A0A087XN12_POEFO Loading...

Kelch repeat and BTB domain containing 11

AlphaFold DB , UniProt , Accession A0A087XN12, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 488 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	K	38.7	Very low	34.5	Very low	261 Å²	261	151.8 Å²	151.8	100%	1.135	85%	0.849	S	S	*	*				0	114	0	-77.4	-178.9	173.8	-179.7	0	107.3
2	P	41.8	Very low	34.4	Very low	126 Å²	126	147.2 Å²	147.2	82%	0.818	84%	0.844	S	S	*	*			trans	-74.5	148.4	-177.4	33.4	-32.5	0	0	0	110.1
3	K	33.3	Very low	34.4	Very low	193 Å²	193	146.2 Å²	146.2	84%	0.839	84%	0.835	S	S	*	*				75.7	112.7	59.6	-94	-163.3	177.8	-171.6	0	115.1
4	D	38.3	Very low	34.4	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	83%	0.83	S	S	*	*			trans	14.4	139.8	154.9	-58.8	-37.2	0	0	0	121.4
5	C	30	Very low	34.7	Very low	126 Å²	126	138.7 Å²	138.7	85%	0.851	82%	0.817	S	S	*	*				-176.4	129.1	116.5	-97.6	0	0	0	0	112.1
6	S	38.4	Very low	34.8	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	82%	0.816	S	S	*	*			trans	-63.1	137.7	147.5	48.1	0	0	0	0	110.3
7	D	30	Very low	35.2	Very low	165 Å²	165	139.3 Å²	139.3	88%	0.882	81%	0.813	S	S	*	*				-173.5	151.5	127.4	-124.1	-26.3	0	0	0	112.5
8	G	36.5	Very low	36.2	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	82%	0.817	S	S	*	*			trans	-69.6	162.2	-174.5	0	0	0	0	0	115.4
9	S	29.1	Very low	37.9	Very low	110 Å²	110	143.1 Å²	143.1	77%	0.769	81%	0.808	S	S	*	*			trans	-154.6	92.7	158.7	24.2	0	0	0	0	110
10	L	32.6	Very low	40.2	Very low	171 Å²	171	144.5 Å²	144.5	90%	0.895	81%	0.807	S	S	*	*			trans	34.1	94.8	133.5	-64.5	154.1	0	0	0	116	A12	L10-A12 VanDerWaalsContact C-N 3.32Å; L10-A12 PolarHBondContact O-N 3.5Å
11	E	31	Very low	42.5	Very low	197 Å²	197	140.8 Å²	140.8	92%	0.921	79%	0.79	S	S	*	*			trans	-64.9	97.3	151.1	-72.8	-174	160.2	0	0	107.8	D13	E11-D13 VanDerWaalsContact C-N 3.28Å; E11-D13 PolarHBondContact O-N 2.92Å
12	A	33.2	Very low	45.1	Very low	96 Å²	96	131.6 Å²	131.6	79%	0.793	75%	0.753	S	S	*	*			trans	-72.2	89.5	166.3	0	0	0	0	0	108.1	L10 G14	L10-A12 VanDerWaalsContact C-N 3.32Å; L10-A12 PolarHBondContact O-N 3.5Å; A12-G14 PolarHBondContact O-N 3.1Å
13	D	34.4	Very low	47.7	Very low	135 Å²	135	125.9 Å²	125.9	72%	0.722	72%	0.715	S	S	*	*			trans	-62.7	88.3	161.6	-174	4.3	0	0	0	108.2	E11 T15	E11-D13 VanDerWaalsContact C-N 3.28Å; E11-D13 PolarHBondContact O-N 2.92Å; D13-T15 PolarHBondContact O-N 2.93Å; D13-T15 PolarHBondContact OD1-N 2.9Å; D13-T15 PolarHBondContact OD1-OG1 2.79Å
14	G	34.1	Very low	50.6	Low	74 Å²	74	118.7 Å²	118.7	76%	0.763	69%	0.687	S	S	*	*			trans	-74.9	40.1	176.6	0	0	0	0	0	112.7	A12 Q16	A12-G14 PolarHBondContact O-N 3.1Å; G14-Q16 PolarHBondContact O-N 3.5Å
15	T	39.4	Very low	53.4	Low	105 Å²	105	111.7 Å²	111.7	64%	0.644	65%	0.65	S	S	*	*			trans	-81	96.2	169.3	-51.1	0	0	0	0	107.6	D13	D13-T15 PolarHBondContact O-N 2.93Å; D13-T15 PolarHBondContact OD1-N 2.9Å; D13-T15 PolarHBondContact OD1-OG1 2.79Å
16	Q	36.2	Very low	56.5	Low	170 Å²	170	108.5 Å²	108.5	79%	0.794	62%	0.623	S	S	*	*			trans	-49	134.7	168.2	-74.9	-158	-4.3	0	0	108.8	G14 K18	G14-Q16 PolarHBondContact O-N 3.5Å; Q16-K18 PolarHBondContact O-N 2.83Å
17	P	41.6	Very low	59.1	Low	118 Å²	118	103.5 Å²	103.5	77%	0.766	59%	0.588	S	S	*	*			trans	-57.6	119.5	176.3	22.9	-30.8	0	0	0	107.5	K19	P17-K19 VanDerWaalsContact C-N 3.29Å; P17-K19 PolarHBondContact O-N 2.93Å
18	K	53.7	Low	61.8	Low	205 Å²	205	99.5 Å²	99.5	89%	0.891	59%	0.585	S	S	*	*			trans	-56.1	101.6	169.8	-86.6	-178.2	177.4	175.4	0	106.1	Q16 E20	Q16-K18 PolarHBondContact O-N 2.83Å; K18-E20 PolarHBondContact O-N 3.13Å
19	K	67.6	Low	64.2	Low	146 Å²	146	100.3 Å²	100.3	64%	0.635	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-47.5	134.4	173.8	-114.9	178	174.9	-179.8	0	107.5	P17 H35	P17-K19 VanDerWaalsContact C-N 3.29Å; P17-K19 PolarHBondContact O-N 2.93Å; K19-H35 PolarHBondContact O-NE2 2.84Å
20	E	84.4	Confident	67.4	Low	171 Å²	171	100 Å²	100	80%	0.799	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-63.5	143.6	170.9	-72.2	-176.3	164.6	0	0	109.1	K18 D22	K18-E20 PolarHBondContact O-N 3.13Å; E20-D22 PolarHBondContact O-N 2.75Å
21	P	88.5	Confident	70.3	Confident	67 Å²	67	95.5 Å²	95.5	44%	0.435	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-60	124.5	178.1	23	-31.6	0	0	0	110.1	N33	P21-N33 HydrophobicContact CB-CB 3.88Å; P21-N33 HydrophobicContact CG-CB 3.89Å
22	D	93.3	Very high	73.4	Confident	68 Å²	68	87 Å²	87	36%	0.364	52%	0.521	S	S	.	.			trans	-101.4	7.8	-173.5	62.3	-14.8	0	0	0	113.3	E20 A34 H35 K36	E20-D22 PolarHBondContact O-N 2.75Å; D22-A34 PolarHBondContact N-O 3.32Å; D22-H35 VanDerWaalsContact OD1-CA 3.29Å; D22-H35 WeakPolarHBondContact OD1-CA 3.39Å; D22-K36 WeakPolarHBondContact O-CE 3.28Å; D22-K36 WeakPolarHBondContact OD1-CG 3.35Å; D22-K36 PolarHBondContact OD1-N 3.33Å
23	L	95.1	Very high	76.4	Confident	6 Å²	6	87.3 Å²	87.3	3%	0.031	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	134.4	178.7	176.6	70.2	0	0	0	112.3	I25 A34 K36 L39 L55	L23-I25 HydrophobicContact CD2-CD1 4.04Å; L23-I25 HydrophobicContact CD2-CG1 3.83Å; L23-I25 HydrophobicContact CG-CG1 4Å; L23-A34 PolarHBondContact N-O 2.68Å; L23-A34 VanDerWaalsContact N-O 3.13Å; L23-A34 PolarHBondContact O-N 2.91Å; L23-K36 HydrophobicContact CB-CG 3.78Å; L23-K36 HydrophobicContact CD2-CG 4.41Å; L23-L39 HydrophobicContact CD2-CD1 3.75Å; L23-L55 HydrophobicContact CD1-CB 4.29Å; L23-L55 HydrophobicContact CD1-CD1 3.83Å; L23-L55 HydrophobicContact CD1-CG 3.82Å; L23-L55 HydrophobicContact CD2-CD1 4.1Å
24	V	95.7	Very high	79.3	Confident	41 Å²	41	80.9 Å²	80.9	25%	0.248	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.4	168.3	-174.3	0	0	0	0	109.6	E26 T31 N53 I54 L55	V24-E26 HydrophobicContact CG1-CG 4.48Å; V24-T31 HydrophobicContact CG1-CG2 4.24Å; V24-N53 PolarHBondContact N-O 3.24Å; V24-I54 HydrophobicContact CB-CG1 4.37Å; V24-I54 CarbonylContact O-C 3.58Å; V24-I54 VanDerWaalsContact O-CA 3.28Å; V24-I54 WeakPolarHBondContact O-CA 3.44Å; V24-L55 PolarHBondContact O-N 2.88Å
25	I	95.8	Very high	82.2	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.2	175.6	-51.8	172.8	0	0	0	108.8	L23 T31 I32 A34 L39 F46 L55 V57 L65 I69	L23-I25 HydrophobicContact CD2-CD1 4.04Å; L23-I25 HydrophobicContact CD2-CG1 3.83Å; L23-I25 HydrophobicContact CG-CG1 4Å; I25-T31 CarbonylContact O-C 3.56Å; I25-T31 VanDerWaalsContact O-CA 3.28Å; I25-T31 WeakPolarHBondContact O-CA 3.45Å; I25-I32 PolarHBondContact N-O 3.46Å; I25-I32 PolarHBondContact O-N 2.8Å; I25-A34 HydrophobicContact CD1-CB 4.35Å; I25-L39 HydrophobicContact CD1-CD1 3.77Å; I25-F46 HydrophobicContact CD1-CE1 3.75Å; I25-F46 HydrophobicContact CD1-CZ 3.88Å; I25-F46 HydrophobicContact CG1-CE1 4.49Å; I25-L55 CarbonylContact C-O 3.46Å; I25-L55 WeakPolarHBondContact CA-O 3.37Å; I25-V57 HydrophobicContact CG2-CB 4.46Å; I25-V57 HydrophobicContact CG2-CG2 3.8Å; I25-L65 HydrophobicContact CB-CD2 4.39Å; I25-L65 HydrophobicContact CG2-CD2 3.62Å; I25-I69 HydrophobicContact CD1-CD1 3.92Å
26	E	95	Very high	84.8	Confident	60 Å²	60	75.8 Å²	75.8	28%	0.28	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126	179.4	-54.8	-173.8	173.1	0	0	110.9	V24 Q30 T31 I54 L55 K56 V57	V24-E26 HydrophobicContact CG1-CG 4.48Å; E26-Q30 WeakPolarHBondContact CA-O 3.35Å; E26-T31 HydrophobicContact CG-CG2 3.96Å; E26-I54 HydrophobicContact CG-CG2 4.02Å; E26-L55 PolarHBondContact N-O 3.08Å; E26-K56 HydrophobicContact CB-CG 4.03Å; E26-K56 WeakPolarHBondContact O-CA 2.76Å; E26-K56 WeakPolarHBondContact OE2-CE 3.39Å; E26-K56 WeakPolarHBondContact OE2-CG 3.41Å; E26-K56 IonicContact OE2-NZ 3.81Å; E26-V57 PolarHBondContact O-N 3.09Å
27	V	94.8	Very high	87.5	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	125.4	175.9	150.2	0	0	0	0	109.7	G29 Q30 V57 M60 L65	V27-G29 PolarHBondContact O-N 2.93Å; V27-G29 VanDerWaalsContact O-N 3.1Å; V27-Q30 PolarHBondContact N-O 3.11Å; V27-Q30 PolarHBondContact O-N 3.19Å; V27-V57 HydrophobicContact CG2-CB 3.6Å; V27-V57 HydrophobicContact CG2-CG1 4.05Å; V27-V57 WeakPolarHBondContact CG2-O 3.49Å; V27-M60 WeakPolarHBondContact CG1-O 3.49Å; V27-M60 HydrophobicContact CG2-CG 4.32Å; V27-L65 HydrophobicContact CB-CD2 3.98Å; V27-L65 HydrophobicContact CG2-CD2 3.66Å
28	G	85.9	Confident	90.1	Very high	81 Å²	81	67.4 Å²	67.4	84%	0.835	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	30.8	172	0	0	0	0	0	114.6	Q30	G28-Q30 VanDerWaalsContact C-N 3.31Å; G28-Q30 PolarHBondContact O-N 3.3Å
29	G	87.3	Confident	92	Very high	85 Å²	85	57.6 Å²	57.6	88%	0.876	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	1.4	-177.3	0	0	0	0	0	115.2	V27	V27-G29 PolarHBondContact O-N 2.93Å; V27-G29 VanDerWaalsContact O-N 3.1Å
30	Q	94.9	Very high	93.3	Very high	102 Å²	102	51.4 Å²	51.4	48%	0.477	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	156.8	174.6	-66.7	179.1	69.1	0	0	110.8	E26 V27 G28 Y62	E26-Q30 WeakPolarHBondContact CA-O 3.35Å; V27-Q30 PolarHBondContact N-O 3.11Å; V27-Q30 PolarHBondContact O-N 3.19Å; G28-Q30 VanDerWaalsContact C-N 3.31Å; G28-Q30 PolarHBondContact O-N 3.3Å; Q30-Y62 HydrophobicContact CB-CD2 3.32Å; Q30-Y62 HydrophobicContact CB-CE2 3.64Å; Q30-Y62 HydrophobicContact CB-CG 3.97Å; Q30-Y62 HydrophobicContact CG-CD2 4.26Å; Q30-Y62 HydrophobicContact CG-CG 4.47Å
31	T	95	Very high	93.8	Very high	77 Å²	77	49.8 Å²	49.8	47%	0.472	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.9	-175.3	62.7	0	0	0	0	112.2	V24 I25 E26	V24-T31 HydrophobicContact CG1-CG2 4.24Å; I25-T31 CarbonylContact O-C 3.56Å; I25-T31 VanDerWaalsContact O-CA 3.28Å; I25-T31 WeakPolarHBondContact O-CA 3.45Å; E26-T31 HydrophobicContact CG-CG2 3.96Å
32	I	95.9	Very high	94.1	Very high	19 Å²	19	50.2 Å²	50.2	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.9	174.3	-57.6	-177.1	0	0	0	108.3	I25 Y62 L65 I69	I25-I32 PolarHBondContact N-O 3.46Å; I25-I32 PolarHBondContact O-N 2.8Å; I32-Y62 HydrophobicContact CD1-CD2 4.15Å; I32-Y62 HydrophobicContact CD1-CE2 3.72Å; I32-Y62 HydrophobicContact CG1-CD2 4.11Å; I32-Y62 HydrophobicContact CG1-CE2 3.34Å; I32-L65 HydrophobicContact CD1-CB 4.34Å; I32-L65 HydrophobicContact CD1-CD2 3.74Å; I32-L65 HydrophobicContact CD1-CG 3.82Å; I32-L65 HydrophobicContact CG1-CD2 4.47Å; I32-I69 HydrophobicContact CG2-CG2 4.43Å
33	N	95.1	Very high	94.3	Very high	103 Å²	103	47 Å²	47	55%	0.551	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	129	173.3	-66.4	-46.2	0	0	0	109.6	P21	P21-N33 HydrophobicContact CB-CB 3.88Å; P21-N33 HydrophobicContact CG-CB 3.89Å
34	A	95	Very high	94.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	171.5	-176	0	0	0	0	0	112	D22 L23 I25 L39	D22-A34 PolarHBondContact N-O 3.32Å; L23-A34 PolarHBondContact N-O 2.68Å; L23-A34 VanDerWaalsContact N-O 3.13Å; L23-A34 PolarHBondContact O-N 2.91Å; I25-A34 HydrophobicContact CD1-CB 4.35Å; A34-L39 HydrophobicContact CB-CD1 3.74Å; A34-L39 HydrophobicContact CB-CG 4.29Å
35	H	95.4	Very high	94.3	Very high	44 Å²	44	50.4 Å²	50.4	20%	0.204	30%	0.303	C	S	.	.			trans	-106.5	119	-178.9	-54.2	77.9	0	0	0	110.2	K19 D22 S37 V38 L39 Y73	K19-H35 PolarHBondContact O-NE2 2.84Å; D22-H35 VanDerWaalsContact OD1-CA 3.29Å; D22-H35 WeakPolarHBondContact OD1-CA 3.39Å; H35-S37 VanDerWaalsContact C-N 3.26Å; H35-S37 PolarHBondContact O-N 3.06Å; H35-V38 HydrophobicContact CB-CB 4.2Å; H35-V38 HydrophobicContact CB-CG2 3.91Å; H35-V38 PolarHBondContact O-N 2.84Å; H35-V38 VanDerWaalsContact O-N 3.13Å; H35-L39 WeakPolarHBondContact O-CG 3.02Å; H35-L39 PolarHBondContact O-N 3.41Å; H35-L39 VanDerWaalsContact O-N 3.08Å; H35-Y73 VanDerWaalsContact CB-OH 3.29Å; H35-Y73 WeakPolarHBondContact CB-OH 3.47Å; H35-Y73 PolarHBondContact N-OH 2.61Å; H35-Y73 AromaticContact ND1-CE1 3.82Å; H35-Y73 AromaticContact ND1-CZ 3.6Å; H35-Y73 PolarHBondContact ND1-OH 3.19Å
36	K	94.8	Very high	94.3	Very high	28 Å²	28	50.6 Å²	50.6	12%	0.122	30%	0.304	C	S	.	.	H	α-helix	trans	-53.3	-43.4	-178.7	-70.1	179.9	-179.2	177.7	0	112.6	D22 L23 V38 L39 A40 L50 R52 N53	D22-K36 WeakPolarHBondContact O-CE 3.28Å; D22-K36 WeakPolarHBondContact OD1-CG 3.35Å; D22-K36 PolarHBondContact OD1-N 3.33Å; L23-K36 HydrophobicContact CB-CG 3.78Å; L23-K36 HydrophobicContact CD2-CG 4.41Å; K36-V38 VanDerWaalsContact C-N 3.34Å; K36-V38 PolarHBondContact O-N 2.94Å; K36-L39 PolarHBondContact O-N 3.22Å; K36-A40 WeakPolarHBondContact O-CB 3.37Å; K36-A40 PolarHBondContact O-N 3.48Å; K36-L50 HydrophobicContact CB-CD2 3.83Å; K36-L50 WeakPolarHBondContact CE-O 3.46Å; K36-L50 PolarHBondContact NZ-O 2.85Å; K36-R52 WeakPolarHBondContact CE-O 3.48Å; K36-R52 PolarHBondContact NZ-O 2.95Å; K36-R52 VanDerWaalsContact NZ-O 3.13Å; K36-N53 PolarHBondContact NZ-OD1 3.36Å
37	S	93.8	Very high	94.3	Very high	71 Å²	71	53.5 Å²	53.5	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-41	-178.6	56.5	0	0	0	0	112.3	H35 E41	H35-S37 VanDerWaalsContact C-N 3.26Å; H35-S37 PolarHBondContact O-N 3.06Å; S37-E41 PolarHBondContact O-N 3.39Å
38	V	94.4	Very high	94.3	Very high	40 Å²	40	57.2 Å²	57.2	24%	0.242	35%	0.346	C	S	.	.	H	α-helix	trans	-71	-45	-179.2	177.4	0	0	0	0	110.4	H35 K36 E41 I72 Y73	H35-V38 HydrophobicContact CB-CB 4.2Å; H35-V38 HydrophobicContact CB-CG2 3.91Å; H35-V38 PolarHBondContact O-N 2.84Å; H35-V38 VanDerWaalsContact O-N 3.13Å; K36-V38 VanDerWaalsContact C-N 3.34Å; K36-V38 PolarHBondContact O-N 2.94Å; V38-E41 PolarHBondContact O-N 2.87Å; V38-I72 HydrophobicContact CG1-CG2 3.77Å; V38-Y73 HydrophobicContact CB-CE1 4.09Å; V38-Y73 HydrophobicContact CG1-CD1 4Å; V38-Y73 HydrophobicContact CG1-CE1 3.66Å; V38-Y73 HydrophobicContact CG1-CE2 4.45Å; V38-Y73 HydrophobicContact CG2-CE1 4.06Å
