicContact CG1-CD2 4.39Å; V422-F424 HydrophobicContact CG1-CE2 3.87Å; V422-F424 HydrophobicContact CG1-CZ 4.02Å
423	E	90.1	Very high	86.1	Confident	74 Å²	74	77.2 Å²	77.2	35%	0.346	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.6	177.8	-68.5	-170.4	-151.9	0	0	110.7	R400 Y401 Y402 C403 L425	R400-E423 IonicContact CZ-OE1 3.21Å; R400-E423 IonicContact NE-OE1 2.7Å; R400-E423 PolarHBondContact NE-OE1 2.8Å; R400-E423 IonicContact NE-OE2 3.89Å; R400-E423 IonicContact NH2-OE1 2.82Å; R400-E423 PolarHBondContact NH2-OE1 3.43Å; R400-E423 IonicContact NH2-OE2 3.69Å; Y401-E423 PolarHBondContact O-N 2.81Å; Y402-E423 CarbonylContact C-O 3.55Å; Y402-E423 WeakPolarHBondContact CA-O 3.28Å; Y402-E423 HydrophobicContact CD1-CB 3.82Å; Y402-E423 HydrophobicContact CE1-CB 4.27Å; Y402-E423 WeakPolarHBondContact CE1-OE2 3.41Å; C403-E423 PolarHBondContact N-O 2.81Å; C403-E423 PolarHBondContact SG-O 3.28Å; C403-E423 VanDerWaalsContact SG-O 3.38Å; E423-L425 PolarHBondContact O-N 3.32Å
424	F	90.4	Very high	85.7	Confident	42 Å²	42	77.4 Å²	77.4	18%	0.184	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	115.2	179.5	-66.8	-96	0	0	0	110.5	C403 M411 R415 V422	C403-F424 WeakPolarHBondContact SG-CD1 3.26Å; C403-F424 VanDerWaalsContact SG-CE1 3.53Å; C403-F424 VanDerWaalsContact SG-CG 3.54Å; M411-F424 HydrophobicContact CB-CD1 4.42Å; M411-F424 HydrophobicContact CB-CE1 3.91Å; M411-F424 HydrophobicContact CE-CB 4.36Å; M411-F424 HydrophobicContact CE-CD1 3.67Å; M411-F424 HydrophobicContact CE-CE1 4.27Å; M411-F424 HydrophobicContact CE-CG 4.14Å; M411-F424 HydrophobicContact CG-CD1 3.96Å; M411-F424 HydrophobicContact CG-CE1 3.8Å; R415-F424 HydrophobicContact CG-CD2 4.29Å; R415-F424 HydrophobicContact CG-CE2 3.38Å; R415-F424 HydrophobicContact CG-CZ 3.6Å; V422-F424 HydrophobicContact CB-CE2 4.49Å; V422-F424 HydrophobicContact CG1-CD2 4.39Å; V422-F424 HydrophobicContact CG1-CE2 3.87Å; V422-F424 HydrophobicContact CG1-CZ 4.02Å
425	L	91.7	Very high	85.1	Confident	26 Å²	26	80.6 Å²	80.6	14%	0.136	42%	0.418	C	S	.	.			trans	-90.4	-10.2	176.6	-62.5	-172.5	0	0	0	113.4	L378 Y402 C403 E423 L431 V436	L378-L425 HydrophobicContact CD1-CD1 3.8Å; Y402-L425 HydrophobicContact CD1-CD1 4.05Å; Y402-L425 HydrophobicContact CD1-CD2 3.89Å; Y402-L425 HydrophobicContact CD1-CG 4.08Å; Y402-L425 HydrophobicContact CG-CD1 4.08Å; Y402-L425 HydrophobicContact CG-CG 4.46Å; C403-L425 PolarHBondContact O-N 3.44Å; E423-L425 PolarHBondContact O-N 3.32Å; L425-L431 HydrophobicContact CB-CD1 4.4Å; L425-L431 HydrophobicContact CD1-CD1 3.54Å; L425-V436 HydrophobicContact CD1-CG2 4.04Å
426	G	90.1	Very high	84.6	Confident	23 Å²	23	76.4 Å²	76.4	24%	0.237	41%	0.406	C	S	.	.			trans	80.4	-144	179.4	0	0	0	0	0	112.9	C404 V428	C404-G426 VanDerWaalsContact CA-O 3.31Å; C404-G426 WeakPolarHBondContact CA-O 3.16Å; C404-G426 WeakPolarHBondContact CB-O 3.37Å; G426-V428 PolarHBondContact O-N 3.3Å