39	L	95	Very high	94.7	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.1	-42.4	179	-62.8	-174.4	0	0	0	112.7	L23 I25 A34 H35 K36 E41 K42 S43 F46 I69 I72	L23-L39 HydrophobicContact CD2-CD1 3.75Å; I25-L39 HydrophobicContact CD1-CD1 3.77Å; A34-L39 HydrophobicContact CB-CD1 3.74Å; A34-L39 HydrophobicContact CB-CG 4.29Å; H35-L39 WeakPolarHBondContact O-CG 3.02Å; H35-L39 PolarHBondContact O-N 3.41Å; H35-L39 VanDerWaalsContact O-N 3.08Å; K36-L39 PolarHBondContact O-N 3.22Å; L39-E41 PolarHBondContact O-N 2.93Å; L39-K42 PolarHBondContact O-N 3.12Å; L39-S43 VanDerWaalsContact O-CB 3.27Å; L39-S43 WeakPolarHBondContact O-CB 3.5Å; L39-S43 PolarHBondContact O-N 2.96Å; L39-F46 HydrophobicContact CB-CB 3.87Å; L39-F46 HydrophobicContact CB-CD2 3.75Å; L39-F46 HydrophobicContact CB-CG 3.86Å; L39-F46 HydrophobicContact CD1-CD1 4.12Å; L39-F46 HydrophobicContact CD1-CD2 4.07Å; L39-F46 HydrophobicContact CD1-CE1 4.2Å; L39-F46 HydrophobicContact CD1-CE2 4.18Å; L39-F46 HydrophobicContact CD1-CG 4.08Å; L39-F46 HydrophobicContact CD1-CZ 4.24Å; L39-F46 HydrophobicContact CG-CD2 4.35Å; L39-I69 HydrophobicContact CD1-CD1 4.05Å; L39-I69 HydrophobicContact CD2-CD1 3.47Å; L39-I69 VanDerWaalsContact CD2-CD1 3.47Å; L39-I69 HydrophobicContact CD2-CG2 4.47Å; L39-I69 HydrophobicContact CG-CD1 4.43Å; L39-I72 HydrophobicContact CD2-CB 4.36Å; L39-I72 HydrophobicContact CD2-CD1 3.58Å; L39-I72 HydrophobicContact CD2-CG2 4.1Å
40	A	94.8	Very high	95	Very high	16 Å²	16	56.7 Å²	56.7	13%	0.132	30%	0.298	C	S	.	.	H	α-helix	trans	-68.2	-17.7	-178.5	0	0	0	0	0	113.8	K36 K47 L50	K36-A40 WeakPolarHBondContact O-CB 3.37Å; K36-A40 PolarHBondContact O-N 3.48Å; A40-K47 HydrophobicContact CB-CB 4Å; A40-K47 HydrophobicContact CB-CG 4.37Å; A40-L50 HydrophobicContact CB-CD2 3.86Å; A40-L50 HydrophobicContact CB-CG 4.45Å
41	E	95	Very high	94.8	Very high	137 Å²	137	57.3 Å²	57.3	64%	0.64	31%	0.313	S	S	*	.	H	α-helix	trans	-69.8	-37.9	174.9	-165.4	-164	132.7	0	0	111.9	S37 V38 L39	S37-E41 PolarHBondContact O-N 3.39Å; V38-E41 PolarHBondContact O-N 2.87Å; L39-E41 PolarHBondContact O-N 2.93Å
42	K	93.8	Very high	94.7	Very high	75 Å²	75	60.4 Å²	60.4	33%	0.326	32%	0.316	S	S	.	.	H	α-helix	trans	-107.5	-6.8	-174.4	-55.2	-57.6	-169.2	-155.4	0	113.9	L39 I72	L39-K42 PolarHBondContact O-N 3.12Å; K42-I72 HydrophobicContact CB-CG1 4.18Å; K42-I72 HydrophobicContact CB-CG2 4.22Å; K42-I72 HydrophobicContact CG-CG2 3.99Å
43	S	97	Very high	94.5	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.007	34%	0.339	C	S	.	.			trans	-137.6	117.1	-173.7	174.1	0	0	0	0	112.9	L39 Y45 F46 K47 L94 Q95	L39-S43 VanDerWaalsContact O-CB 3.27Å; L39-S43 WeakPolarHBondContact O-CB 3.5Å; L39-S43 PolarHBondContact O-N 2.96Å; S43-Y45 VanDerWaalsContact C-N 3.25Å; S43-Y45 PolarHBondContact O-N 3.34Å; S43-Y45 PolarHBondContact OG-N 3.4Å; S43-F46 VanDerWaalsContact CB-CD2 3.45Å; S43-F46 PolarHBondContact O-N 3.44Å; S43-F46 WeakPolarHBondContact OG-CD2 3.42Å; S43-F46 PolarHBondContact OG-N 2.95Å; S43-K47 WeakPolarHBondContact O-CB 3.28Å; S43-K47 PolarHBondContact O-N 2.99Å; S43-L94 PolarHBondContact OG-O 3Å; S43-Q95 WeakPolarHBondContact CA-O 3.49Å
44	D	96.1	Very high	94.4	Very high	88 Å²	88	64.4 Å²	64.4	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-28.4	172.8	-72.3	-37.9	0	0	0	112	K47 A48 Q95	D44-K47 PolarHBondContact O-N 3.36Å; D44-A48 WeakPolarHBondContact O-CB 3.29Å; D44-A48 PolarHBondContact O-N 3.37Å; D44-Q95 HydrophobicContact CB-CB 4.22Å; D44-Q95 PolarHBondContact N-O 2.97Å
45	Y	96.1	Very high	94.3	Very high	30 Å²	30	64.5 Å²	64.5	12%	0.118	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-46.7	174.7	175	-89.4	0	0	0	111.9	S43 R49 V57 L94	S43-Y45 VanDerWaalsContact C-N 3.25Å; S43-Y45 PolarHBondContact O-N 3.34Å; S43-Y45 PolarHBondContact OG-N 3.4Å; Y45-R49 VanDerWaalsContact CD2-NH1 3.27Å; Y45-R49 WeakPolarHBondContact O-CD 3.43Å; Y45-R49 PolarHBondContact O-NH1 3.04Å; Y45-V57 HydrophobicContact CE1-CG2 4.21Å; Y45-L94 WeakPolarHBondContact CB-O 3.29Å; Y45-L94 HydrophobicContact CD1-CD2 3.75Å; Y45-L94 HydrophobicContact CE1-CD2 3.84Å; Y45-L94 HydrophobicContact CG-CD2 4.26Å
46	F	95.5	Very high	94.2	Very high	5 Å²	5	69.6 Å²	69.6	2%	0.022	36%	0.359	C	S	.	.	H	α-helix	trans	-75.5	-37.1	178.8	-68.2	-60.1	0	0	0	111.5	I25 L39 S43 A48 R49 L50 L55 I69 L94	I25-F46 HydrophobicContact CD1-CE1 3.75Å; I25-F46 HydrophobicContact CD1-CZ 3.88Å; I25-F46 HydrophobicContact CG1-CE1 4.49Å; L39-F46 HydrophobicContact CB-CB 3.87Å; L39-F46 HydrophobicContact CB-CD2 3.75Å; L39-F46 HydrophobicContact CB-CG 3.86Å; L39-F46 HydrophobicContact CD1-CD1 4.12Å; L39-F46 HydrophobicContact CD1-CD2 4.07Å; L39-F46 HydrophobicContact CD1-CE1 4.2Å; L39-F46 HydrophobicContact CD1-CE2 4.18Å; L39-F46 HydrophobicContact CD1-CG 4.08Å; L39-F46 HydrophobicContact CD1-CZ 4.24Å; L39-F46 HydrophobicContact CG-CD2 4.35Å; S43-F46 VanDerWaalsContact CB-CD2 3.45Å; S43-F46 PolarHBondContact O-N 3.44Å; S43-F46 WeakPolarHBondContact OG-CD2 3.42Å; S43-F46 PolarHBondContact OG-N 2.95Å; F46-A48 VanDerWaalsContact C-N 3.28Å; F46-A48 PolarHBondContact O-N 3.02Å; F46-R49 CarbonylContact O-C 3.58Å; F46-R49 WeakPolarHBondContact O-CA 3.43Å; F46-R49 PolarHBondContact O-N 3.29Å; F46-L50 PolarHBondContact O-N 3.37Å; F46-L55 HydrophobicContact CD1-CD1 3.93Å; F46-L55 HydrophobicContact CE1-CD1 4.2Å; F46-I69 HydrophobicContact CE2-CD1 4.21Å; F46-I69 HydrophobicContact CZ-CD1 4.22Å; F46-L94 HydrophobicContact CE2-CD1 4.25Å; F46-L94 HydrophobicContact CE2-CD2 4.27Å; F46-L94 HydrophobicContact CZ-CD1 4.25Å; F46-L94 HydrophobicContact CZ-CD2 3.91Å
47	K	95.2	Very high	94.1	Very high	120 Å²	120	68.6 Å²	68.6	52%	0.522	36%	0.356	S	S	.	.	H	α-helix	trans	-57.2	-40.2	173.8	-170	175.9	-179.5	178.9	0	112.4	A40 S43 D44 R49 L50	A40-K47 HydrophobicContact CB-CB 4Å; A40-K47 HydrophobicContact CB-CG 4.37Å; S43-K47 WeakPolarHBondContact O-CB 3.28Å; S43-K47 PolarHBondContact O-N 2.99Å; D44-K47 PolarHBondContact O-N 3.36Å; K47-R49 PolarHBondContact O-N 3.46Å; K47-L50 WeakPolarHBondContact O-CD1 3.15Å; K47-L50 WeakPolarHBondContact O-CG 3.16Å
48	A	95.1	Very high	93.9	Very high	80 Å²	80	73.9 Å²	73.9	66%	0.661	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-7.7	175.6	0	0	0	0	0	114.3	D44 F46	D44-A48 WeakPolarHBondContact O-CB 3.29Å; D44-A48 PolarHBondContact O-N 3.37Å; F46-A48 VanDerWaalsContact C-N 3.28Å; F46-A48 PolarHBondContact O-N 3.02Å
49	R	94.4	Very high	93.5	Very high	75 Å²	75	75.4 Å²	75.4	28%	0.283	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	18.2	-171.1	-72.1	170.9	179.8	71.7	2.7	114	Y45 F46 K47 S51 R52 L55	Y45-R49 VanDerWaalsContact CD2-NH1 3.27Å; Y45-R49 WeakPolarHBondContact O-CD 3.43Å; Y45-R49 PolarHBondContact O-NH1 3.04Å; F46-R49 CarbonylContact O-C 3.58Å; F46-R49 WeakPolarHBondContact O-CA 3.43Å; F46-R49 PolarHBondContact O-N 3.29Å; K47-R49 PolarHBondContact O-N 3.46Å; R49-S51 PolarHBondContact O-N 2.99Å; R49-S51 VanDerWaalsContact O-N 3.09Å; R49-R52 PolarHBondContact O-N 3.35Å; R49-R52 VanDerWaalsContact O-N 3.08Å; R49-L55 HydrophobicContact CB-CD1 4.05Å; R49-L55 HydrophobicContact CB-CD2 4.09Å; R49-L55 HydrophobicContact CG-CD2 4.36Å
50	L	92.4	Very high	93.5	Very high	80 Å²	80	76.8 Å²	76.8	42%	0.419	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.1	-177.8	-73.7	170.2	0	0	0	114.6	K36 A40 F46 K47 R52	K36-L50 HydrophobicContact CB-CD2 3.83Å; K36-L50 WeakPolarHBondContact CE-O 3.46Å; K36-L50 PolarHBondContact NZ-O 2.85Å; A40-L50 HydrophobicContact CB-CD2 3.86Å; A40-L50 HydrophobicContact CB-CG 4.45Å; F46-L50 PolarHBondContact O-N 3.37Å; K47-L50 WeakPolarHBondContact O-CD1 3.15Å; K47-L50 WeakPolarHBondContact O-CG 3.16Å; L50-R52 PolarHBondContact O-N 3.26Å
51	S	91.8	Very high	93.4	Very high	114 Å²	114	78.5 Å²	78.5	80%	0.797	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.7	179.6	59.3	0	0	0	0	114.4	R49	R49-S51 PolarHBondContact O-N 2.99Å; R49-S51 VanDerWaalsContact O-N 3.09Å
52	R	91.8	Very high	93.4	Very high	142 Å²	142	75.7 Å²	75.7	54%	0.536	40%	0.395	S	S	.	.			trans	-96.7	139	-177.2	-63.5	-177.1	178	-172.6	2.5	111.3	K36 R49 L50 L55	K36-R52 WeakPolarHBondContact CE-O 3.48Å; K36-R52 PolarHBondContact NZ-O 2.95Å; K36-R52 VanDerWaalsContact NZ-O 3.13Å; R49-R52 PolarHBondContact O-N 3.35Å; R49-R52 VanDerWaalsContact O-N 3.08Å; L50-R52 PolarHBondContact O-N 3.26Å; R52-L55 HydrophobicContact CB-CD2 3.84Å; R52-L55 HydrophobicContact CB-CG 4.25Å; R52-L55 VanDerWaalsContact CD-CD2 3.4Å; R52-L55 HydrophobicContact CG-CD2 4.24Å
53	N	91.5	Very high	93.4	Very high	106 Å²	106	79.2 Å²	79.2	57%	0.567	41%	0.41	S	S	*	.	S	Bend	trans	-96.2	-18	174.7	-61.3	-14.3	0	0	0	112.5	V24 K36	V24-N53 PolarHBondContact N-O 3.24Å; K36-N53 PolarHBondContact NZ-OD1 3.36Å
54	I	93.3	Very high	93.3	Very high	100 Å²	100	79.6 Å²	79.6	51%	0.513	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.4	175.3	-54.4	176.9	0	0	0	108.7	V24 E26	V24-I54 HydrophobicContact CB-CG1 4.37Å; V24-I54 CarbonylContact O-C 3.58Å; V24-I54 VanDerWaalsContact O-CA 3.28Å; V24-I54 WeakPolarHBondContact O-CA 3.44Å; E26-I54 HydrophobicContact CG-CG2 4.02Å
55	L	94.3	Very high	93.3	Very high	3 Å²	3	75.4 Å²	75.4	2%	0.016	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	114.5	-179	-77.6	-179.6	0	0	0	111.7	L23 V24 I25 E26 F46 R49 R52 V57	L23-L55 HydrophobicContact CD1-CB 4.29Å; L23-L55 HydrophobicContact CD1-CD1 3.83Å; L23-L55 HydrophobicContact CD1-CG 3.82Å; L23-L55 HydrophobicContact CD2-CD1 4.1Å; V24-L55 PolarHBondContact O-N 2.88Å; I25-L55 CarbonylContact C-O 3.46Å; I25-L55 WeakPolarHBondContact CA-O 3.37Å; E26-L55 PolarHBondContact N-O 3.08Å; F46-L55 HydrophobicContact CD1-CD1 3.93Å; F46-L55 HydrophobicContact CE1-CD1 4.2Å; R49-L55 HydrophobicContact CB-CD1 4.05Å; R49-L55 HydrophobicContact CB-CD2 4.09Å; R49-L55 HydrophobicContact CG-CD2 4.36Å; R52-L55 HydrophobicContact CB-CD2 3.84Å; R52-L55 HydrophobicContact CB-CG 4.25Å; R52-L55 VanDerWaalsContact CD-CD2 3.4Å; R52-L55 HydrophobicContact CG-CD2 4.24Å; L55-V57 PolarHBondContact O-N 3.37Å
56	K	93	Very high	93.3	Very high	150 Å²	150	75.5 Å²	75.5	65%	0.652	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	111.7	170.1	-73.2	174.2	174.7	176.4	0	110	E26	E26-K56 HydrophobicContact CB-CG 4.03Å; E26-K56 WeakPolarHBondContact O-CA 2.76Å; E26-K56 WeakPolarHBondContact OE2-CE 3.39Å; E26-K56 WeakPolarHBondContact OE2-CG 3.41Å; E26-K56 IonicContact OE2-NZ 3.81Å
57	V	92.6	Very high	93.3	Very high	8 Å²	8	76.5 Å²	76.5	5%	0.048	40%	0.402	C	S	.	.			trans	-96.4	136.3	173.1	176.3	0	0	0	0	108.5	I25 E26 V27 Y45 L55 M60 L94	I25-V57 HydrophobicContact CG2-CB 4.46Å; I25-V57 HydrophobicContact CG2-CG2 3.8Å; E26-V57 PolarHBondContact O-N 3.09Å; V27-V57 HydrophobicContact CG2-CB 3.6Å; V27-V57 HydrophobicContact CG2-CG1 4.05Å; V27-V57 WeakPolarHBondContact CG2-O 3.49Å; Y45-V57 HydrophobicContact CE1-CG2 4.21Å; L55-V57 PolarHBondContact O-N 3.37Å; V57-M60 HydrophobicContact CG1-CG 4.23Å; V57-M60 HydrophobicContact CG1-SD 3.7Å; V57-L94 HydrophobicContact CG1-CD2 4.19Å; V57-L94 HydrophobicContact CG2-CD2 4.37Å
58	K	88.7	Confident	93.4	Very high	182 Å²	182	70.8 Å²	70.8	79%	0.791	38%	0.377	S	S	*	.			trans	-120.8	154.7	178.8	-66	-174.3	179.5	-176.8	0	109.4
59	G	86.8	Confident	93.4	Very high	71 Å²	71	67.2 Å²	67.2	73%	0.732	35%	0.347	S	S	*	.	S	Bend	trans	86.1	14.6	174.7	0	0	0	0	0	115.3
60	M	93.5	Very high	93.4	Very high	30 Å²	30	67.6 Å²	67.6	15%	0.148	35%	0.354	C	S	.	.	S	Bend	trans	-145.8	158.3	171.5	80.9	-163	-45.3	0	0	112.2	V27 V57 T64 L65 L68 G90 L94	V27-M60 WeakPolarHBondContact CG1-O 3.49Å; V27-M60 HydrophobicContact CG2-CG 4.32Å; V57-M60 HydrophobicContact CG1-CG 4.23Å; V57-M60 HydrophobicContact CG1-SD 3.7Å; M60-T64 HydrophobicContact CE-CG2 3.77Å; M60-L65 HydrophobicContact CE-CB 4.41Å; M60-L65 HydrophobicContact CG-CB 4.27Å; M60-L65 HydrophobicContact SD-CB 3.95Å; M60-L65 HydrophobicContact SD-CD1 3.88Å; M60-L65 HydrophobicContact SD-CG 4.44Å; M60-L68 HydrophobicContact CE-CD1 3.58Å; M60-G90 VanDerWaalsContact CE-CA 3.4Å; M60-L94 HydrophobicContact CE-CD1 3.96Å; M60-L94 HydrophobicContact CE-CG 4.42Å; M60-L94 HydrophobicContact SD-CD1 4Å; M60-L94 HydrophobicContact SD-CG 4.31Å
61	S	94.1	Very high	93.6	Very high	52 Å²	52	64.8 Å²	64.8	36%	0.364	34%	0.338	S	S	.	.			trans	-78.1	156.1	175	84.1	0	0	0	0	111.6	K63 T64 L65	S61-K63 VanDerWaalsContact C-N 3.26Å; S61-K63 PolarHBondContact O-N 3.37Å; S61-K63 PolarHBondContact OG-N 3.23Å; S61-T64 PolarHBondContact O-N 3.44Å; S61-T64 PolarHBondContact OG-N 2.98Å; S61-T64 VanDerWaalsContact OG-N 3.11Å; S61-T64 PolarHBondContact OG-OG1 3.5Å; S61-L65 PolarHBondContact O-N 3Å
62	Y	94.7	Very high	93.8	Very high	77 Å²	77	59.9 Å²	59.9	30%	0.302	30%	0.303	S	S	.	.	H	α-helix	trans	-57.5	-41.1	173.8	176.5	-92.8	0	0	0	111.7	Q30 I32 T64 L65 S66	Q30-Y62 HydrophobicContact CB-CD2 3.32Å; Q30-Y62 HydrophobicContact CB-CE2 3.64Å; Q30-Y62 HydrophobicContact CB-CG 3.97Å; Q30-Y62 HydrophobicContact CG-CD2 4.26Å; Q30-Y62 HydrophobicContact CG-CG 4.47Å; I32-Y62 HydrophobicContact CD1-CD2 4.15Å; I32-Y62 HydrophobicContact CD1-CE2 3.72Å; I32-Y62 HydrophobicContact CG1-CD2 4.11Å; I32-Y62 HydrophobicContact CG1-CE2 3.34Å; Y62-T64 PolarHBondContact O-N 3.33Å; Y62-L65 PolarHBondContact O-N 2.88Å; Y62-S66 WeakPolarHBondContact O-CB 3.42Å; Y62-S66 PolarHBondContact O-N 2.76Å
63	K	94.3	Very high	94	Very high	150 Å²	150	57.6 Å²	57.6	65%	0.652	30%	0.295	S	S	*	.	H	α-helix	trans	-59.8	-46.9	178.8	-172.5	177.3	-178.7	-179.5	0	111.6	S61 S66 T67	S61-K63 VanDerWaalsContact C-N 3.26Å; S61-K63 PolarHBondContact O-N 3.37Å; S61-K63 PolarHBondContact OG-N 3.23Å; K63-S66 PolarHBondContact O-N 3.49Å; K63-T67 PolarHBondContact O-N 3.1Å; K63-T67 PolarHBondContact O-OG1 3.13Å; K63-T67 VanDerWaalsContact O-OG1 3.04Å