427	D	91.2	Very high	83.8	Confident	26 Å²	26	75.3 Å²	75.3	14%	0.139	40%	0.403	C	S	.	.			trans	-62.3	128.2	-177.3	-167.6	-35.4	0	0	0	111.7	I406 R429 E430	I406-D427 HydrophobicContact CG2-CB 3.91Å; D427-R429 PolarHBondContact O-N 2.99Å; D427-R429 VanDerWaalsContact OD1-CB 3.31Å; D427-R429 WeakPolarHBondContact OD1-CB 3.24Å; D427-R429 WeakPolarHBondContact OD1-CG 3.33Å; D427-R429 PolarHBondContact OD1-N 3.47Å; D427-R429 IonicContact OD1-NE 3.96Å; D427-R429 PolarHBondContact OD1-NE 3.19Å; D427-R429 VanDerWaalsContact OD1-NE 3.17Å; D427-R429 IonicContact OD2-CZ 3.92Å; D427-R429 IonicContact OD2-NE 3.28Å; D427-R429 PolarHBondContact OD2-NE 3.12Å; D427-R429 IonicContact OD2-NH2 3.94Å; D427-R429 PolarHBondContact OD2-NH2 2.81Å; D427-E430 HydrophobicContact CB-CG 4.22Å; D427-E430 PolarHBondContact O-N 3.43Å
428	V	91.9	Very high	82.2	Confident	40 Å²	40	80.3 Å²	80.3	24%	0.242	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-57.6	-29.7	177.8	67.2	0	0	0	0	112.9	L380 F381 C404 G426 E430 L431	L380-V428 HydrophobicContact CD1-CG2 4.34Å; L380-V428 HydrophobicContact CD2-CG2 3.88Å; F381-V428 HydrophobicContact CE1-CG1 3.94Å; F381-V428 HydrophobicContact CZ-CG1 3.83Å; C404-V428 HydrophobicContact CB-CB 4.21Å; G426-V428 PolarHBondContact O-N 3.3Å; V428-E430 PolarHBondContact O-N 2.82Å; V428-L431 WeakPolarHBondContact O-CB 3.33Å; V428-L431 PolarHBondContact O-N 3.29Å; V428-L431 VanDerWaalsContact O-N 3.12Å
429	R	90.2	Very high	80.6	Confident	207 Å²	207	82.5 Å²	82.5	78%	0.781	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-67.2	-21.4	177.7	-62.7	175.5	-68.1	178.1	1.1	112.5	D427	D427-R429 PolarHBondContact O-N 2.99Å; D427-R429 VanDerWaalsContact OD1-CB 3.31Å; D427-R429 WeakPolarHBondContact OD1-CB 3.24Å; D427-R429 WeakPolarHBondContact OD1-CG 3.33Å; D427-R429 PolarHBondContact OD1-N 3.47Å; D427-R429 IonicContact OD1-NE 3.96Å; D427-R429 PolarHBondContact OD1-NE 3.19Å; D427-R429 VanDerWaalsContact OD1-NE 3.17Å; D427-R429 IonicContact OD2-CZ 3.92Å; D427-R429 IonicContact OD2-NE 3.28Å; D427-R429 PolarHBondContact OD2-NE 3.12Å; D427-R429 IonicContact OD2-NH2 3.94Å; D427-R429 PolarHBondContact OD2-NH2 2.81Å
430	E	89.7	Confident	81.1	Confident	124 Å²	124	81.7 Å²	81.7	58%	0.579	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-97.2	5.9	177.3	-56.7	-177.3	-179.5	0	0	112.6	D427 V428 K435	D427-E430 HydrophobicContact CB-CG 4.22Å; D427-E430 PolarHBondContact O-N 3.43Å; V428-E430 PolarHBondContact O-N 2.82Å; E430-K435 VanDerWaalsContact CB-NZ 3.31Å; E430-K435 WeakPolarHBondContact O-CD 3.39Å; E430-K435 VanDerWaalsContact O-CE 3.24Å; E430-K435 WeakPolarHBondContact O-CE 3.22Å; E430-K435 PolarHBondContact O-NZ 3.3Å; E430-K435 IonicContact OE2-NZ 3.09Å
431	L	89.1	Confident	81.8	Confident	54 Å²	54	77.2 Å²	77.2	28%	0.283	42%	0.415	S	S	.	.			trans	-66.5	134.6	179.6	-168.7	71.9	0	0	0	109.9	L378 L380 L425 V428 V436	L378-L431 HydrophobicContact CD1-CD1 4.45Å; L378-L431 HydrophobicContact CD2-CD2 3.82Å; L380-L431 HydrophobicContact CD2-CD2 4.25Å; L425-L431 HydrophobicContact CB-CD1 4.4Å; L425-L431 HydrophobicContact CD1-CD1 3.54Å; V428-L431 WeakPolarHBondContact O-CB 3.33Å; V428-L431 PolarHBondContact O-N 3.29Å; V428-L431 VanDerWaalsContact O-N 3.12Å; L431-V436 HydrophobicContact CD1-CG2 3.66Å; L431-V436 HydrophobicContact CG-CG2 4.21Å
432	S	85.2	Confident	82.1	Confident	53 Å²	53	76.1 Å²	76.1	37%	0.371	41%	0.409	S	S	.	.			trans	-136.6	156.4	174.3	70.1	0	0	0	0	109.8	A434 K435 V436	S432-A434 PolarHBondContact O-N 2.7Å; S432-K435 WeakPolarHBondContact O-CB 3.44Å; S432-K435 PolarHBondContact O-N 3.41Å; S432-K435 PolarHBondContact OG-N 3.17Å; S432-V436 PolarHBondContact O-N 3.4Å
433	L	83	Confident	81.9	Confident	158 Å²	158	79.5 Å²	79.5	83%	0.827	43%	0.427	S	S	*	.	H	α-helix	trans	-53.2	-38.8	175.3	-75	170.9	0	0	0	111.1	K435 V436 S437	L433-K435 VanDerWaalsContact C-N 3.28Å; L433-K435 PolarHBondContact O-N 2.93Å; L433-V436 PolarHBondContact O-N 3Å; L433-V436 VanDerWaalsContact O-N 3.13Å; L433-S437 WeakPolarHBondContact O-CB 3.19Å; L433-S437 PolarHBondContact O-N 2.8Å; L433-S437 PolarHBondContact O-OG 3.13Å
434	A	80.1	Confident	81.4	Confident	61 Å²	61	79.8 Å²	79.8	50%	0.504	43%	0.432	S	S	.	.	H	α-helix	trans	-63	-28.6	177.4	0	0	0	0	0	114.2	S432 R438	S432-A434 PolarHBondContact O-N 2.7Å; A434-R438 WeakPolarHBondContact O-CG 3.49Å
435	K	76.9	Confident	80.8	Confident	67 Å²	67	82.3 Å²	82.3	29%	0.291	45%	0.448	S	S	.	.	H	α-helix	trans	-73.3	-32.3	175.3	-76.5	-176.9	174.3	-179.1	0	111.8	E430 S432 L433	E430-K435 VanDerWaalsContact CB-NZ 3.31Å; E430-K435 WeakPolarHBondContact O-CD 3.39Å; E430-K435 VanDerWaalsContact O-CE 3.24Å; E430-K435 WeakPolarHBondContact O-CE 3.22Å; E430-K435 PolarHBondContact O-NZ 3.3Å; E430-K435 IonicContact OE2-NZ 3.09Å; S432-K435 WeakPolarHBondContact O-CB 3.44Å; S432-K435 PolarHBondContact O-N 3.41Å; S432-K435 PolarHBondContact OG-N 3.17Å; L433-K435 VanDerWaalsContact C-N 3.28Å; L433-K435 PolarHBondContact O-N 2.93Å
436	V	77.5	Confident	80.1	Confident	39 Å²	39	86.4 Å²	86.4	24%	0.236	47%	0.471	C	S	.	.	H	α-helix	trans	-94.2	-27.4	-176.4	-171.7	0	0	0	0	112.1	L378 Y402 L425 L431 S432 L433 R438	L378-V436 HydrophobicContact CD2-CG2 4.24Å; Y402-V436 HydrophobicContact CD2-CG1 4.36Å; Y402-V436 HydrophobicContact CE2-CG1 4.34Å; Y402-V436 PolarHBondContact OH-O 3.35Å; L425-V436 HydrophobicContact CD1-CG2 4.04Å; L431-V436 HydrophobicContact CD1-CG2 3.66Å; L431-V436 HydrophobicContact CG-CG2 4.21Å; S432-V436 PolarHBondContact O-N 3.4Å; L433-V436 PolarHBondContact O-N 3Å; L433-V436 VanDerWaalsContact O-N 3.13Å; V436-R438 VanDerWaalsContact C-N 3.32Å; V436-R438 PolarHBondContact O-N 2.95Å
437	S	71.2	Confident	79.3	Confident	79 Å²	79	91.2 Å²	91.2	55%	0.552	49%	0.489	S	S	*	.			trans	-85.2	5.2	-178.7	73.6	0	0	0	0	114.3	L433 G439	L433-S437 WeakPolarHBondContact O-CB 3.19Å; L433-S437 PolarHBondContact O-N 2.8Å; L433-S437 PolarHBondContact O-OG 3.13Å; S437-G439 PolarHBondContact O-N 3.45Å
438	R	53.5	Low	78.3	Confident	202 Å²	202	96.7 Å²	96.7	76%	0.762	52%	0.518	S	S	*	.			trans	-77.5	73.2	174.3	-86.1	-177.3	179.1	-168.4	1.1	110	R400 A434 V436	R400-R438 PolarHBondContact NH1-O 3.23Å; A434-R438 WeakPolarHBondContact O-CG 3.49Å; V436-R438 VanDerWaalsContact C-N 3.32Å; V436-R438 PolarHBondContact O-N 2.95Å
439	G	51.2	Low	77.1	Confident	76 Å²	76	101.8 Å²	101.8	78%	0.784	54%	0.543	S	S	*	.			trans	157.4	0	178.8	0	0	0	0	0	109.9	R376 S437	R376-G439 PolarHBondContact NH1-OXT 2.86Å; S437-G439 PolarHBondContact O-N 3.45Å

Retrieved 439 of 439 residues in 379.9 ms (Link to these results)

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