64	T	95.4	Very high	94.2	Very high	8 Å²	8	56.4 Å²	56.4	5%	0.049	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-44.4	177.3	-48.5	0	0	0	0	111.5	M60 S61 Y62 T67 L68 D86	M60-T64 HydrophobicContact CE-CG2 3.77Å; S61-T64 PolarHBondContact O-N 3.44Å; S61-T64 PolarHBondContact OG-N 2.98Å; S61-T64 VanDerWaalsContact OG-N 3.11Å; S61-T64 PolarHBondContact OG-OG1 3.5Å; Y62-T64 PolarHBondContact O-N 3.33Å; T64-T67 PolarHBondContact O-N 3.15Å; T64-L68 HydrophobicContact CG2-CD1 4.28Å; T64-L68 WeakPolarHBondContact O-CG 3.34Å; T64-L68 PolarHBondContact O-N 3.41Å; T64-L68 VanDerWaalsContact O-N 3.13Å; T64-D86 VanDerWaalsContact CG2-C 3.48Å; T64-D86 HydrophobicContact CG2-CB 4.04Å; T64-D86 WeakPolarHBondContact CG2-O 3.41Å
65	L	95.9	Very high	94.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.2	-47.6	177.5	179.9	65.9	0	0	0	110.6	I25 V27 I32 M60 S61 Y62 T67 L68 I69 L94	I25-L65 HydrophobicContact CB-CD2 4.39Å; I25-L65 HydrophobicContact CG2-CD2 3.62Å; V27-L65 HydrophobicContact CB-CD2 3.98Å; V27-L65 HydrophobicContact CG2-CD2 3.66Å; I32-L65 HydrophobicContact CD1-CB 4.34Å; I32-L65 HydrophobicContact CD1-CD2 3.74Å; I32-L65 HydrophobicContact CD1-CG 3.82Å; I32-L65 HydrophobicContact CG1-CD2 4.47Å; M60-L65 HydrophobicContact CE-CB 4.41Å; M60-L65 HydrophobicContact CG-CB 4.27Å; M60-L65 HydrophobicContact SD-CB 3.95Å; M60-L65 HydrophobicContact SD-CD1 3.88Å; M60-L65 HydrophobicContact SD-CG 4.44Å; S61-L65 PolarHBondContact O-N 3Å; Y62-L65 PolarHBondContact O-N 2.88Å; L65-T67 VanDerWaalsContact C-N 3.35Å; L65-T67 PolarHBondContact O-N 2.93Å; L65-L68 PolarHBondContact O-N 3.14Å; L65-L68 VanDerWaalsContact O-N 3.15Å; L65-I69 HydrophobicContact CD1-CD1 4.31Å; L65-I69 HydrophobicContact CD1-CG1 4.03Å; L65-I69 HydrophobicContact CG-CG1 4.19Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.22Å; L65-I69 PolarHBondContact O-N 3.37Å; L65-L94 HydrophobicContact CD1-CD1 3.67Å
66	S	95.3	Very high	94	Very high	32 Å²	32	62.8 Å²	62.8	22%	0.224	33%	0.329	C	S	.	.	H	α-helix	trans	-54.4	-50.9	176.9	-166	0	0	0	0	110.9	Y62 K63 L68 I69 D70	Y62-S66 WeakPolarHBondContact O-CB 3.42Å; Y62-S66 PolarHBondContact O-N 2.76Å; K63-S66 PolarHBondContact O-N 3.49Å; S66-L68 VanDerWaalsContact C-N 3.28Å; S66-L68 PolarHBondContact O-N 3.49Å; S66-I69 PolarHBondContact O-N 3.39Å; S66-I69 VanDerWaalsContact O-N 3.16Å; S66-D70 WeakPolarHBondContact O-CB 3.37Å; S66-D70 PolarHBondContact O-N 2.82Å; S66-D70 VanDerWaalsContact O-OD2 3.09Å; S66-D70 PolarHBondContact OG-OD2 3Å
67	T	95.9	Very high	94	Very high	27 Å²	27	56.9 Å²	56.9	17%	0.166	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-38.9	179	-56.5	0	0	0	0	113	K63 T64 L65 Y71 I77 V87	K63-T67 PolarHBondContact O-N 3.1Å; K63-T67 PolarHBondContact O-OG1 3.13Å; K63-T67 VanDerWaalsContact O-OG1 3.04Å; T64-T67 PolarHBondContact O-N 3.15Å; L65-T67 VanDerWaalsContact C-N 3.35Å; L65-T67 PolarHBondContact O-N 2.93Å; T67-Y71 WeakPolarHBondContact O-CB 3.35Å; T67-Y71 PolarHBondContact O-N 2.74Å; T67-I77 HydrophobicContact CG2-CG1 4.43Å; T67-V87 HydrophobicContact CG2-CG2 4.35Å
68	L	96.6	Very high	93.8	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-73.8	-37.9	179	-68.7	170.1	0	0	0	112.4	M60 T64 L65 S66 Y71 I72 V87 G90 A91 L94 I96 A99	M60-L68 HydrophobicContact CE-CD1 3.58Å; T64-L68 HydrophobicContact CG2-CD1 4.28Å; T64-L68 WeakPolarHBondContact O-CG 3.34Å; T64-L68 PolarHBondContact O-N 3.41Å; T64-L68 VanDerWaalsContact O-N 3.13Å; L65-L68 PolarHBondContact O-N 3.14Å; L65-L68 VanDerWaalsContact O-N 3.15Å; S66-L68 VanDerWaalsContact C-N 3.28Å; S66-L68 PolarHBondContact O-N 3.49Å; L68-Y71 PolarHBondContact O-N 3.43Å; L68-I72 WeakPolarHBondContact O-CG1 3.21Å; L68-I72 PolarHBondContact O-N 3.13Å; L68-V87 HydrophobicContact CD2-CG1 4.1Å; L68-G90 VanDerWaalsContact CD1-C 3.46Å; L68-A91 HydrophobicContact CD2-CB 3.82Å; L68-L94 HydrophobicContact CD1-CD1 3.98Å; L68-I96 HydrophobicContact CB-CD1 4.22Å; L68-A99 HydrophobicContact CD2-CB 3.96Å
69	I	95.4	Very high	93.9	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-66.5	-46.5	174.8	-62.4	-66.4	0	0	0	109.6	I25 I32 L39 F46 L65 S66 Y71 I72 Y73	I25-I69 HydrophobicContact CD1-CD1 3.92Å; I32-I69 HydrophobicContact CG2-CG2 4.43Å; L39-I69 HydrophobicContact CD1-CD1 4.05Å; L39-I69 HydrophobicContact CD2-CD1 3.47Å; L39-I69 VanDerWaalsContact CD2-CD1 3.47Å; L39-I69 HydrophobicContact CD2-CG2 4.47Å; L39-I69 HydrophobicContact CG-CD1 4.43Å; F46-I69 HydrophobicContact CE2-CD1 4.21Å; F46-I69 HydrophobicContact CZ-CD1 4.22Å; L65-I69 HydrophobicContact CD1-CD1 4.31Å; L65-I69 HydrophobicContact CD1-CG1 4.03Å; L65-I69 HydrophobicContact CG-CG1 4.19Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.22Å; L65-I69 PolarHBondContact O-N 3.37Å; S66-I69 PolarHBondContact O-N 3.39Å; S66-I69 VanDerWaalsContact O-N 3.16Å; I69-Y71 VanDerWaalsContact C-N 3.28Å; I69-Y71 PolarHBondContact O-N 3.05Å; I69-I72 WeakPolarHBondContact O-CB 3.32Å; I69-I72 PolarHBondContact O-N 3.25Å; I69-Y73 HydrophobicContact CG2-CD2 3.92Å; I69-Y73 HydrophobicContact CG2-CE2 3.76Å; I69-Y73 VanDerWaalsContact O-CD2 3.26Å; I69-Y73 WeakPolarHBondContact O-CD2 3.49Å; I69-Y73 PolarHBondContact O-N 2.83Å; I69-Y73 VanDerWaalsContact O-N 3.12Å
70	D	95.3	Very high	93.9	Very high	82 Å²	82	51.2 Å²	51.2	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-57.2	-42.2	175.7	-66.5	-28.6	0	0	0	111	S66 I72 Y73 T74	S66-D70 WeakPolarHBondContact O-CB 3.37Å; S66-D70 PolarHBondContact O-N 2.82Å; S66-D70 VanDerWaalsContact O-OD2 3.09Å; S66-D70 PolarHBondContact OG-OD2 3Å; D70-I72 PolarHBondContact O-N 3.47Å; D70-Y73 PolarHBondContact O-N 2.83Å; D70-T74 WeakPolarHBondContact O-CB 3.26Å; D70-T74 WeakPolarHBondContact O-CG2 3.27Å; D70-T74 PolarHBondContact O-N 3.34Å; D70-T74 PolarHBondContact O-OG1 3.46Å
71	Y	96.3	Very high	93.2	Very high	22 Å²	22	56.4 Å²	56.4	9%	0.086	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-41.6	172.9	167.8	-98.9	0	0	0	112.5	T67 L68 I69 Y73 T74 S75 I77 I96 C98 A99 A102	T67-Y71 WeakPolarHBondContact O-CB 3.35Å; T67-Y71 PolarHBondContact O-N 2.74Å; L68-Y71 PolarHBondContact O-N 3.43Å; I69-Y71 VanDerWaalsContact C-N 3.28Å; I69-Y71 PolarHBondContact O-N 3.05Å; Y71-Y73 PolarHBondContact O-N 3.37Å; Y71-T74 PolarHBondContact O-N 3.08Å; Y71-S75 WeakPolarHBondContact O-CA 3.32Å; Y71-S75 PolarHBondContact O-N 3.13Å; Y71-I77 HydrophobicContact CD2-CB 3.74Å; Y71-I77 HydrophobicContact CD2-CG1 4.44Å; Y71-I77 HydrophobicContact CE2-CB 4.38Å; Y71-I77 HydrophobicContact CG-CB 4.33Å; Y71-I77 HydrophobicContact CG-CD1 4.46Å; Y71-I96 HydrophobicContact CE1-CG2 4.38Å; Y71-C98 VanDerWaalsContact OH-C 3.23Å; Y71-C98 WeakPolarHBondContact OH-CB 3.43Å; Y71-C98 PolarHBondContact OH-O 3.15Å; Y71-C98 VanDerWaalsContact OH-O 3.08Å; Y71-A99 HydrophobicContact CD1-CB 3.6Å; Y71-A99 VanDerWaalsContact CE1-CA 3.47Å; Y71-A99 HydrophobicContact CE1-CB 3.51Å; Y71-A99 HydrophobicContact CG-CB 4.45Å; Y71-A102 HydrophobicContact CE2-CB 3.73Å
72	I	95.8	Very high	92.9	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.051	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-36.9	177.4	-67.2	167.2	0	0	0	110.7	V38 L39 K42 L68 I69 D70 I96	V38-I72 HydrophobicContact CG1-CG2 3.77Å; L39-I72 HydrophobicContact CD2-CB 4.36Å; L39-I72 HydrophobicContact CD2-CD1 3.58Å; L39-I72 HydrophobicContact CD2-CG2 4.1Å; K42-I72 HydrophobicContact CB-CG1 4.18Å; K42-I72 HydrophobicContact CB-CG2 4.22Å; K42-I72 HydrophobicContact CG-CG2 3.99Å; L68-I72 WeakPolarHBondContact O-CG1 3.21Å; L68-I72 PolarHBondContact O-N 3.13Å; I69-I72 WeakPolarHBondContact O-CB 3.32Å; I69-I72 PolarHBondContact O-N 3.25Å; D70-I72 PolarHBondContact O-N 3.47Å; I72-I96 HydrophobicContact CD1-CD1 3.85Å; I72-I96 HydrophobicContact CD1-CG1 4.49Å; I72-I96 HydrophobicContact CG1-CD1 4.49Å
73	Y	95.3	Very high	92.8	Very high	94 Å²	94	57.8 Å²	57.8	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-77.8	-35.7	178.3	-79.5	-77.6	0	0	0	114.1	H35 V38 I69 D70 Y71	H35-Y73 VanDerWaalsContact CB-OH 3.29Å; H35-Y73 WeakPolarHBondContact CB-OH 3.47Å; H35-Y73 PolarHBondContact N-OH 2.61Å; H35-Y73 AromaticContact ND1-CE1 3.82Å; H35-Y73 AromaticContact ND1-CZ 3.6Å; H35-Y73 PolarHBondContact ND1-OH 3.19Å; V38-Y73 HydrophobicContact CB-CE1 4.09Å; V38-Y73 HydrophobicContact CG1-CD1 4Å; V38-Y73 HydrophobicContact CG1-CE1 3.66Å; V38-Y73 HydrophobicContact CG1-CE2 4.45Å; V38-Y73 HydrophobicContact CG2-CE1 4.06Å; I69-Y73 HydrophobicContact CG2-CD2 3.92Å; I69-Y73 HydrophobicContact CG2-CE2 3.76Å; I69-Y73 VanDerWaalsContact O-CD2 3.26Å; I69-Y73 WeakPolarHBondContact O-CD2 3.49Å; I69-Y73 PolarHBondContact O-N 2.83Å; I69-Y73 VanDerWaalsContact O-N 3.12Å; D70-Y73 PolarHBondContact O-N 2.83Å; Y71-Y73 PolarHBondContact O-N 3.37Å
74	T	95.3	Very high	92.6	Very high	81 Å²	81	50.7 Å²	50.7	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-108.4	-16.3	-168	62.8	0	0	0	0	113.8	D70 Y71 Q76	D70-T74 WeakPolarHBondContact O-CB 3.26Å; D70-T74 WeakPolarHBondContact O-CG2 3.27Å; D70-T74 PolarHBondContact O-N 3.34Å; D70-T74 PolarHBondContact O-OG1 3.46Å; Y71-T74 PolarHBondContact O-N 3.08Å; T74-Q76 PolarHBondContact O-N 3.24Å; T74-Q76 PolarHBondContact OG1-N 2.74Å; T74-Q76 PolarHBondContact OG1-O 3.23Å
75	S	93.1	Very high	92.5	Very high	83 Å²	83	52.2 Å²	52.2	58%	0.58	28%	0.284	S	S	*	.	S	Bend	trans	56.2	16.8	-167.5	-56.1	0	0	0	0	114.6	Y71	Y71-S75 WeakPolarHBondContact O-CA 3.32Å; Y71-S75 PolarHBondContact O-N 3.13Å
76	Q	91.6	Very high	92.3	Very high	155 Å²	155	56.2 Å²	56.2	72%	0.724	31%	0.306	S	S	*	.			trans	-114.3	132.2	175.7	-66.4	-175.1	1	0	0	110.2	T74	T74-Q76 PolarHBondContact O-N 3.24Å; T74-Q76 PolarHBondContact OG1-N 2.74Å; T74-Q76 PolarHBondContact OG1-O 3.23Å
77	I	92.7	Very high	92.3	Very high	25 Å²	25	54.7 Å²	54.7	13%	0.128	30%	0.295	C	S	.	.			trans	-120.2	127.3	-179.4	-158.3	168.1	0	0	0	110.1	T67 Y71 V79 V87 A99 A102 A103	T67-I77 HydrophobicContact CG2-CG1 4.43Å; Y71-I77 HydrophobicContact CD2-CB 3.74Å; Y71-I77 HydrophobicContact CD2-CG1 4.44Å; Y71-I77 HydrophobicContact CE2-CB 4.38Å; Y71-I77 HydrophobicContact CG-CB 4.33Å; Y71-I77 HydrophobicContact CG-CD1 4.46Å; I77-V79 HydrophobicContact CB-CG2 4.45Å; I77-V79 HydrophobicContact CD1-CG2 4.13Å; I77-V79 HydrophobicContact CG1-CG2 3.81Å; I77-V79 HydrophobicContact CG2-CG2 4.06Å; I77-V87 HydrophobicContact CD1-CG1 3.63Å; I77-V87 HydrophobicContact CG1-CG1 4.35Å; I77-A99 HydrophobicContact CD1-CB 4.36Å; I77-A102 HydrophobicContact CG2-CB 3.72Å; I77-A103 HydrophobicContact CD1-CB 4.2Å
78	S	89	Confident	92.2	Very high	94 Å²	94	53.4 Å²	53.4	66%	0.657	29%	0.288	S	S	*	.			trans	-97.8	102.9	176.1	-176.7	0	0	0	0	109.4	N83	S78-N83 PolarHBondContact O-ND2 3.49Å
79	V	90.1	Very high	92.1	Very high	6 Å²	6	55.9 Å²	55.9	4%	0.036	30%	0.302	C	S	.	.			trans	-115.9	133.4	-178.2	-175	0	0	0	0	110.3	I77 N83 V84 V87 A103 M107 Q110	I77-V79 HydrophobicContact CB-CG2 4.45Å; I77-V79 HydrophobicContact CD1-CG2 4.13Å; I77-V79 HydrophobicContact CG1-CG2 3.81Å; I77-V79 HydrophobicContact CG2-CG2 4.06Å; V79-N83 WeakPolarHBondContact CA-OD1 3.5Å; V79-V84 HydrophobicContact CG1-CB 3.49Å; V79-V84 VanDerWaalsContact CG1-CB 3.49Å; V79-V84 HydrophobicContact CG1-CG2 3.66Å; V79-V87 HydrophobicContact CG2-CG1 4.32Å; V79-A103 HydrophobicContact CG2-CB 3.89Å; V79-M107 HydrophobicContact CG1-CG 3.92Å; V79-M107 HydrophobicContact CG1-SD 3.69Å; V79-Q110 PolarHBondContact O-NE2 3.38Å
80	S	86.8	Confident	92.1	Very high	42 Å²	42	55.7 Å²	55.7	29%	0.294	30%	0.302	S	S	.	.			trans	-132.8	170.8	173.6	78.8	0	0	0	0	110.2	D82 N83 V84	S80-D82 PolarHBondContact O-N 2.92Å; S80-D82 VanDerWaalsContact O-N 3.08Å; S80-D82 PolarHBondContact OG-N 3.46Å; S80-N83 PolarHBondContact N-OD1 2.92Å; S80-N83 PolarHBondContact O-N 3Å; S80-N83 PolarHBondContact O-OD1 3.27Å; S80-N83 VanDerWaalsContact O-OD1 3.11Å; S80-V84 VanDerWaalsContact O-CB 3.26Å; S80-V84 WeakPolarHBondContact O-CB 3.48Å; S80-V84 WeakPolarHBondContact O-CG1 3.5Å; S80-V84 PolarHBondContact O-N 3.26Å
81	K	79.4	Confident	92.1	Very high	140 Å²	140	51.8 Å²	51.8	61%	0.609	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.4	175	68.5	-179	-174.6	177.4	0	113.9
82	D	86.8	Confident	92	Very high	130 Å²	130	55 Å²	55	70%	0.695	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-27.2	-173.9	-53.7	-54.6	0	0	0	112.7	S80	S80-D82 PolarHBondContact O-N 2.92Å; S80-D82 VanDerWaalsContact O-N 3.08Å; S80-D82 PolarHBondContact OG-N 3.46Å
83	N	91.9	Very high	92	Very high	28 Å²	28	57.6 Å²	57.6	15%	0.15	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-14.4	-175.6	75.5	2.9	0	0	0	113.9	S78 V79 S80 V85 D86 V87	S78-N83 PolarHBondContact O-ND2 3.49Å; V79-N83 WeakPolarHBondContact CA-OD1 3.5Å; S80-N83 PolarHBondContact N-OD1 2.92Å; S80-N83 PolarHBondContact O-N 3Å; S80-N83 PolarHBondContact O-OD1 3.27Å; S80-N83 VanDerWaalsContact O-OD1 3.11Å; N83-V85 VanDerWaalsContact C-N 3.3Å; N83-V85 PolarHBondContact O-N 3.35Å; N83-D86 PolarHBondContact O-N 3.32Å; N83-D86 VanDerWaalsContact O-N 3.1Å; N83-V87 HydrophobicContact CB-CG2 4.32Å; N83-V87 WeakPolarHBondContact O-CB 3.17Å; N83-V87 VanDerWaalsContact O-CG2 3.32Å; N83-V87 WeakPolarHBondContact O-CG2 3.27Å; N83-V87 PolarHBondContact O-N 2.87Å
84	V	91.3	Very high	92	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.5	-42	-173.3	60	0	0	0	0	113.3	V79 S80 D86 I88 M107 I122	V79-V84 HydrophobicContact CG1-CB 3.49Å; V79-V84 VanDerWaalsContact CG1-CB 3.49Å; V79-V84 HydrophobicContact CG1-CG2 3.66Å; S80-V84 VanDerWaalsContact O-CB 3.26Å; S80-V84 WeakPolarHBondContact O-CB 3.48Å; S80-V84 WeakPolarHBondContact O-CG1 3.5Å; S80-V84 PolarHBondContact O-N 3.26Å; V84-D86 PolarHBondContact O-N 3.17Å; V84-I88 HydrophobicContact CG2-CD1 3.61Å; V84-I88 HydrophobicContact CG2-CG1 4.29Å; V84-I88 WeakPolarHBondContact O-CB 3.29Å; V84-I88 VanDerWaalsContact O-CG1 3.22Å; V84-I88 WeakPolarHBondContact O-CG1 3.33Å; V84-I88 PolarHBondContact O-N 3.04Å; V84-M107 HydrophobicContact CB-SD 4.1Å; V84-M107 HydrophobicContact CG2-CE 4.35Å; V84-M107 HydrophobicContact CG2-CG 3.79Å; V84-M107 HydrophobicContact CG2-SD 3.86Å; V84-I122 HydrophobicContact CG1-CD1 3.66Å; V84-I122 HydrophobicContact CG1-CG1 4.42Å; V84-I122 HydrophobicContact CG1-CG2 4.18Å; V84-I122 HydrophobicContact CG2-CG2 4.27Å
85	V	92.1	Very high	92.1	Very high	40 Å²	40	53.8 Å²	53.8	24%	0.242	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-45.7	179.9	169.7	0	0	0	0	110.7	N83 T89 I122	N83-V85 VanDerWaalsContact C-N 3.3Å; N83-V85 PolarHBondContact O-N 3.35Å; V85-T89 VanDerWaalsContact O-CB 3.29Å; V85-T89 WeakPolarHBondContact O-CB 3.19Å; V85-T89 PolarHBondContact O-N 3.41Å; V85-T89 PolarHBondContact O-OG1 3.04Å; V85-I122 HydrophobicContact CG2-CG1 4.29Å; V85-I122 HydrophobicContact CG2-CG2 4.3Å
86	D	93.4	Very high	92.2	Very high	84 Å²	84	49.9 Å²	49.9	45%	0.449	26%	0.261	S	S	.	.	H	α-helix	trans	-70.5	-43.4	-178.7	-66.6	-23.2	0	0	0	111.1	T64 N83 V84 I88 T89 G90	T64-D86 VanDerWaalsContact CG2-C 3.48Å; T64-D86 HydrophobicContact CG2-CB 4.04Å; T64-D86 WeakPolarHBondContact CG2-O 3.41Å; N83-D86 PolarHBondContact O-N 3.32Å; N83-D86 VanDerWaalsContact O-N 3.1Å; V84-D86 PolarHBondContact O-N 3.17Å; D86-I88 PolarHBondContact O-N 3.19Å; D86-T89 PolarHBondContact O-N 3.36Å; D86-G90 PolarHBondContact O-N 3.06Å
87	V	94.8	Very high	92.4	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-47.8	178	170.6	0	0	0	0	110.6	T67 L68 I77 V79 N83 G90 A91 A103	T67-V87 HydrophobicContact CG2-CG2 4.35Å; L68-V87 HydrophobicContact CD2-CG1 4.1Å; I77-V87 HydrophobicContact CD1-CG1 3.63Å; I77-V87 HydrophobicContact CG1-CG1 4.35Å; V79-V87 HydrophobicContact CG2-CG1 4.32Å; N83-V87 HydrophobicContact CB-CG2 4.32Å; N83-V87 WeakPolarHBondContact O-CB 3.17Å; N83-V87 VanDerWaalsContact O-CG2 3.32Å; N83-V87 WeakPolarHBondContact O-CG2 3.27Å; N83-V87 PolarHBondContact O-N 2.87Å; V87-G90 PolarHBondContact O-N 3.09Å; V87-A91 VanDerWaalsContact O-CB 3.26Å; V87-A91 WeakPolarHBondContact O-CB 3.27Å; V87-A91 PolarHBondContact O-N 2.95Å; V87-A103 HydrophobicContact CG1-CB 4.46Å
88	I	94.1	Very high	92.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-42.4	179.5	-67.9	177.2	0	0	0	111.2	V84 D86 A91 K92 A103 Q126 L128	V84-I88 HydrophobicContact CG2-CD1 3.61Å; V84-I88 HydrophobicContact CG2-CG1 4.29Å; V84-I88 WeakPolarHBondContact O-CB 3.29Å; V84-I88 VanDerWaalsContact O-CG1 3.22Å; V84-I88 WeakPolarHBondContact O-CG1 3.33Å; V84-I88 PolarHBondContact O-N 3.04Å; D86-I88 PolarHBondContact O-N 3.19Å; I88-A91 PolarHBondContact O-N 3.11Å; I88-K92 HydrophobicContact CG2-CD 4.31Å; I88-K92 WeakPolarHBondContact O-CG 3.2Å; I88-K92 PolarHBondContact O-N 2.98Å; I88-A103 HydrophobicContact CD1-CB 4.43Å; I88-A103 HydrophobicContact CG1-CB 4.02Å; I88-Q126 HydrophobicContact CG2-CB 4.39Å; I88-Q126 HydrophobicContact CG2-CG 4.36Å; I88-L128 HydrophobicContact CD1-CD1 3.52Å; I88-L128 HydrophobicContact CG2-CD1 4.37Å; I88-L128 HydrophobicContact CG2-CD2 4.27Å
89	T	93.6	Very high	92.8	Very high	51 Å²	51	43.3 Å²	43.3	31%	0.313	23%	0.232	S	C	.	.	H	α-helix	trans	-64.3	-44.2	177.9	-55	0	0	0	0	110.6	V85 D86 K92 I93 Q126	V85-T89 VanDerWaalsContact O-CB 3.29Å; V85-T89 WeakPolarHBondContact O-CB 3.19Å; V85-T89 PolarHBondContact O-N 3.41Å; V85-T89 PolarHBondContact O-OG1 3.04Å; D86-T89 PolarHBondContact O-N 3.36Å; T89-K92 PolarHBondContact O-N 2.96Å; T89-I93 HydrophobicContact CG2-CD1 4.02Å; T89-I93 VanDerWaalsContact O-CG1 3.29Å; T89-I93 WeakPolarHBondContact O-CG1 3.49Å; T89-I93 PolarHBondContact O-N 3.38Å; T89-Q126 PolarHBondContact OG1-NE2 2.92Å
90	G	95.1	Very high	93	Very high	1 Å²	1	44 Å²	44	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-44.9	176.5	0	0	0	0	0	113.1	M60 L68 D86 V87 K92 I93 L94	M60-G90 VanDerWaalsContact CE-CA 3.4Å; L68-G90 VanDerWaalsContact CD1-C 3.46Å; D86-G90 PolarHBondContact O-N 3.06Å; V87-G90 PolarHBondContact O-N 3.09Å; G90-K92 VanDerWaalsContact C-N 3.3Å; G90-K92 PolarHBondContact O-N 3.45Å; G90-I93 PolarHBondContact O-N 3.08Å; G90-L94 WeakPolarHBondContact O-CB 3.13Å; G90-L94 WeakPolarHBondContact O-CG 3.38Å; G90-L94 PolarHBondContact O-N 3.32Å
91	A	95.6	Very high	93.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-39	176.2	0	0	0	0	0	111.7	L68 V87 I88 L94 Q95 I96 A99 V100	L68-A91 HydrophobicContact CD2-CB 3.82Å; V87-A91 VanDerWaalsContact O-CB 3.26Å; V87-A91 WeakPolarHBondContact O-CB 3.27Å; V87-A91 PolarHBondContact O-N 2.95Å; I88-A91 PolarHBondContact O-N 3.11Å; A91-L94 CarbonylContact O-C 3.53Å; A91-Q95 WeakPolarHBondContact O-CA 3.44Å; A91-Q95 PolarHBondContact O-N 3.2Å; A91-I96 PolarHBondContact O-N 3.24Å; A91-A99 HydrophobicContact CB-CB 3.97Å; A91-V100 HydrophobicContact CB-CG2 3.59Å
92	K	94.6	Very high	94	Very high	89 Å²	89	39.7 Å²	39.7	39%	0.387	22%	0.217	S	C	.	.	H	α-helix	trans	-66.6	-43.9	173.5	-72.1	173.4	-179.8	174.7	0	112.3	I88 T89 G90 L94 Q95 V100 Q126	I88-K92 HydrophobicContact CG2-CD 4.31Å; I88-K92 WeakPolarHBondContact O-CG 3.2Å; I88-K92 PolarHBondContact O-N 2.98Å; T89-K92 PolarHBondContact O-N 2.96Å; G90-K92 VanDerWaalsContact C-N 3.3Å; G90-K92 PolarHBondContact O-N 3.45Å; K92-L94 VanDerWaalsContact C-N 3.34Å; K92-L94 PolarHBondContact O-N 2.79Å; K92-Q95 PolarHBondContact O-N 3Å; K92-Q95 VanDerWaalsContact O-N 3.12Å; K92-V100 HydrophobicContact CG-CG2 4.09Å; K92-Q126 PolarHBondContact NZ-O 3.02Å
93	I	94.9	Very high	94.4	Very high	66 Å²	66	33.5 Å²	33.5	34%	0.338	18%	0.184	S	C	.	.	H	α-helix	trans	-59.8	-46	177	-71.9	166.4	0	0	0	110.8	T89 G90 Q95	T89-I93 HydrophobicContact CG2-CD1 4.02Å; T89-I93 VanDerWaalsContact O-CG1 3.29Å; T89-I93 WeakPolarHBondContact O-CG1 3.49Å; T89-I93 PolarHBondContact O-N 3.38Å; G90-I93 PolarHBondContact O-N 3.08Å; I93-Q95 PolarHBondContact O-N 3.31Å
94	L	96	Very high	94.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	4.2	178.7	-62.3	179.7	0	0	0	112.9	S43 Y45 F46 V57 M60 L65 L68 G90 A91 K92 I96	S43-L94 PolarHBondContact OG-O 3Å; Y45-L94 WeakPolarHBondContact CB-O 3.29Å; Y45-L94 HydrophobicContact CD1-CD2 3.75Å; Y45-L94 HydrophobicContact CE1-CD2 3.84Å; Y45-L94 HydrophobicContact CG-CD2 4.26Å; F46-L94 HydrophobicContact CE2-CD1 4.25Å; F46-L94 HydrophobicContact CE2-CD2 4.27Å; F46-L94 HydrophobicContact CZ-CD1 4.25Å; F46-L94 HydrophobicContact CZ-CD2 3.91Å; V57-L94 HydrophobicContact CG1-CD2 4.19Å; V57-L94 HydrophobicContact CG2-CD2 4.37Å; M60-L94 HydrophobicContact CE-CD1 3.96Å; M60-L94 HydrophobicContact CE-CG 4.42Å; M60-L94 HydrophobicContact SD-CD1 4Å; M60-L94 HydrophobicContact SD-CG 4.31Å; L65-L94 HydrophobicContact CD1-CD1 3.67Å; L68-L94 HydrophobicContact CD1-CD1 3.98Å; G90-L94 WeakPolarHBondContact O-CB 3.13Å; G90-L94 WeakPolarHBondContact O-CG 3.38Å; G90-L94 PolarHBondContact O-N 3.32Å; A91-L94 CarbonylContact O-C 3.53Å; K92-L94 VanDerWaalsContact C-N 3.34Å; K92-L94 PolarHBondContact O-N 2.79Å; L94-I96 HydrophobicContact CB-CD1 3.68Å; L94-I96 HydrophobicContact CB-CG1 3.88Å; L94-I96 HydrophobicContact CD1-CD1 4.1Å; L94-I96 WeakPolarHBondContact O-CG1 3.45Å; L94-I96 PolarHBondContact O-N 3.45Å
95	Q	96.8	Very high	94.5	Very high	95 Å²	95	36.2 Å²	36.2	44%	0.444	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	55.6	179.3	-55.9	176.8	20.2	0	0	112.1	S43 D44 A91 K92 I93 P97	S43-Q95 WeakPolarHBondContact CA-O 3.49Å; D44-Q95 HydrophobicContact CB-CB 4.22Å; D44-Q95 PolarHBondContact N-O 2.97Å; A91-Q95 WeakPolarHBondContact O-CA 3.44Å; A91-Q95 PolarHBondContact O-N 3.2Å; K92-Q95 PolarHBondContact O-N 3Å; K92-Q95 VanDerWaalsContact O-N 3.12Å; I93-Q95 PolarHBondContact O-N 3.31Å; Q95-P97 WeakPolarHBondContact O-CD 3.46Å
96	I	96.7	Very high	94.5	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.195	C	C	.	.			trans	-112.9	79.6	176.8	-49.4	165.7	0	0	0	108.4	L68 Y71 I72 A91 L94 C98 A99 V100	L68-I96 HydrophobicContact CB-CD1 4.22Å; Y71-I96 HydrophobicContact CE1-CG2 4.38Å; I72-I96 HydrophobicContact CD1-CD1 3.85Å; I72-I96 HydrophobicContact CD1-CG1 4.49Å; I72-I96 HydrophobicContact CG1-CD1 4.49Å; A91-I96 PolarHBondContact O-N 3.24Å; L94-I96 HydrophobicContact CB-CD1 3.68Å; L94-I96 HydrophobicContact CB-CG1 3.88Å; L94-I96 HydrophobicContact CD1-CD1 4.1Å; L94-I96 WeakPolarHBondContact O-CG1 3.45Å; L94-I96 PolarHBondContact O-N 3.45Å; I96-C98 VanDerWaalsContact C-N 3.3Å; I96-C98 PolarHBondContact O-N 2.99Å; I96-A99 HydrophobicContact CB-CB 4Å; I96-A99 HydrophobicContact CG2-CB 3.49Å; I96-A99 VanDerWaalsContact CG2-CB 3.49Å; I96-A99 PolarHBondContact O-N 3.29Å; I96-V100 PolarHBondContact O-N 2.55Å
97	P	94.4	Very high	94.5	Very high	89 Å²	89	31.7 Å²	31.7	58%	0.578	18%	0.175	S	C	*	.	H	α-helix	trans	-61	-37	-174.2	-23.3	34.4	0	0	0	113.2	Q95 A99 V100 Q101	Q95-P97 WeakPolarHBondContact O-CD 3.46Å; P97-A99 VanDerWaalsContact C-N 3.29Å; P97-A99 PolarHBondContact O-N 3.14Å; P97-V100 WeakPolarHBondContact O-CB 3.26Å; P97-V100 PolarHBondContact O-N 3.17Å; P97-V100 VanDerWaalsContact O-N 3.13Å; P97-Q101 PolarHBondContact O-N 3.39Å
98	C	94.5	Very high	94.4	Very high	46 Å²	46	33.3 Å²	33.3	31%	0.311	19%	0.186	S	C	.	.	H	α-helix	trans	-65.1	-31.5	179.3	62	0	0	0	0	112.7	Y71 I96 Q101 A102	Y71-C98 VanDerWaalsContact OH-C 3.23Å; Y71-C98 WeakPolarHBondContact OH-CB 3.43Å; Y71-C98 PolarHBondContact OH-O 3.15Å; Y71-C98 VanDerWaalsContact OH-O 3.08Å; I96-C98 VanDerWaalsContact C-N 3.3Å; I96-C98 PolarHBondContact O-N 2.99Å; C98-Q101 PolarHBondContact O-N 3Å; C98-A102 VanDerWaalsContact O-CB 3.31Å; C98-A102 WeakPolarHBondContact O-CB 3.4Å; C98-A102 PolarHBondContact O-N 3.3Å
99	A	95.3	Very high	94.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.2	-35.4	173.6	0	0	0	0	0	112	L68 Y71 I77 A91 I96 P97 A103	L68-A99 HydrophobicContact CD2-CB 3.96Å; Y71-A99 HydrophobicContact CD1-CB 3.6Å; Y71-A99 VanDerWaalsContact CE1-CA 3.47Å; Y71-A99 HydrophobicContact CE1-CB 3.51Å; Y71-A99 HydrophobicContact CG-CB 4.45Å; I77-A99 HydrophobicContact CD1-CB 4.36Å; A91-A99 HydrophobicContact CB-CB 3.97Å; I96-A99 HydrophobicContact CB-CB 4Å; I96-A99 HydrophobicContact CG2-CB 3.49Å; I96-A99 VanDerWaalsContact CG2-CB 3.49Å; I96-A99 PolarHBondContact O-N 3.29Å; P97-A99 VanDerWaalsContact C-N 3.29Å; P97-A99 PolarHBondContact O-N 3.14Å; A99-A103 VanDerWaalsContact O-CB 3.32Å; A99-A103 WeakPolarHBondContact O-CB 3.14Å; A99-A103 PolarHBondContact O-N 3.39Å
100	V	94.5	Very high	94.3	Very high	20 Å²	20	42.9 Å²	42.9	12%	0.121	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-46.6	173.6	179.5	0	0	0	0	109.9	A91 K92 I96 P97 A103 M104 L128	A91-V100 HydrophobicContact CB-CG2 3.59Å; K92-V100 HydrophobicContact CG-CG2 4.09Å; I96-V100 PolarHBondContact O-N 2.55Å; P97-V100 WeakPolarHBondContact O-CB 3.26Å; P97-V100 PolarHBondContact O-N 3.17Å; P97-V100 VanDerWaalsContact O-N 3.13Å; V100-A103 PolarHBondContact O-N 3.36Å; V100-M104 HydrophobicContact CG1-SD 3.97Å; V100-M104 WeakPolarHBondContact O-CG 3.08Å; V100-M104 PolarHBondContact O-N 2.96Å; V100-L128 HydrophobicContact CG1-CD2 4.33Å
101	Q	94.4	Very high	94.3	Very high	71 Å²	71	43.7 Å²	43.7	33%	0.332	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-48.8	177.9	-168	63.3	42	0	0	111.5	P97 C98 A103 M104 D105 E130	P97-Q101 PolarHBondContact O-N 3.39Å; C98-Q101 PolarHBondContact O-N 3Å; Q101-A103 VanDerWaalsContact C-N 3.26Å; Q101-A103 PolarHBondContact O-N 2.98Å; Q101-M104 CarbonylContact O-C 3.59Å; Q101-M104 WeakPolarHBondContact O-CA 3.43Å; Q101-M104 WeakPolarHBondContact O-CB 3.41Å; Q101-M104 PolarHBondContact O-N 2.79Å; Q101-D105 PolarHBondContact NE2-OD1 2.87Å; Q101-D105 VanDerWaalsContact O-CG 3.24Å; Q101-D105 PolarHBondContact O-N 3.48Å; Q101-E130 PolarHBondContact NE2-OE2 3.1Å
102	A	94.4	Very high	94.2	Very high	21 Å²	21	46 Å²	46	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-37.5	178.4	0	0	0	0	0	112.4	Y71 I77 C98 S106	Y71-A102 HydrophobicContact CE2-CB 3.73Å; I77-A102 HydrophobicContact CG2-CB 3.72Å; C98-A102 VanDerWaalsContact O-CB 3.31Å; C98-A102 WeakPolarHBondContact O-CB 3.4Å; C98-A102 PolarHBondContact O-N 3.3Å; A102-S106 WeakPolarHBondContact O-CB 3.33Å; A102-S106 PolarHBondContact O-N 3.24Å
103	A	94	Very high	94.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-41	173.1	0	0	0	0	0	112.1	I77 V79 V87 I88 A99 V100 Q101 M107	I77-A103 HydrophobicContact CD1-CB 4.2Å; V79-A103 HydrophobicContact CG2-CB 3.89Å; V87-A103 HydrophobicContact CG1-CB 4.46Å; I88-A103 HydrophobicContact CD1-CB 4.43Å; I88-A103 HydrophobicContact CG1-CB 4.02Å; A99-A103 VanDerWaalsContact O-CB 3.32Å; A99-A103 WeakPolarHBondContact O-CB 3.14Å; A99-A103 PolarHBondContact O-N 3.39Å; V100-A103 PolarHBondContact O-N 3.36Å; Q101-A103 VanDerWaalsContact C-N 3.26Å; Q101-A103 PolarHBondContact O-N 2.98Å; A103-M107 WeakPolarHBondContact O-CB 3.38Å; A103-M107 WeakPolarHBondContact O-CG 3.38Å; A103-M107 PolarHBondContact O-N 3.38Å
104	M	93.4	Very high	94	Very high	11 Å²	11	46.9 Å²	46.9	5%	0.054	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-41.4	177.3	-73.4	169.7	41.8	0	0	112.5	V100 Q101 M107 S108 L128 E130 L131	V100-M104 HydrophobicContact CG1-SD 3.97Å; V100-M104 WeakPolarHBondContact O-CG 3.08Å; V100-M104 PolarHBondContact O-N 2.96Å; Q101-M104 CarbonylContact O-C 3.59Å; Q101-M104 WeakPolarHBondContact O-CA 3.43Å; Q101-M104 WeakPolarHBondContact O-CB 3.41Å; Q101-M104 PolarHBondContact O-N 2.79Å; M104-M107 PolarHBondContact O-N 3.01Å; M104-S108 WeakPolarHBondContact O-CB 3.48Å; M104-S108 PolarHBondContact O-N 3.16Å; M104-S108 PolarHBondContact O-OG 2.94Å; M104-L128 HydrophobicContact CG-CD1 4.2Å; M104-L128 HydrophobicContact SD-CB 4.33Å; M104-L128 HydrophobicContact SD-CD1 4.49Å; M104-L128 HydrophobicContact SD-CD2 3.9Å; M104-L128 HydrophobicContact SD-CG 4.44Å; M104-E130 HydrophobicContact CE-CB 3.63Å; M104-E130 HydrophobicContact CE-CG 4.25Å; M104-E130 WeakPolarHBondContact CE-OE2 3.42Å; M104-L131 HydrophobicContact CG-CB 4.47Å
105	D	92.9	Very high	93.9	Very high	74 Å²	74	48.8 Å²	48.8	40%	0.396	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-48.2	178.2	-61.5	-19.6	0	0	0	109.9	Q101 M107 S108 E109	Q101-D105 PolarHBondContact NE2-OD1 2.87Å; Q101-D105 VanDerWaalsContact O-CG 3.24Å; Q101-D105 PolarHBondContact O-N 3.48Å; D105-M107 VanDerWaalsContact C-N 3.31Å; D105-M107 PolarHBondContact O-N 2.96Å; D105-S108 WeakPolarHBondContact O-CB 3.35Å; D105-S108 PolarHBondContact O-N 2.99Å; D105-E109 PolarHBondContact O-N 3.48Å
106	S	92.2	Very high	93.9	Very high	24 Å²	24	44.2 Å²	44.2	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-58.7	-40.2	175.7	-174	0	0	0	0	112.7	A102 Q110	A102-S106 WeakPolarHBondContact O-CB 3.33Å; A102-S106 PolarHBondContact O-N 3.24Å; S106-Q110 VanDerWaalsContact O-CG 3.29Å; S106-Q110 WeakPolarHBondContact O-CG 3.4Å; S106-Q110 PolarHBondContact O-N 3.34Å; S106-Q110 PolarHBondContact O-NE2 3.07Å; S106-Q110 PolarHBondContact OG-NE2 3.12Å; S106-Q110 VanDerWaalsContact OG-NE2 3.16Å
107	M	92.4	Very high	93.8	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.03	25%	0.25	C	C	.	.	H	α-helix	trans	-70	-33.1	175.7	-72.4	-64.6	-58	0	0	112.7	V79 V84 A103 M104 D105 Q110 I111 I119 L131	V79-M107 HydrophobicContact CG1-CG 3.92Å; V79-M107 HydrophobicContact CG1-SD 3.69Å; V84-M107 HydrophobicContact CB-SD 4.1Å; V84-M107 HydrophobicContact CG2-CE 4.35Å; V84-M107 HydrophobicContact CG2-CG 3.79Å; V84-M107 HydrophobicContact CG2-SD 3.86Å; A103-M107 WeakPolarHBondContact O-CB 3.38Å; A103-M107 WeakPolarHBondContact O-CG 3.38Å; A103-M107 PolarHBondContact O-N 3.38Å; M104-M107 PolarHBondContact O-N 3.01Å; D105-M107 VanDerWaalsContact C-N 3.31Å; D105-M107 PolarHBondContact O-N 2.96Å; M107-Q110 PolarHBondContact O-N 3.46Å; M107-I111 WeakPolarHBondContact O-CG1 3.23Å; M107-I119 HydrophobicContact CE-CB 4.48Å; M107-I119 HydrophobicContact CE-CD1 3.84Å; M107-I119 HydrophobicContact CE-CG1 3.61Å; M107-I119 HydrophobicContact CE-CG2 4.35Å; M107-L131 HydrophobicContact CB-CD1 4.02Å; M107-L131 HydrophobicContact CB-CD2 4.19Å
108	S	93.6	Very high	93.8	Very high	35 Å²	35	46.8 Å²	46.8	25%	0.245	24%	0.243	C	C	.	.	H	α-helix	trans	-68.5	-36.6	179	-63.8	0	0	0	0	111.9	M104 D105 Q110 I111 L131	M104-S108 WeakPolarHBondContact O-CB 3.48Å; M104-S108 PolarHBondContact O-N 3.16Å; M104-S108 PolarHBondContact O-OG 2.94Å; D105-S108 WeakPolarHBondContact O-CB 3.35Å; D105-S108 PolarHBondContact O-N 2.99Å; S108-Q110 VanDerWaalsContact C-N 3.29Å; S108-Q110 PolarHBondContact O-N 3.06Å; S108-I111 WeakPolarHBondContact O-CG1 3.33Å; S108-L131 WeakPolarHBondContact OG-CD1 3.34Å
109	E	92.4	Very high	93.8	Very high	169 Å²	169	44.8 Å²	44.8	79%	0.79	23%	0.23	S	C	*	.	H	α-helix	trans	-70.5	-25.9	175.8	-69.2	177.4	177.5	0	0	113	D105	D105-E109 PolarHBondContact O-N 3.48Å
110	Q	91.6	Very high	93.8	Very high	83 Å²	83	44.8 Å²	44.8	39%	0.388	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	5.4	-177.6	-68.1	177.5	54.3	0	0	113.8	V79 S106 M107 S108 T112 N115	V79-Q110 PolarHBondContact O-NE2 3.38Å; S106-Q110 VanDerWaalsContact O-CG 3.29Å; S106-Q110 WeakPolarHBondContact O-CG 3.4Å; S106-Q110 PolarHBondContact O-N 3.34Å; S106-Q110 PolarHBondContact O-NE2 3.07Å; S106-Q110 PolarHBondContact OG-NE2 3.12Å; S106-Q110 VanDerWaalsContact OG-NE2 3.16Å; M107-Q110 PolarHBondContact O-N 3.46Å; S108-Q110 VanDerWaalsContact C-N 3.29Å; S108-Q110 PolarHBondContact O-N 3.06Å; Q110-T112 PolarHBondContact O-N 3.31Å; Q110-N115 PolarHBondContact O-ND2 3.36Å
111	I	94.8	Very high	93.9	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.087	24%	0.242	C	C	.	.			trans	-68.2	125.3	-179.3	-55.6	-179.1	0	0	0	110.2	M107 S108 N115 C116 I119 T134 A135 F138	M107-I111 WeakPolarHBondContact O-CG1 3.23Å; S108-I111 WeakPolarHBondContact O-CG1 3.33Å; I111-N115 WeakPolarHBondContact CA-OD1 3.26Å; I111-C116 HydrophobicContact CG2-CB 3.74Å; I111-I119 HydrophobicContact CB-CD1 4.33Å; I111-I119 HydrophobicContact CD1-CG2 4.4Å; I111-I119 HydrophobicContact CG1-CD1 3.75Å; I111-I119 HydrophobicContact CG1-CG2 4.36Å; I111-T134 HydrophobicContact CD1-CG2 3.83Å; I111-A135 HydrophobicContact CD1-CB 4.47Å; I111-F138 HydrophobicContact CB-CD2 4.12Å; I111-F138 HydrophobicContact CB-CE2 4.48Å; I111-F138 HydrophobicContact CB-CG 4.24Å; I111-F138 HydrophobicContact CG2-CB 3.86Å; I111-F138 HydrophobicContact CG2-CD1 3.46Å; I111-F138 VanDerWaalsContact CG2-CD1 3.46Å; I111-F138 HydrophobicContact CG2-CD2 3.67Å; I111-F138 HydrophobicContact CG2-CE1 3.91Å; I111-F138 HydrophobicContact CG2-CE2 4.07Å; I111-F138 HydrophobicContact CG2-CG 3.35Å; I111-F138 HydrophobicContact CG2-CZ 4.19Å; I111-F138 WeakPolarHBondContact O-CE2 3.29Å
112	T	94.9	Very high	93.8	Very high	50 Å²	50	44.5 Å²	44.5	31%	0.307	23%	0.232	S	C	.	.			trans	-127.9	166	175.7	79.1	0	0	0	0	110.5	Q110 E114 N115 C116 F138	Q110-T112 PolarHBondContact O-N 3.31Å; T112-E114 WeakPolarHBondContact CB-OE2 3.32Å; T112-E114 PolarHBondContact O-N 2.77Å; T112-E114 PolarHBondContact OG1-N 2.92Å; T112-E114 PolarHBondContact OG1-OE2 3.03Å; T112-N115 PolarHBondContact N-OD1 3.32Å; T112-N115 PolarHBondContact O-N 3.44Å; T112-N115 PolarHBondContact O-OD1 3.2Å; T112-N115 PolarHBondContact OG1-N 3.13Å; T112-C116 VanDerWaalsContact O-CB 3.24Å; T112-C116 WeakPolarHBondContact O-CB 3.29Å; T112-C116 PolarHBondContact O-N 3.37Å; T112-F138 VanDerWaalsContact C-CE1 3.48Å; T112-F138 VanDerWaalsContact C-CZ 3.44Å
113	P	93.3	Very high	93.8	Very high	32 Å²	32	43.5 Å²	43.5	21%	0.208	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.5	175.2	-24.9	36.7	0	0	0	112.6	C116 F138	P113-C116 PolarHBondContact O-SG 3.18Å; P113-F138 HydrophobicContact CG-CE1 4.45Å; P113-F138 HydrophobicContact CG-CZ 4.16Å
114	E	92.1	Very high	93.9	Very high	141 Å²	141	46.7 Å²	46.7	66%	0.659	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-28.6	-175.4	-54.7	72.9	-154.1	0	0	113.2	T112	T112-E114 WeakPolarHBondContact CB-OE2 3.32Å; T112-E114 PolarHBondContact O-N 2.77Å; T112-E114 PolarHBondContact OG1-N 2.92Å; T112-E114 PolarHBondContact OG1-OE2 3.03Å
115	N	93.6	Very high	93.9	Very high	39 Å²	39	53.8 Å²	53.8	21%	0.209	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-9.2	-174.9	74.9	14.6	0	0	0	114.4	Q110 I111 T112 Y117 E118 I119	Q110-N115 PolarHBondContact O-ND2 3.36Å; I111-N115 WeakPolarHBondContact CA-OD1 3.26Å; T112-N115 PolarHBondContact N-OD1 3.32Å; T112-N115 PolarHBondContact O-N 3.44Å; T112-N115 PolarHBondContact O-OD1 3.2Å; T112-N115 PolarHBondContact OG1-N 3.13Å; N115-Y117 VanDerWaalsContact C-N 3.25Å; N115-Y117 PolarHBondContact O-N 3.41Å; N115-Y117 VanDerWaalsContact O-N 3.12Å; N115-E118 WeakPolarHBondContact O-CB 3.44Å; N115-E118 PolarHBondContact O-N 2.78Å; N115-I119 WeakPolarHBondContact O-CG1 3.45Å; N115-I119 PolarHBondContact O-N 2.9Å; N115-I119 WeakPolarHBondContact OD1-CD1 3.34Å
116	C	96	Very high	93.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-35.9	-171.2	62.1	0	0	0	0	113.7	I111 T112 P113 L120 F138 M139	I111-C116 HydrophobicContact CG2-CB 3.74Å; T112-C116 VanDerWaalsContact O-CB 3.24Å; T112-C116 WeakPolarHBondContact O-CB 3.29Å; T112-C116 PolarHBondContact O-N 3.37Å; P113-C116 PolarHBondContact O-SG 3.18Å; C116-L120 WeakPolarHBondContact O-CB 3.46Å; C116-L120 PolarHBondContact O-N 3.26Å; C116-F138 HydrophobicContact CB-CD1 3.74Å; C116-F138 HydrophobicContact CB-CE1 3.97Å; C116-M139 HydrophobicContact CB-CE 3.97Å; C116-M139 HydrophobicContact CB-CG 4.33Å; C116-M139 VanDerWaalsContact O-CE 3.31Å; C116-M139 WeakPolarHBondContact O-CE 3.2Å
117	Y	95.9	Very high	93.9	Very high	48 Å²	48	61 Å²	61	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-70.1	-38.7	176.9	-175.2	-96.5	0	0	0	113	N115 L120 T121 R155 L156	N115-Y117 VanDerWaalsContact C-N 3.25Å; N115-Y117 PolarHBondContact O-N 3.41Å; N115-Y117 VanDerWaalsContact O-N 3.12Å; Y117-L120 WeakPolarHBondContact O-CB 3.39Å; Y117-L120 PolarHBondContact O-N 2.85Å; Y117-T121 PolarHBondContact O-N 3.34Å; Y117-T121 PolarHBondContact O-OG1 3.12Å; Y117-R155 HydrophobicContact CD2-CB 4.23Å; Y117-R155 HydrophobicContact CE1-CB 3.96Å; Y117-R155 HydrophobicContact CE2-CB 3.56Å; Y117-R155 VanDerWaalsContact CZ-CB 3.41Å; Y117-R155 WeakPolarHBondContact OH-CB 3.47Å; Y117-R155 PolarHBondContact OH-O 3.15Å; Y117-L156 HydrophobicContact CD2-CD2 3.97Å; Y117-L156 HydrophobicContact CE2-CD2 4.02Å
118	E	93.4	Very high	93.9	Very high	96 Å²	96	61.3 Å²	61.3	45%	0.449	29%	0.288	S	S	.	.	H	α-helix	trans	-65.2	-45.2	177.8	-60	-175.6	165.4	0	0	110.1	N115 L120 T121 I122	N115-E118 WeakPolarHBondContact O-CB 3.44Å; N115-E118 PolarHBondContact O-N 2.78Å; E118-L120 VanDerWaalsContact C-N 3.33Å; E118-L120 PolarHBondContact O-N 3.43Å; E118-T121 WeakPolarHBondContact O-CB 3.48Å; E118-T121 PolarHBondContact O-N 3.09Å; E118-T121 VanDerWaalsContact O-N 3.09Å; E118-I122 WeakPolarHBondContact O-CG1 3.23Å; E118-I122 PolarHBondContact O-N 3.44Å
119	I	94.3	Very high	94	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-44	175.6	-63.3	-178.8	0	0	0	110.7	M107 I111 N115 T121 I122 A123 L131	M107-I119 HydrophobicContact CE-CB 4.48Å; M107-I119 HydrophobicContact CE-CD1 3.84Å; M107-I119 HydrophobicContact CE-CG1 3.61Å; M107-I119 HydrophobicContact CE-CG2 4.35Å; I111-I119 HydrophobicContact CB-CD1 4.33Å; I111-I119 HydrophobicContact CD1-CG2 4.4Å; I111-I119 HydrophobicContact CG1-CD1 3.75Å; I111-I119 HydrophobicContact CG1-CG2 4.36Å; N115-I119 WeakPolarHBondContact O-CG1 3.45Å; N115-I119 PolarHBondContact O-N 2.9Å; N115-I119 WeakPolarHBondContact OD1-CD1 3.34Å; I119-T121 VanDerWaalsContact C-N 3.28Å; I119-T121 PolarHBondContact O-N 3Å; I119-I122 PolarHBondContact O-N 2.98Å; I119-A123 WeakPolarHBondContact O-CB 3.22Å; I119-A123 PolarHBondContact O-N 3.32Å; I119-L131 HydrophobicContact CG2-CD1 3.82Å; I119-L131 HydrophobicContact CG2-CD2 4.1Å; I119-L131 HydrophobicContact CG2-CG 3.96Å
120	L	96.3	Very high	94.1	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-41.1	174.2	177.7	62.3	0	0	0	112	C116 Y117 E118 A123 K124 K132 A135 Y136 M139 L156	C116-L120 WeakPolarHBondContact O-CB 3.46Å; C116-L120 PolarHBondContact O-N 3.26Å; Y117-L120 WeakPolarHBondContact O-CB 3.39Å; Y117-L120 PolarHBondContact O-N 2.85Å; E118-L120 VanDerWaalsContact C-N 3.33Å; E118-L120 PolarHBondContact O-N 3.43Å; L120-A123 PolarHBondContact O-N 3.33Å; L120-K124 HydrophobicContact CD1-CD 4.47Å; L120-K124 HydrophobicContact CG-CD 4.32Å; L120-K124 WeakPolarHBondContact O-CG 3.19Å; L120-K124 PolarHBondContact O-N 2.8Å; L120-K132 HydrophobicContact CD1-CB 4.47Å; L120-K132 HydrophobicContact CD1-CG 3.75Å; L120-A135 HydrophobicContact CB-CB 4.02Å; L120-A135 HydrophobicContact CD1-CB 4.2Å; L120-Y136 HydrophobicContact CD1-CD1 4.28Å; L120-Y136 HydrophobicContact CD1-CD2 4.33Å; L120-Y136 HydrophobicContact CD1-CE1 3.82Å; L120-Y136 HydrophobicContact CD1-CE2 3.9Å; L120-Y136 HydrophobicContact CD1-CG 4.49Å; L120-Y136 HydrophobicContact CD2-CD1 4.14Å; L120-Y136 HydrophobicContact CD2-CE1 3.47Å; L120-Y136 VanDerWaalsContact CD2-CE1 3.47Å; L120-Y136 HydrophobicContact CG-CE1 4.3Å; L120-M139 HydrophobicContact CB-CE 3.93Å; L120-M139 HydrophobicContact CD2-CE 3.7Å; L120-M139 HydrophobicContact CD2-SD 4.29Å; L120-M139 HydrophobicContact CG-CE 4.42Å; L120-L156 HydrophobicContact CD2-CD2 3.94Å
121	T	95.3	Very high	94.3	Very high	61 Å²	61	57 Å²	57	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-66.3	-44	179.2	-59	0	0	0	0	111.4	Y117 E118 I119 K124 K125	Y117-T121 PolarHBondContact O-N 3.34Å; Y117-T121 PolarHBondContact O-OG1 3.12Å; E118-T121 WeakPolarHBondContact O-CB 3.48Å; E118-T121 PolarHBondContact O-N 3.09Å; E118-T121 VanDerWaalsContact O-N 3.09Å; I119-T121 VanDerWaalsContact C-N 3.28Å; I119-T121 PolarHBondContact O-N 3Å; T121-K124 PolarHBondContact O-N 3.33Å; T121-K125 WeakPolarHBondContact O-CB 3.43Å; T121-K125 PolarHBondContact O-N 3.32Å
122	I	92.8	Very high	94.4	Very high	23 Å²	23	59.8 Å²	59.8	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-48.1	173.8	-69.4	157.7	0	0	0	110	V84 V85 E118 I119 K124 K125 Q126	V84-I122 HydrophobicContact CG1-CD1 3.66Å; V84-I122 HydrophobicContact CG1-CG1 4.42Å; V84-I122 HydrophobicContact CG1-CG2 4.18Å; V84-I122 HydrophobicContact CG2-CG2 4.27Å; V85-I122 HydrophobicContact CG2-CG1 4.29Å; V85-I122 HydrophobicContact CG2-CG2 4.3Å; E118-I122 WeakPolarHBondContact O-CG1 3.23Å; E118-I122 PolarHBondContact O-N 3.44Å; I119-I122 PolarHBondContact O-N 2.98Å; I122-K124 VanDerWaalsContact C-N 3.32Å; I122-K124 PolarHBondContact O-N 3.3Å; I122-K125 PolarHBondContact O-N 3.38Å; I122-Q126 HydrophobicContact CG2-CG 4.4Å; I122-Q126 WeakPolarHBondContact O-CB 3.31Å; I122-Q126 PolarHBondContact O-N 3.43Å
123	A	95.1	Very high	94.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-42.1	179.9	0	0	0	0	0	112.1	I119 L120 R127 L128 L131 K132	I119-A123 WeakPolarHBondContact O-CB 3.22Å; I119-A123 PolarHBondContact O-N 3.32Å; L120-A123 PolarHBondContact O-N 3.33Å; A123-R127 WeakPolarHBondContact O-CA 3.44Å; A123-R127 PolarHBondContact O-N 2.79Å; A123-L128 HydrophobicContact CB-CB 4.36Å; A123-L128 PolarHBondContact O-N 2.93Å; A123-L131 HydrophobicContact CB-CB 4.09Å; A123-L131 HydrophobicContact CB-CD2 4.09Å; A123-L131 HydrophobicContact CB-CG 3.98Å; A123-K132 HydrophobicContact CB-CB 3.88Å
124	K	95.4	Very high	94.7	Very high	68 Å²	68	60 Å²	60	30%	0.296	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-50	174.5	-73.4	171.2	-175.7	168.3	0	112	L120 T121 I122 Q126 R127 K132 Y136 E160	L120-K124 HydrophobicContact CD1-CD 4.47Å; L120-K124 HydrophobicContact CG-CD 4.32Å; L120-K124 WeakPolarHBondContact O-CG 3.19Å; L120-K124 PolarHBondContact O-N 2.8Å; T121-K124 PolarHBondContact O-N 3.33Å; I122-K124 VanDerWaalsContact C-N 3.32Å; I122-K124 PolarHBondContact O-N 3.3Å; K124-Q126 VanDerWaalsContact C-N 3.29Å; K124-Q126 PolarHBondContact O-N 2.97Å; K124-R127 PolarHBondContact O-N 3.4Å; K124-R127 VanDerWaalsContact O-N 3.14Å; K124-K132 HydrophobicContact CG-CD 4.4Å; K124-Y136 WeakPolarHBondContact CE-OH 3.31Å; K124-Y136 PolarHBondContact NZ-OH 3.49Å; K124-E160 WeakPolarHBondContact CE-OE1 3.48Å; K124-E160 IonicContact NZ-OE1 3.76Å; K124-E160 PolarHBondContact NZ-OE1 3.04Å; K124-E160 IonicContact NZ-OE2 2.78Å; K124-E160 PolarHBondContact NZ-OE2 3.12Å
125	K	92.8	Very high	94.9	Very high	159 Å²	159	53.2 Å²	53.2	69%	0.691	25%	0.251	S	S	*	.	H	α-helix	trans	-60.8	-39.5	-178.7	-173.1	177.3	-180	-178.6	0	111.8	T121 I122	T121-K125 WeakPolarHBondContact O-CB 3.43Å; T121-K125 PolarHBondContact O-N 3.32Å; I122-K125 PolarHBondContact O-N 3.38Å
126	Q	92	Very high	95.1	Very high	24 Å²	24	52 Å²	52	11%	0.112	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.3	180	-67.5	-62.3	-23.1	0	0	114	I88 T89 K92 I122 K124 L128	I88-Q126 HydrophobicContact CG2-CB 4.39Å; I88-Q126 HydrophobicContact CG2-CG 4.36Å; T89-Q126 PolarHBondContact OG1-NE2 2.92Å; K92-Q126 PolarHBondContact NZ-O 3.02Å; I122-Q126 HydrophobicContact CG2-CG 4.4Å; I122-Q126 WeakPolarHBondContact O-CB 3.31Å; I122-Q126 PolarHBondContact O-N 3.43Å; K124-Q126 VanDerWaalsContact C-N 3.29Å; K124-Q126 PolarHBondContact O-N 2.97Å; Q126-L128 VanDerWaalsContact C-N 3.3Å; Q126-L128 HydrophobicContact CB-CD1 3.73Å; Q126-L128 HydrophobicContact CB-CD2 4.29Å; Q126-L128 HydrophobicContact CB-CG 3.66Å; Q126-L128 PolarHBondContact O-N 3.31Å
127	R	93.7	Very high	95.2	Very high	226 Å²	226	58.1 Å²	58.1	85%	0.853	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	41.6	-177.4	-55.1	-178.3	-179.2	-174.4	-0.5	113.3	A123 K124 S129	A123-R127 WeakPolarHBondContact O-CA 3.44Å; A123-R127 PolarHBondContact O-N 2.79Å; K124-R127 PolarHBondContact O-N 3.4Å; K124-R127 VanDerWaalsContact O-N 3.14Å; R127-S129 PolarHBondContact O-N 2.9Å
128	L	93.4	Very high	95.3	Very high	12 Å²	12	57.8 Å²	57.8	6%	0.063	27%	0.266	C	S	.	.			trans	-93.9	93	179.8	-52.9	172.5	0	0	0	109.2	I88 V100 M104 A123 Q126 E130 L131 K132	I88-L128 HydrophobicContact CD1-CD1 3.52Å; I88-L128 HydrophobicContact CG2-CD1 4.37Å; I88-L128 HydrophobicContact CG2-CD2 4.27Å; V100-L128 HydrophobicContact CG1-CD2 4.33Å; M104-L128 HydrophobicContact CG-CD1 4.2Å; M104-L128 HydrophobicContact SD-CB 4.33Å; M104-L128 HydrophobicContact SD-CD1 4.49Å; M104-L128 HydrophobicContact SD-CD2 3.9Å; M104-L128 HydrophobicContact SD-CG 4.44Å; A123-L128 HydrophobicContact CB-CB 4.36Å; A123-L128 PolarHBondContact O-N 2.93Å; Q126-L128 VanDerWaalsContact C-N 3.3Å; Q126-L128 HydrophobicContact CB-CD1 3.73Å; Q126-L128 HydrophobicContact CB-CD2 4.29Å; Q126-L128 HydrophobicContact CB-CG 3.66Å; Q126-L128 PolarHBondContact O-N 3.31Å; L128-E130 PolarHBondContact O-N 3.28Å; L128-L131 HydrophobicContact CB-CB 4.16Å; L128-L131 HydrophobicContact CD1-CD2 4.12Å; L128-K132 VanDerWaalsContact O-CB 3.23Å; L128-K132 WeakPolarHBondContact O-CB 3.18Å; L128-K132 PolarHBondContact O-N 3.25Å; L128-K132 VanDerWaalsContact O-N 3.07Å
129	S	95.1	Very high	95.5	Very high	83 Å²	83	53.2 Å²	53.2	58%	0.58	25%	0.245	S	C	*	.	H	α-helix	trans	-64.5	-39.3	-173.2	-67.7	0	0	0	0	113.6	R127 E133	R127-S129 PolarHBondContact O-N 2.9Å; S129-E133 WeakPolarHBondContact O-CB 3.17Å; S129-E133 PolarHBondContact O-N 3.44Å
130	E	95.1	Very high	95.6	Very high	114 Å²	114	53.1 Å²	53.1	53%	0.533	25%	0.245	S	C	.	.	H	α-helix	trans	-68.3	-50.7	-179.6	-61	175.4	-174.7	0	0	111.5	Q101 M104 L128 K132 E133 T134	Q101-E130 PolarHBondContact NE2-OE2 3.1Å; M104-E130 HydrophobicContact CE-CB 3.63Å; M104-E130 HydrophobicContact CE-CG 4.25Å; M104-E130 WeakPolarHBondContact CE-OE2 3.42Å; L128-E130 PolarHBondContact O-N 3.28Å; E130-K132 VanDerWaalsContact C-N 3.27Å; E130-K132 PolarHBondContact O-N 3.49Å; E130-E133 CarbonylContact O-C 3.55Å; E130-E133 WeakPolarHBondContact O-CA 3.39Å; E130-E133 WeakPolarHBondContact O-CB 3.24Å; E130-E133 PolarHBondContact O-N 3.45Å; E130-T134 PolarHBondContact O-N 3.49Å; E130-T134 PolarHBondContact O-OG1 3.03Å; E130-T134 VanDerWaalsContact O-OG1 3.11Å
131	L	95.3	Very high	95.7	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-60.7	-38.2	177.7	-177.2	62.5	0	0	0	111.9	M104 M107 S108 I119 A123 L128 E133 T134 A135	M104-L131 HydrophobicContact CG-CB 4.47Å; M107-L131 HydrophobicContact CB-CD1 4.02Å; M107-L131 HydrophobicContact CB-CD2 4.19Å; S108-L131 WeakPolarHBondContact OG-CD1 3.34Å; I119-L131 HydrophobicContact CG2-CD1 3.82Å; I119-L131 HydrophobicContact CG2-CD2 4.1Å; I119-L131 HydrophobicContact CG2-CG 3.96Å; A123-L131 HydrophobicContact CB-CB 4.09Å; A123-L131 HydrophobicContact CB-CD2 4.09Å; A123-L131 HydrophobicContact CB-CG 3.98Å; L128-L131 HydrophobicContact CB-CB 4.16Å; L128-L131 HydrophobicContact CD1-CD2 4.12Å; L131-E133 VanDerWaalsContact C-N 3.32Å; L131-E133 PolarHBondContact O-N 2.92Å; L131-T134 PolarHBondContact O-N 3.04Å; L131-A135 WeakPolarHBondContact O-CB 3.4Å; L131-A135 PolarHBondContact O-N 3.31Å
132	K	96.9	Very high	95.7	Very high	74 Å²	74	54.1 Å²	54.1	32%	0.322	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-44.7	173.8	179.2	-168.3	71.5	-177	0	111	L120 A123 K124 L128 E130 A135 Y136	L120-K132 HydrophobicContact CD1-CB 4.47Å; L120-K132 HydrophobicContact CD1-CG 3.75Å; A123-K132 HydrophobicContact CB-CB 3.88Å; K124-K132 HydrophobicContact CG-CD 4.4Å; L128-K132 VanDerWaalsContact O-CB 3.23Å; L128-K132 WeakPolarHBondContact O-CB 3.18Å; L128-K132 PolarHBondContact O-N 3.25Å; L128-K132 VanDerWaalsContact O-N 3.07Å; E130-K132 VanDerWaalsContact C-N 3.27Å; E130-K132 PolarHBondContact O-N 3.49Å; K132-A135 PolarHBondContact O-N 2.85Å; K132-Y136 HydrophobicContact CD-CE2 4.13Å; K132-Y136 HydrophobicContact CG-CD2 4.09Å; K132-Y136 HydrophobicContact CG-CE2 3.66Å; K132-Y136 VanDerWaalsContact O-CD2 3.24Å; K132-Y136 WeakPolarHBondContact O-CD2 3.36Å; K132-Y136 PolarHBondContact O-N 2.97Å; K132-Y136 VanDerWaalsContact O-N 3.1Å
133	E	96.8	Very high	96	Very high	43 Å²	43	53.2 Å²	53.2	20%	0.201	24%	0.243	C	C	.	.	H	α-helix	trans	-67.2	-42.4	178.4	175.6	62	-163.6	0	0	111.5	S129 E130 L131 A135 Y136 R137 K167	S129-E133 WeakPolarHBondContact O-CB 3.17Å; S129-E133 PolarHBondContact O-N 3.44Å; E130-E133 CarbonylContact O-C 3.55Å; E130-E133 WeakPolarHBondContact O-CA 3.39Å; E130-E133 WeakPolarHBondContact O-CB 3.24Å; E130-E133 PolarHBondContact O-N 3.45Å; L131-E133 VanDerWaalsContact C-N 3.32Å; L131-E133 PolarHBondContact O-N 2.92Å; E133-A135 VanDerWaalsContact C-N 3.33Å; E133-A135 PolarHBondContact O-N 2.89Å; E133-Y136 PolarHBondContact O-N 3.26Å; E133-R137 WeakPolarHBondContact O-CG 3.38Å; E133-R137 PolarHBondContact O-N 3.39Å; E133-R137 IonicContact OE1-CZ 3.62Å; E133-R137 VanDerWaalsContact OE1-CZ 3.26Å; E133-R137 IonicContact OE1-NE 3.3Å; E133-R137 PolarHBondContact OE1-NE 2.85Å; E133-R137 IonicContact OE1-NH2 3.28Å; E133-R137 PolarHBondContact OE1-NH2 2.92Å; E133-K167 WeakPolarHBondContact OE1-CE 3.32Å; E133-K167 IonicContact OE1-NZ 2.55Å; E133-K167 PolarHBondContact OE1-NZ 3.11Å; E133-K167 VanDerWaalsContact OE2-CE 3.25Å; E133-K167 WeakPolarHBondContact OE2-CE 3.42Å; E133-K167 IonicContact OE2-NZ 3.45Å; E133-K167 PolarHBondContact OE2-NZ 3.04Å
134	T	96.8	Very high	96	Very high	43 Å²	43	53.8 Å²	53.8	26%	0.264	25%	0.246	S	C	.	.	H	α-helix	trans	-59.7	-42.8	173.7	-53.7	0	0	0	0	111.6	I111 E130 L131 Y136 R137 F138	I111-T134 HydrophobicContact CD1-CG2 3.83Å; E130-T134 PolarHBondContact O-N 3.49Å; E130-T134 PolarHBondContact O-OG1 3.03Å; E130-T134 VanDerWaalsContact O-OG1 3.11Å; L131-T134 PolarHBondContact O-N 3.04Å; T134-Y136 PolarHBondContact O-N 3.02Å; T134-R137 PolarHBondContact O-N 3.42Å; T134-F138 WeakPolarHBondContact O-CB 3.39Å; T134-F138 PolarHBondContact O-N 3.25Å
135	A	97.8	Very high	96	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-42.3	176.4	0	0	0	0	0	112.3	I111 L120 L131 K132 E133 F138 M139	I111-A135 HydrophobicContact CD1-CB 4.47Å; L120-A135 HydrophobicContact CB-CB 4.02Å; L120-A135 HydrophobicContact CD1-CB 4.2Å; L131-A135 WeakPolarHBondContact O-CB 3.4Å; L131-A135 PolarHBondContact O-N 3.31Å; K132-A135 PolarHBondContact O-N 2.85Å; E133-A135 VanDerWaalsContact C-N 3.33Å; E133-A135 PolarHBondContact O-N 2.89Å; A135-F138 PolarHBondContact O-N 2.76Å; A135-M139 WeakPolarHBondContact O-CG 3.31Å; A135-M139 PolarHBondContact O-N 3.35Å
136	Y	98.1	Very high	96.2	Very high	13 Å²	13	48.2 Å²	48.2	5%	0.051	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-38.5	174.9	-73.7	-48.8	0	0	0	113	L120 K124 K132 E133 T134 M139 S140 E160 L163 V164	L120-Y136 HydrophobicContact CD1-CD1 4.28Å; L120-Y136 HydrophobicContact CD1-CD2 4.33Å; L120-Y136 HydrophobicContact CD1-CE1 3.82Å; L120-Y136 HydrophobicContact CD1-CE2 3.9Å; L120-Y136 HydrophobicContact CD1-CG 4.49Å; L120-Y136 HydrophobicContact CD2-CD1 4.14Å; L120-Y136 HydrophobicContact CD2-CE1 3.47Å; L120-Y136 VanDerWaalsContact CD2-CE1 3.47Å; L120-Y136 HydrophobicContact CG-CE1 4.3Å; K124-Y136 WeakPolarHBondContact CE-OH 3.31Å; K124-Y136 PolarHBondContact NZ-OH 3.49Å; K132-Y136 HydrophobicContact CD-CE2 4.13Å; K132-Y136 HydrophobicContact CG-CD2 4.09Å; K132-Y136 HydrophobicContact CG-CE2 3.66Å; K132-Y136 VanDerWaalsContact O-CD2 3.24Å; K132-Y136 WeakPolarHBondContact O-CD2 3.36Å; K132-Y136 PolarHBondContact O-N 2.97Å; K132-Y136 VanDerWaalsContact O-N 3.1Å; E133-Y136 PolarHBondContact O-N 3.26Å; T134-Y136 PolarHBondContact O-N 3.02Å; Y136-M139 HydrophobicContact CD1-SD 4.48Å; Y136-M139 PolarHBondContact O-N 2.85Å; Y136-S140 WeakPolarHBondContact O-CB 3.34Å; Y136-S140 PolarHBondContact O-N 3.3Å; Y136-E160 HydrophobicContact CE1-CB 4.35Å; Y136-E160 HydrophobicContact CE1-CG 4.26Å; Y136-E160 WeakPolarHBondContact OH-CG 3.32Å; Y136-L163 HydrophobicContact CD2-CD2 3.83Å; Y136-L163 HydrophobicContact CE2-CD2 3.78Å; Y136-L163 HydrophobicContact CG-CD2 4.22Å; Y136-V164 HydrophobicContact CD1-CG2 3.83Å
137	R	96.9	Very high	96.4	Very high	129 Å²	129	47.6 Å²	47.6	49%	0.487	22%	0.221	S	C	.	.	H	α-helix	trans	-62.3	-47.5	174.2	-72.7	176.5	-168.6	150.4	-1.2	111	E133 T134 M139 S140 D141	E133-R137 WeakPolarHBondContact O-CG 3.38Å; E133-R137 PolarHBondContact O-N 3.39Å; E133-R137 IonicContact OE1-CZ 3.62Å; E133-R137 VanDerWaalsContact OE1-CZ 3.26Å; E133-R137 IonicContact OE1-NE 3.3Å; E133-R137 PolarHBondContact OE1-NE 2.85Å; E133-R137 IonicContact OE1-NH2 3.28Å; E133-R137 PolarHBondContact OE1-NH2 2.92Å; T134-R137 PolarHBondContact O-N 3.42Å; R137-M139 VanDerWaalsContact C-N 3.31Å; R137-M139 PolarHBondContact O-N 3.04Å; R137-S140 CarbonylContact O-C 3.57Å; R137-S140 WeakPolarHBondContact O-CA 3.35Å; R137-S140 WeakPolarHBondContact O-CB 3.25Å; R137-S140 PolarHBondContact O-N 2.98Å; R137-D141 PolarHBondContact O-N 3.08Å
138	F	97.6	Very high	96.5	Very high	40 Å²	40	40 Å²	40	18%	0.175	19%	0.194	C	C	.	.	H	α-helix	trans	-55.9	-45.3	175.7	179.5	-86.7	0	0	0	112.4	I111 T112 P113 C116 T134 A135 S140 D141 N142	I111-F138 HydrophobicContact CB-CD2 4.12Å; I111-F138 HydrophobicContact CB-CE2 4.48Å; I111-F138 HydrophobicContact CB-CG 4.24Å; I111-F138 HydrophobicContact CG2-CB 3.86Å; I111-F138 HydrophobicContact CG2-CD1 3.46Å; I111-F138 VanDerWaalsContact CG2-CD1 3.46Å; I111-F138 HydrophobicContact CG2-CD2 3.67Å; I111-F138 HydrophobicContact CG2-CE1 3.91Å; I111-F138 HydrophobicContact CG2-CE2 4.07Å; I111-F138 HydrophobicContact CG2-CG 3.35Å; I111-F138 HydrophobicContact CG2-CZ 4.19Å; I111-F138 WeakPolarHBondContact O-CE2 3.29Å; T112-F138 VanDerWaalsContact C-CE1 3.48Å; T112-F138 VanDerWaalsContact C-CZ 3.44Å; P113-F138 HydrophobicContact CG-CE1 4.45Å; P113-F138 HydrophobicContact CG-CZ 4.16Å; C116-F138 HydrophobicContact CB-CD1 3.74Å; C116-F138 HydrophobicContact CB-CE1 3.97Å; T134-F138 WeakPolarHBondContact O-CB 3.39Å; T134-F138 PolarHBondContact O-N 3.25Å; A135-F138 PolarHBondContact O-N 2.76Å; F138-S140 VanDerWaalsContact C-N 3.32Å; F138-S140 PolarHBondContact O-N 2.88Å; F138-D141 PolarHBondContact O-N 3.17Å; F138-N142 PolarHBondContact O-N 2.74Å; F138-N142 VanDerWaalsContact O-N 3.12Å; F138-N142 PolarHBondContact O-ND2 2.7Å
139	M	98.1	Very high	96.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-37.7	177.1	-69.5	175.9	-161.9	0	0	112.3	C116 L120 A135 Y136 R137 N142 F143 I146 L156 V164	C116-M139 HydrophobicContact CB-CE 3.97Å; C116-M139 HydrophobicContact CB-CG 4.33Å; C116-M139 VanDerWaalsContact O-CE 3.31Å; C116-M139 WeakPolarHBondContact O-CE 3.2Å; L120-M139 HydrophobicContact CB-CE 3.93Å; L120-M139 HydrophobicContact CD2-CE 3.7Å; L120-M139 HydrophobicContact CD2-SD 4.29Å; L120-M139 HydrophobicContact CG-CE 4.42Å; A135-M139 WeakPolarHBondContact O-CG 3.31Å; A135-M139 PolarHBondContact O-N 3.35Å; Y136-M139 HydrophobicContact CD1-SD 4.48Å; Y136-M139 PolarHBondContact O-N 2.85Å; R137-M139 VanDerWaalsContact C-N 3.31Å; R137-M139 PolarHBondContact O-N 3.04Å; M139-N142 CarbonylContact O-C 3.52Å; M139-F143 VanDerWaalsContact O-CA 3.26Å; M139-F143 WeakPolarHBondContact O-CA 3.45Å; M139-F143 PolarHBondContact O-N 2.63Å; M139-F143 VanDerWaalsContact O-N 3.11Å; M139-I146 HydrophobicContact CB-CG1 4.15Å; M139-I146 HydrophobicContact CG-CD1 4.31Å; M139-I146 HydrophobicContact CG-CG1 4.38Å; M139-I146 WeakPolarHBondContact O-CG1 3.38Å; M139-L156 HydrophobicContact SD-CD1 4.25Å; M139-L156 HydrophobicContact SD-CD2 4.15Å; M139-V164 HydrophobicContact CB-CG1 4.06Å; M139-V164 HydrophobicContact CB-CG2 4.17Å; M139-V164 HydrophobicContact SD-CG2 4.48Å
140	S	97.6	Very high	96.6	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-51.8	174.2	156.6	0	0	0	0	110.5	Y136 R137 F138 N142 F143 R168	Y136-S140 WeakPolarHBondContact O-CB 3.34Å; Y136-S140 PolarHBondContact O-N 3.3Å; R137-S140 CarbonylContact O-C 3.57Å; R137-S140 WeakPolarHBondContact O-CA 3.35Å; R137-S140 WeakPolarHBondContact O-CB 3.25Å; R137-S140 PolarHBondContact O-N 2.98Å; F138-S140 VanDerWaalsContact C-N 3.32Å; F138-S140 PolarHBondContact O-N 2.88Å; S140-N142 PolarHBondContact O-N 3.29Å; S140-N142 VanDerWaalsContact O-N 3.14Å; S140-F143 VanDerWaalsContact O-CB 3.24Å; S140-F143 WeakPolarHBondContact O-CB 3.41Å; S140-F143 PolarHBondContact O-N 2.76Å; S140-R168 WeakPolarHBondContact O-CD 3.43Å; S140-R168 WeakPolarHBondContact OG-CA 3.46Å; S140-R168 PolarHBondContact OG-N 3.17Å; S140-R168 VanDerWaalsContact OG-N 3.12Å
141	D	96.6	Very high	96.5	Very high	49 Å²	49	39.8 Å²	39.8	26%	0.262	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-29	-174.9	-60.3	-9	0	0	0	111.7	R137 F138 Y247 N271 I273 T274	R137-D141 PolarHBondContact O-N 3.08Å; F138-D141 PolarHBondContact O-N 3.17Å; D141-Y247 PolarHBondContact O-OH 3.2Å; D141-N271 PolarHBondContact O-ND2 3.01Å; D141-I273 HydrophobicContact CB-CG2 4.11Å; D141-T274 HydrophobicContact CB-CG2 4.48Å
142	N	96.8	Very high	96.5	Very high	33 Å²	33	39.9 Å²	39.9	18%	0.176	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	24.5	178.2	-60.4	-76	0	0	0	113.6	F138 M139 S140 L144 Q145 I146	F138-N142 PolarHBondContact O-N 2.74Å; F138-N142 VanDerWaalsContact O-N 3.12Å; F138-N142 PolarHBondContact O-ND2 2.7Å; M139-N142 CarbonylContact O-C 3.52Å; S140-N142 PolarHBondContact O-N 3.29Å; S140-N142 VanDerWaalsContact O-N 3.14Å; N142-L144 VanDerWaalsContact C-N 3.33Å; N142-L144 PolarHBondContact O-N 3.11Å; N142-L144 VanDerWaalsContact O-N 3.07Å; N142-Q145 WeakPolarHBondContact O-CB 3.48Å; N142-Q145 PolarHBondContact O-N 2.88Å; N142-I146 PolarHBondContact O-N 3.4Å; N142-I146 VanDerWaalsContact O-N 3.15Å
143	F	97.5	Very high	96.4	Very high	3 Å²	3	37.7 Å²	37.7	1%	0.013	19%	0.193	C	C	.	.	H	α-helix	trans	-48.8	-42.2	-167.4	-171.4	-118.5	0	0	0	115.8	M139 S140 Q145 I146 L147 Y153 V164 L165 R168 H245 Y247	M139-F143 VanDerWaalsContact O-CA 3.26Å; M139-F143 WeakPolarHBondContact O-CA 3.45Å; M139-F143 PolarHBondContact O-N 2.63Å; M139-F143 VanDerWaalsContact O-N 3.11Å; S140-F143 VanDerWaalsContact O-CB 3.24Å; S140-F143 WeakPolarHBondContact O-CB 3.41Å; S140-F143 PolarHBondContact O-N 2.76Å; F143-Q145 VanDerWaalsContact C-N 3.32Å; F143-Q145 PolarHBondContact O-N 3.4Å; F143-I146 PolarHBondContact O-N 2.79Å; F143-L147 HydrophobicContact CD1-CD1 3.68Å; F143-L147 HydrophobicContact CD1-CG 4.12Å; F143-L147 HydrophobicContact CD2-CG 4.47Å; F143-L147 HydrophobicContact CE1-CD1 3.41Å; F143-L147 VanDerWaalsContact CE1-CD1 3.41Å; F143-L147 HydrophobicContact CE1-CD2 4.18Å; F143-L147 HydrophobicContact CE1-CG 3.85Å; F143-L147 HydrophobicContact CE2-CD2 4.29Å; F143-L147 HydrophobicContact CE2-CG 4.22Å; F143-L147 HydrophobicContact CG-CD1 4.43Å; F143-L147 HydrophobicContact CG-CG 4.43Å; F143-L147 HydrophobicContact CZ-CD1 3.96Å; F143-L147 HydrophobicContact CZ-CD2 3.85Å; F143-L147 HydrophobicContact CZ-CG 3.91Å; F143-L147 WeakPolarHBondContact O-CB 3.5Å; F143-L147 WeakPolarHBondContact O-CG 3.29Å; F143-L147 PolarHBondContact O-N 3.35Å; F143-Y153 HydrophobicContact CE2-CE2 4.09Å; F143-Y153 HydrophobicContact CZ-CE2 4.45Å; F143-V164 HydrophobicContact CD2-CG1 3.65Å; F143-V164 HydrophobicContact CE2-CG1 3.92Å; F143-L165 HydrophobicContact CE1-CD1 3.96Å; F143-L165 HydrophobicContact CE2-CB 4.48Å; F143-L165 HydrophobicContact CZ-CB 4.21Å; F143-L165 HydrophobicContact CZ-CD1 4.04Å; F143-R168 HydrophobicContact CB-CG 4.39Å; F143-H245 HydrophobicContact CD1-CB 3.91Å; F143-H245 HydrophobicContact CE1-CB 4.01Å; F143-H245 AromaticContact CE1-CD2 3.79Å; F143-H245 AromaticContact CE1-CG 3.68Å; F143-H245 AromaticContact CE1-ND1 3.97Å; F143-Y247 HydrophobicContact CB-CE2 4.22Å; F143-Y247 PolarHBondContact N-OH 3.49Å; F143-Y247 VanDerWaalsContact N-OH 3.15Å
144	L	96.5	Very high	96.3	Very high	13 Å²	13	37.5 Å²	37.5	7%	0.068	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-34.2	178.7	-69.7	179.7	0	0	0	113.3	N142 L147 K148 Y247 F249 C269 P315	N142-L144 VanDerWaalsContact C-N 3.33Å; N142-L144 PolarHBondContact O-N 3.11Å; N142-L144 VanDerWaalsContact O-N 3.07Å; L144-L147 HydrophobicContact CD2-CD1 4.23Å; L144-K148 WeakPolarHBondContact O-CG 3.45Å; L144-Y247 HydrophobicContact CD1-CD1 3.81Å; L144-Y247 HydrophobicContact CD1-CD2 3.98Å; L144-Y247 HydrophobicContact CD1-CE1 3.93Å; L144-Y247 HydrophobicContact CD1-CE2 4.13Å; L144-Y247 HydrophobicContact CD1-CG 3.84Å; L144-Y247 HydrophobicContact CD2-CD2 4.39Å; L144-Y247 HydrophobicContact CD2-CE2 4.38Å; L144-Y247 HydrophobicContact CG-CD1 4.37Å; L144-Y247 HydrophobicContact CG-CD2 3.89Å; L144-Y247 HydrophobicContact CG-CE1 4.14Å; L144-Y247 HydrophobicContact CG-CE2 3.65Å; L144-Y247 HydrophobicContact CG-CG 4.27Å; L144-F249 HydrophobicContact CD1-CE1 4.05Å; L144-F249 HydrophobicContact CD1-CZ 3.75Å; L144-F249 HydrophobicContact CD2-CZ 4.27Å; L144-C269 HydrophobicContact CD1-CB 4.47Å; L144-P315 HydrophobicContact CD2-CB 4.26Å
145	Q	95.8	Very high	96.3	Very high	109 Å²	109	42.7 Å²	42.7	51%	0.509	22%	0.218	S	C	.	.	H	α-helix	trans	-71.4	-42.9	174.7	-64.2	178.7	11.7	0	0	110	N142 F143 L147 K148 D149	N142-Q145 WeakPolarHBondContact O-CB 3.48Å; N142-Q145 PolarHBondContact O-N 2.88Å; F143-Q145 VanDerWaalsContact C-N 3.32Å; F143-Q145 PolarHBondContact O-N 3.4Å; Q145-L147 VanDerWaalsContact C-N 3.34Å; Q145-L147 PolarHBondContact O-N 3.25Å; Q145-K148 PolarHBondContact O-N 3.3Å; Q145-D149 PolarHBondContact O-N 3.14Å
146	I	97	Very high	96.3	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-44.8	177.1	-58.7	-53.9	0	0	0	111	M139 N142 F143 K148 D149 V152 Y153	M139-I146 HydrophobicContact CB-CG1 4.15Å; M139-I146 HydrophobicContact CG-CD1 4.31Å; M139-I146 HydrophobicContact CG-CG1 4.38Å; M139-I146 WeakPolarHBondContact O-CG1 3.38Å; N142-I146 PolarHBondContact O-N 3.4Å; N142-I146 VanDerWaalsContact O-N 3.15Å; F143-I146 PolarHBondContact O-N 2.79Å; I146-K148 PolarHBondContact O-N 3.36Å; I146-D149 PolarHBondContact O-N 3.2Å; I146-D149 VanDerWaalsContact O-N 3.14Å; I146-V152 HydrophobicContact CD1-CG1 4.23Å; I146-V152 HydrophobicContact CG2-CG1 3.8Å; I146-Y153 HydrophobicContact CG2-CD2 4.14Å; I146-Y153 WeakPolarHBondContact O-CB 3.41Å
147	L	96.1	Very high	96.2	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.052	24%	0.236	C	C	.	.	H	α-helix	trans	-56.6	-35.2	178.5	-82.1	174.9	0	0	0	113.5	F143 L144 Q145 Y153 P315 R316	F143-L147 HydrophobicContact CD1-CD1 3.68Å; F143-L147 HydrophobicContact CD1-CG 4.12Å; F143-L147 HydrophobicContact CD2-CG 4.47Å; F143-L147 HydrophobicContact CE1-CD1 3.41Å; F143-L147 VanDerWaalsContact CE1-CD1 3.41Å; F143-L147 HydrophobicContact CE1-CD2 4.18Å; F143-L147 HydrophobicContact CE1-CG 3.85Å; F143-L147 HydrophobicContact CE2-CD2 4.29Å; F143-L147 HydrophobicContact CE2-CG 4.22Å; F143-L147 HydrophobicContact CG-CD1 4.43Å; F143-L147 HydrophobicContact CG-CG 4.43Å; F143-L147 HydrophobicContact CZ-CD1 3.96Å; F143-L147 HydrophobicContact CZ-CD2 3.85Å; F143-L147 HydrophobicContact CZ-CG 3.91Å; F143-L147 WeakPolarHBondContact O-CB 3.5Å; F143-L147 WeakPolarHBondContact O-CG 3.29Å; F143-L147 PolarHBondContact O-N 3.35Å; L144-L147 HydrophobicContact CD2-CD1 4.23Å; Q145-L147 VanDerWaalsContact C-N 3.34Å; Q145-L147 PolarHBondContact O-N 3.25Å; L147-Y153 HydrophobicContact CD2-CD1 4.26Å; L147-Y153 HydrophobicContact CD2-CD2 3.94Å; L147-Y153 HydrophobicContact CD2-CE1 3.86Å; L147-Y153 HydrophobicContact CD2-CE2 3.49Å; L147-Y153 VanDerWaalsContact CD2-CE2 3.49Å; L147-Y153 HydrophobicContact CD2-CG 4.29Å; L147-Y153 VanDerWaalsContact CD2-CZ 3.44Å; L147-Y153 HydrophobicContact CG-CE2 4.47Å; L147-P315 HydrophobicContact CD1-CB 4.33Å; L147-P315 HydrophobicContact CD1-CG 4.24Å; L147-R316 HydrophobicContact CB-CG 4.47Å; L147-R316 HydrophobicContact CD2-CG 4.13Å
148	K	95.6	Very high	96.2	Very high	66 Å²	66	41.3 Å²	41.3	29%	0.287	23%	0.233	S	C	.	.	H	α-helix	trans	-75.7	-26.4	-178.8	-69.8	176.3	-168.6	-161.5	0	112.9	L144 Q145 I146 P150 P315 D318	L144-K148 WeakPolarHBondContact O-CG 3.45Å; Q145-K148 PolarHBondContact O-N 3.3Å; I146-K148 PolarHBondContact O-N 3.36Å; K148-P150 VanDerWaalsContact O-CD 3.23Å; K148-P150 WeakPolarHBondContact O-CD 3.45Å; K148-P315 WeakPolarHBondContact CG-O 3.31Å; K148-D318 HydrophobicContact CD-CB 4.11Å; K148-D318 VanDerWaalsContact CE-OD1 3.24Å; K148-D318 WeakPolarHBondContact CE-OD1 3.26Å; K148-D318 HydrophobicContact CG-CB 4.25Å; K148-D318 IonicContact NZ-OD1 3.53Å; K148-D318 PolarHBondContact NZ-OD1 3.02Å; K148-D318 IonicContact NZ-OD2 3.63Å
149	D	95.8	Very high	96.2	Very high	55 Å²	55	43.6 Å²	43.6	29%	0.294	25%	0.254	S	S	.	.			trans	-91.3	107.7	-176.3	-171.5	-11.8	0	0	0	111.5	Q145 I146 A151 V152 Y153	Q145-D149 PolarHBondContact O-N 3.14Å; I146-D149 PolarHBondContact O-N 3.2Å; I146-D149 VanDerWaalsContact O-N 3.14Å; D149-A151 PolarHBondContact O-N 3.23Å; D149-A151 WeakPolarHBondContact OD1-CA 3.18Å; D149-A151 WeakPolarHBondContact OD1-CB 3.41Å; D149-A151 PolarHBondContact OD1-N 3.45Å; D149-V152 HydrophobicContact CB-CB 4.43Å; D149-V152 HydrophobicContact CB-CG2 4.45Å; D149-V152 PolarHBondContact O-N 3.43Å; D149-Y153 PolarHBondContact O-N 2.68Å
150	P	93.6	Very high	96.2	Very high	100 Å²	100	44.9 Å²	44.9	65%	0.649	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-24.7	177.8	-16.2	33	0	0	0	112.8	K148 V152 G154	K148-P150 VanDerWaalsContact O-CD 3.23Å; K148-P150 WeakPolarHBondContact O-CD 3.45Å; P150-V152 PolarHBondContact O-N 3.22Å; P150-G154 WeakPolarHBondContact O-CA 3.38Å; P150-G154 PolarHBondContact O-N 3.37Å; P150-G154 VanDerWaalsContact O-N 3.09Å
151	A	92.9	Very high	96.2	Very high	50 Å²	50	47.7 Å²	47.7	41%	0.413	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-25.9	178.4	0	0	0	0	0	112	D149 R155	D149-A151 PolarHBondContact O-N 3.23Å; D149-A151 WeakPolarHBondContact OD1-CA 3.18Å; D149-A151 WeakPolarHBondContact OD1-CB 3.41Å; D149-A151 PolarHBondContact OD1-N 3.45Å; A151-R155 WeakPolarHBondContact O-CD 3.24Å; A151-R155 VanDerWaalsContact O-CG 3.27Å; A151-R155 WeakPolarHBondContact O-CG 3.47Å; A151-R155 PolarHBondContact O-NE 3.25Å
152	V	95.5	Very high	96.2	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.024	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-68.3	173.8	-179.4	0	0	0	0	110.4	I146 D149 P150 G154 R155 L156	I146-V152 HydrophobicContact CD1-CG1 4.23Å; I146-V152 HydrophobicContact CG2-CG1 3.8Å; D149-V152 HydrophobicContact CB-CB 4.43Å; D149-V152 HydrophobicContact CB-CG2 4.45Å; D149-V152 PolarHBondContact O-N 3.43Å; P150-V152 PolarHBondContact O-N 3.22Å; V152-G154 VanDerWaalsContact C-N 3.32Å; V152-G154 PolarHBondContact O-N 2.92Å; V152-R155 PolarHBondContact O-N 3.28Å; V152-L156 PolarHBondContact O-N 3.28Å
153	Y	95.3	Very high	96.3	Very high	27 Å²	27	51.8 Å²	51.8	11%	0.106	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-68.2	-32.2	-170.5	-170.9	-94.4	0	0	0	113	F143 I146 L147 D149 R155 L156 R161 R316	F143-Y153 HydrophobicContact CE2-CE2 4.09Å; F143-Y153 HydrophobicContact CZ-CE2 4.45Å; I146-Y153 HydrophobicContact CG2-CD2 4.14Å; I146-Y153 WeakPolarHBondContact O-CB 3.41Å; L147-Y153 HydrophobicContact CD2-CD1 4.26Å; L147-Y153 HydrophobicContact CD2-CD2 3.94Å; L147-Y153 HydrophobicContact CD2-CE1 3.86Å; L147-Y153 HydrophobicContact CD2-CE2 3.49Å; L147-Y153 VanDerWaalsContact CD2-CE2 3.49Å; L147-Y153 HydrophobicContact CD2-CG 4.29Å; L147-Y153 VanDerWaalsContact CD2-CZ 3.44Å; L147-Y153 HydrophobicContact CG-CE2 4.47Å; D149-Y153 PolarHBondContact O-N 2.68Å; Y153-R155 PolarHBondContact O-N 2.83Å; Y153-L156 HydrophobicContact CD2-CD1 4.23Å; Y153-L156 PolarHBondContact O-N 3.2Å; Y153-R161 HydrophobicContact CD2-CG 4.31Å; Y153-R161 HydrophobicContact CE1-CG 4.25Å; Y153-R161 HydrophobicContact CE2-CB 4.17Å; Y153-R161 HydrophobicContact CE2-CG 3.75Å; Y153-R161 PolarHBondContact O-NE 3.37Å; Y153-R161 PolarHBondContact O-NH2 3.43Å; Y153-R316 VanDerWaalsContact CE1-CZ 3.46Å
154	G	94.9	Very high	96.3	Very high	39 Å²	39	51.6 Å²	51.6	40%	0.402	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-63.3	-29.2	174.3	0	0	0	0	0	113.1	P150 V152 R161	P150-G154 WeakPolarHBondContact O-CA 3.38Å; P150-G154 PolarHBondContact O-N 3.37Å; P150-G154 VanDerWaalsContact O-N 3.09Å; V152-G154 VanDerWaalsContact C-N 3.32Å; V152-G154 PolarHBondContact O-N 2.92Å; G154-R161 PolarHBondContact O-NH2 3.06Å
155	R	96.4	Very high	96.3	Very high	153 Å²	153	53.6 Å²	53.6	58%	0.577	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-92	-10.5	-179	-60.7	-169.9	-179.9	175.4	-1	114.9	Y117 A151 V152 Y153	Y117-R155 HydrophobicContact CD2-CB 4.23Å; Y117-R155 HydrophobicContact CE1-CB 3.96Å; Y117-R155 HydrophobicContact CE2-CB 3.56Å; Y117-R155 VanDerWaalsContact CZ-CB 3.41Å; Y117-R155 WeakPolarHBondContact OH-CB 3.47Å; Y117-R155 PolarHBondContact OH-O 3.15Å; A151-R155 WeakPolarHBondContact O-CD 3.24Å; A151-R155 VanDerWaalsContact O-CG 3.27Å; A151-R155 WeakPolarHBondContact O-CG 3.47Å; A151-R155 PolarHBondContact O-NE 3.25Å; V152-R155 PolarHBondContact O-N 3.28Å; Y153-R155 PolarHBondContact O-N 2.83Å
156	L	97.1	Very high	96.3	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.026	31%	0.307	C	S	.	.	S	Bend	trans	-70.6	140.3	171	-64.4	177.5	0	0	0	110.4	Y117 L120 M139 V152 Y153 E160 R161	Y117-L156 HydrophobicContact CD2-CD2 3.97Å; Y117-L156 HydrophobicContact CE2-CD2 4.02Å; L120-L156 HydrophobicContact CD2-CD2 3.94Å; M139-L156 HydrophobicContact SD-CD1 4.25Å; M139-L156 HydrophobicContact SD-CD2 4.15Å; V152-L156 PolarHBondContact O-N 3.28Å; Y153-L156 HydrophobicContact CD2-CD1 4.23Å; Y153-L156 PolarHBondContact O-N 3.2Å; L156-E160 WeakPolarHBondContact CA-OE2 3.48Å; L156-E160 HydrophobicContact CB-CB 4.1Å; L156-E160 HydrophobicContact CD2-CB 4.25Å; L156-R161 HydrophobicContact CB-CG 3.84Å; L156-R161 HydrophobicContact CD1-CG 4.46Å; L156-R161 VanDerWaalsContact O-CZ 3.31Å; L156-R161 PolarHBondContact O-NE 2.79Å; L156-R161 PolarHBondContact O-NH2 3.18Å; L156-R161 VanDerWaalsContact O-NH2 3.17Å
157	T	97.2	Very high	96.3	Very high	66 Å²	66	56.4 Å²	56.4	41%	0.405	31%	0.312	S	S	.	.			trans	-69.2	164.9	171.5	71.7	0	0	0	0	110.8	S159 E160 R161	T157-S159 VanDerWaalsContact C-N 3.33Å; T157-S159 PolarHBondContact O-N 2.83Å; T157-S159 PolarHBondContact OG1-OG 3.48Å; T157-E160 PolarHBondContact N-OE2 3.39Å; T157-E160 PolarHBondContact O-N 3.32Å; T157-E160 VanDerWaalsContact O-N 3.15Å; T157-E160 WeakPolarHBondContact OG1-CG 3.26Å; T157-E160 PolarHBondContact OG1-N 3.05Å; T157-R161 WeakPolarHBondContact O-CG 3.36Å; T157-R161 PolarHBondContact O-N 2.58Å
158	G	97.1	Very high	96.3	Very high	42 Å²	42	56 Å²	56	43%	0.433	31%	0.31	S	S	.	.	H	α-helix	trans	-55	-47.7	176.4	0	0	0	0	0	112.6	E160 R161 D162	G158-E160 VanDerWaalsContact C-N 3.27Å; G158-E160 PolarHBondContact O-N 2.94Å; G158-R161 PolarHBondContact O-N 3.11Å; G158-D162 VanDerWaalsContact O-CG 3.27Å; G158-D162 PolarHBondContact O-N 3.31Å
159	S	97.4	Very high	96.3	Very high	88 Å²	88	57 Å²	57	62%	0.615	32%	0.316	S	S	*	.	H	α-helix	trans	-64.8	-29.9	178.3	55.8	0	0	0	0	113.4	T157 L163	T157-S159 VanDerWaalsContact C-N 3.33Å; T157-S159 PolarHBondContact O-N 2.83Å; T157-S159 PolarHBondContact OG1-OG 3.48Å; S159-L163 VanDerWaalsContact O-CB 3.29Å; S159-L163 WeakPolarHBondContact O-CB 3.23Å; S159-L163 PolarHBondContact O-N 3.39Å
160	E	97.7	Very high	96.2	Very high	27 Å²	27	59.2 Å²	59.2	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-72.9	-40.1	175.2	-70.3	167.4	177.4	0	0	111.9	K124 Y136 L156 T157 G158 D162 L163 V164	K124-E160 WeakPolarHBondContact CE-OE1 3.48Å; K124-E160 IonicContact NZ-OE1 3.76Å; K124-E160 PolarHBondContact NZ-OE1 3.04Å; K124-E160 IonicContact NZ-OE2 2.78Å; K124-E160 PolarHBondContact NZ-OE2 3.12Å; Y136-E160 HydrophobicContact CE1-CB 4.35Å; Y136-E160 HydrophobicContact CE1-CG 4.26Å; Y136-E160 WeakPolarHBondContact OH-CG 3.32Å; L156-E160 WeakPolarHBondContact CA-OE2 3.48Å; L156-E160 HydrophobicContact CB-CB 4.1Å; L156-E160 HydrophobicContact CD2-CB 4.25Å; T157-E160 PolarHBondContact N-OE2 3.39Å; T157-E160 PolarHBondContact O-N 3.32Å; T157-E160 VanDerWaalsContact O-N 3.15Å; T157-E160 WeakPolarHBondContact OG1-CG 3.26Å; T157-E160 PolarHBondContact OG1-N 3.05Å; G158-E160 VanDerWaalsContact C-N 3.27Å; G158-E160 PolarHBondContact O-N 2.94Å; E160-D162 VanDerWaalsContact C-N 3.32Å; E160-L163 PolarHBondContact O-N 3.19Å; E160-V164 VanDerWaalsContact O-CG2 3.31Å; E160-V164 WeakPolarHBondContact O-CG2 3.29Å; E160-V164 PolarHBondContact O-N 3.01Å
161	R	97.6	Very high	96.1	Very high	62 Å²	62	56.3 Å²	56.3	23%	0.234	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-44.3	173.5	-66.7	172.5	-177.8	151.6	8.1	110.8	Y153 G154 L156 T157 G158 L163 V164 L165	Y153-R161 HydrophobicContact CD2-CG 4.31Å; Y153-R161 HydrophobicContact CE1-CG 4.25Å; Y153-R161 HydrophobicContact CE2-CB 4.17Å; Y153-R161 HydrophobicContact CE2-CG 3.75Å; Y153-R161 PolarHBondContact O-NE 3.37Å; Y153-R161 PolarHBondContact O-NH2 3.43Å; G154-R161 PolarHBondContact O-NH2 3.06Å; L156-R161 HydrophobicContact CB-CG 3.84Å; L156-R161 HydrophobicContact CD1-CG 4.46Å; L156-R161 VanDerWaalsContact O-CZ 3.31Å; L156-R161 PolarHBondContact O-NE 2.79Å; L156-R161 PolarHBondContact O-NH2 3.18Å; L156-R161 VanDerWaalsContact O-NH2 3.17Å; T157-R161 WeakPolarHBondContact O-CG 3.36Å; T157-R161 PolarHBondContact O-N 2.58Å; G158-R161 PolarHBondContact O-N 3.11Å; R161-L163 VanDerWaalsContact C-N 3.33Å; R161-L163 PolarHBondContact O-N 2.97Å; R161-V164 PolarHBondContact O-N 3.44Å; R161-L165 WeakPolarHBondContact O-CB 3.45Å; R161-L165 PolarHBondContact O-N 3.49Å
162	D	97.3	Very high	96	Very high	108 Å²	108	59.3 Å²	59.3	58%	0.578	31%	0.314	S	S	*	.	H	α-helix	trans	-63.6	-40	176.5	-64.5	-22.1	0	0	0	111.4	G158 E160 K166	G158-D162 VanDerWaalsContact O-CG 3.27Å; G158-D162 PolarHBondContact O-N 3.31Å; E160-D162 VanDerWaalsContact C-N 3.32Å; D162-K166 WeakPolarHBondContact O-CB 3.34Å; D162-K166 PolarHBondContact O-N 3.16Å
163	L	97.8	Very high	96	Very high	59 Å²	59	65 Å²	65	31%	0.309	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-46.6	176.4	179	63.3	0	0	0	112.1	Y136 S159 E160 R161 L165 K166 K167	Y136-L163 HydrophobicContact CD2-CD2 3.83Å; Y136-L163 HydrophobicContact CE2-CD2 3.78Å; Y136-L163 HydrophobicContact CG-CD2 4.22Å; S159-L163 VanDerWaalsContact O-CB 3.29Å; S159-L163 WeakPolarHBondContact O-CB 3.23Å; S159-L163 PolarHBondContact O-N 3.39Å; E160-L163 PolarHBondContact O-N 3.19Å; R161-L163 VanDerWaalsContact C-N 3.33Å; R161-L163 PolarHBondContact O-N 2.97Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L163-K166 PolarHBondContact O-N 3.46Å; L163-K167 WeakPolarHBondContact O-CG 3.35Å; L163-K167 PolarHBondContact O-N 3.15Å
164	V	97.8	Very high	96	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-44.9	178.2	171.7	0	0	0	0	110.3	Y136 M139 F143 E160 R161 K167 R168	Y136-V164 HydrophobicContact CD1-CG2 3.83Å; M139-V164 HydrophobicContact CB-CG1 4.06Å; M139-V164 HydrophobicContact CB-CG2 4.17Å; M139-V164 HydrophobicContact SD-CG2 4.48Å; F143-V164 HydrophobicContact CD2-CG1 3.65Å; F143-V164 HydrophobicContact CE2-CG1 3.92Å; E160-V164 VanDerWaalsContact O-CG2 3.31Å; E160-V164 WeakPolarHBondContact O-CG2 3.29Å; E160-V164 PolarHBondContact O-N 3.01Å; R161-V164 PolarHBondContact O-N 3.44Å; V164-K167 PolarHBondContact O-N 3.36Å; V164-R168 PolarHBondContact O-N 3.04Å
165	L	96.7	Very high	96	Very high	55 Å²	55	62.5 Å²	62.5	29%	0.288	32%	0.318	S	S	.	.	H	α-helix	trans	-65.2	-41.9	176.4	178.3	59	0	0	0	111.7	F143 R161 L163 K167 R168 M169 H245	F143-L165 HydrophobicContact CE1-CD1 3.96Å; F143-L165 HydrophobicContact CE2-CB 4.48Å; F143-L165 HydrophobicContact CZ-CB 4.21Å; F143-L165 HydrophobicContact CZ-CD1 4.04Å; R161-L165 WeakPolarHBondContact O-CB 3.45Å; R161-L165 PolarHBondContact O-N 3.49Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L165-K167 VanDerWaalsContact C-N 3.34Å; L165-K167 PolarHBondContact O-N 3.12Å; L165-R168 WeakPolarHBondContact O-CB 3.36Å; L165-R168 PolarHBondContact O-N 3.41Å; L165-R168 VanDerWaalsContact O-N 3.15Å; L165-M169 HydrophobicContact CD1-CG 4.34Å; L165-M169 WeakPolarHBondContact O-CG 3.42Å; L165-M169 PolarHBondContact O-N 3.28Å; L165-H245 HydrophobicContact CD1-CB 4.43Å; L165-H245 WeakPolarHBondContact CD1-ND1 3.38Å
166	K	96.5	Very high	96	Very high	144 Å²	144	55.2 Å²	55.2	63%	0.626	29%	0.291	S	S	*	.	H	α-helix	trans	-57.1	-49.5	175.9	180	179.6	176.1	-179	0	110.6	D162 L163 R168 M169 E170	D162-K166 WeakPolarHBondContact O-CB 3.34Å; D162-K166 PolarHBondContact O-N 3.16Å; L163-K166 PolarHBondContact O-N 3.46Å; K166-R168 VanDerWaalsContact C-N 3.27Å; K166-R168 PolarHBondContact O-N 2.88Å; K166-M169 PolarHBondContact O-N 2.98Å; K166-M169 VanDerWaalsContact O-N 3.08Å; K166-E170 PolarHBondContact O-N 2.88Å; K166-E170 VanDerWaalsContact O-N 3.17Å
167	K	95.7	Very high	95.9	Very high	25 Å²	25	55 Å²	55	11%	0.109	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-40.7	175.8	-75.2	-176.9	179.5	-61.9	0	112.4	E133 L163 V164 L165 M169 E170	E133-K167 WeakPolarHBondContact OE1-CE 3.32Å; E133-K167 IonicContact OE1-NZ 2.55Å; E133-K167 PolarHBondContact OE1-NZ 3.11Å; E133-K167 VanDerWaalsContact OE2-CE 3.25Å; E133-K167 WeakPolarHBondContact OE2-CE 3.42Å; E133-K167 IonicContact OE2-NZ 3.45Å; E133-K167 PolarHBondContact OE2-NZ 3.04Å; L163-K167 WeakPolarHBondContact O-CG 3.35Å; L163-K167 PolarHBondContact O-N 3.15Å; V164-K167 PolarHBondContact O-N 3.36Å; L165-K167 VanDerWaalsContact C-N 3.34Å; L165-K167 PolarHBondContact O-N 3.12Å; K167-M169 PolarHBondContact O-N 3.48Å; K167-E170 VanDerWaalsContact O-CB 3.31Å; K167-E170 WeakPolarHBondContact O-CB 3.36Å; K167-E170 PolarHBondContact O-N 3.02Å; K167-E170 VanDerWaalsContact O-N 3.08Å
168	R	96	Very high	95.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-29.2	178.7	-174.8	52.6	171.9	103.5	11.2	113.4	S140 F143 V164 L165 K166 H245 N246 Y247 N271	S140-R168 WeakPolarHBondContact O-CD 3.43Å; S140-R168 WeakPolarHBondContact OG-CA 3.46Å; S140-R168 PolarHBondContact OG-N 3.17Å; S140-R168 VanDerWaalsContact OG-N 3.12Å; F143-R168 HydrophobicContact CB-CG 4.39Å; V164-R168 PolarHBondContact O-N 3.04Å; L165-R168 WeakPolarHBondContact O-CB 3.36Å; L165-R168 PolarHBondContact O-N 3.41Å; L165-R168 VanDerWaalsContact O-N 3.15Å; K166-R168 VanDerWaalsContact C-N 3.27Å; K166-R168 PolarHBondContact O-N 2.88Å; R168-H245 WeakPolarHBondContact CG-O 3.48Å; R168-N246 HydrophobicContact CG-CB 4.42Å; R168-N246 VanDerWaalsContact CZ-O 3.29Å; R168-N246 VanDerWaalsContact NH1-CG 3.28Å; R168-N246 PolarHBondContact NH1-ND2 3.01Å; R168-N246 PolarHBondContact NH1-O 2.75Å; R168-N246 VanDerWaalsContact NH1-O 3.15Å; R168-N246 VanDerWaalsContact NH2-C 3.28Å; R168-N246 PolarHBondContact NH2-O 2.63Å; R168-N246 WeakPolarHBondContact O-CB 3.4Å; R168-N246 PolarHBondContact O-ND2 3.21Å; R168-Y247 VanDerWaalsContact NH2-CE1 3.3Å; R168-Y247 VanDerWaalsContact NH2-CG 3.32Å; R168-N271 PolarHBondContact NH2-OD1 3.44Å
169	M	95.3	Very high	95.5	Very high	87 Å²	87	50 Å²	50	43%	0.429	25%	0.25	S	C	.	.	H	α-helix	trans	-91.7	-6.6	179	-57.7	-55.9	-61.7	0	0	113.4	L165 K166 K167 N246 S474	L165-M169 HydrophobicContact CD1-CG 4.34Å; L165-M169 WeakPolarHBondContact O-CG 3.42Å; L165-M169 PolarHBondContact O-N 3.28Å; K166-M169 PolarHBondContact O-N 2.98Å; K166-M169 VanDerWaalsContact O-N 3.08Å; K167-M169 PolarHBondContact O-N 3.48Å; M169-N246 HydrophobicContact CE-CB 4.37Å; M169-N246 HydrophobicContact SD-CB 3.77Å; M169-S474 PolarHBondContact O-OG 3.44Å; M169-S474 VanDerWaalsContact O-OG 3.09Å
170	E	93.9	Very high	95.1	Very high	102 Å²	102	46.5 Å²	46.5	48%	0.477	23%	0.225	S	C	.	.			trans	-63.1	158.5	175.3	-73	169.6	-173.5	0	0	111.4	K166 K167 S474	K166-E170 PolarHBondContact O-N 2.88Å; K166-E170 VanDerWaalsContact O-N 3.17Å; K167-E170 VanDerWaalsContact O-CB 3.31Å; K167-E170 WeakPolarHBondContact O-CB 3.36Å; K167-E170 PolarHBondContact O-N 3.02Å; K167-E170 VanDerWaalsContact O-N 3.08Å; E170-S474 WeakPolarHBondContact O-CB 3.46Å
171	G	91.8	Very high	94.4	Very high	39 Å²	39	46.4 Å²	46.4	40%	0.402	23%	0.226	S	C	.	.	S	Bend	trans	103	179.9	-175.7	0	0	0	0	0	113	L475	G171-L475 WeakPolarHBondContact CA-O 3.31Å
172	R	91.9	Very high	93	Very high	114 Å²	114	46.8 Å²	46.8	43%	0.43	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	121.7	-175.2	172.7	168.8	28.3	67.1	5.6	110.2	T174 S474 L475	R172-T174 PolarHBondContact O-N 3.39Å; R172-T174 PolarHBondContact O-OG1 3.32Å; R172-T174 VanDerWaalsContact O-OG1 3.07Å; R172-S474 WeakPolarHBondContact O-CA 3.3Å; R172-L475 PolarHBondContact N-O 3.07Å; R172-L475 PolarHBondContact O-N 2.83Å
173	K	94.4	Very high	91.2	Very high	123 Å²	123	43.8 Å²	43.8	54%	0.535	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	119.4	171.5	-67.8	-176.7	-178.5	-179.9	0	108.6	I429 V472	K173-I429 HydrophobicContact CB-CG2 4.4Å; K173-V472 HydrophobicContact CB-CG1 3.92Å; K173-V472 HydrophobicContact CG-CG1 4.39Å
174	T	94.8	Very high	89.1	Confident	9 Å²	9	47.2 Å²	47.2	6%	0.055	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.5	-176.5	-54.1	0	0	0	0	108.7	R172 M176 C216 F217 L473 L475	R172-T174 PolarHBondContact O-N 3.39Å; R172-T174 PolarHBondContact O-OG1 3.32Å; R172-T174 VanDerWaalsContact O-OG1 3.07Å; T174-M176 HydrophobicContact CG2-CE 4.43Å; T174-C216 HydrophobicContact CG2-CB 4.2Å; T174-F217 WeakPolarHBondContact CG2-O 3.46Å; T174-L473 PolarHBondContact N-O 3.33Å; T174-L473 PolarHBondContact O-N 2.92Å; T174-L475 HydrophobicContact CG2-CD1 4.23Å
175	L	96.1	Very high	86.5	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.5	170.9	-178.9	66.8	0	0	0	109	F217 W224 A427 I429 Y434 V436 T441 P470	L175-F217 HydrophobicContact CB-CB 4.06Å; L175-F217 HydrophobicContact CD2-CB 4.43Å; L175-F217 HydrophobicContact CG-CB 4.5Å; L175-F217 PolarHBondContact O-N 3.22Å; L175-W224 HydrophobicContact CD2-CH2 3.73Å; L175-W224 HydrophobicContact CD2-CZ2 4.15Å; L175-W224 HydrophobicContact CG-CH2 3.87Å; L175-A427 HydrophobicContact CD1-CB 3.84Å; L175-I429 HydrophobicContact CB-CD1 3.72Å; L175-I429 HydrophobicContact CD1-CD1 4.46Å; L175-Y434 HydrophobicContact CD1-CG 4.35Å; L175-Y434 HydrophobicContact CD2-CD1 3.6Å; L175-Y434 HydrophobicContact CD2-CE1 4.25Å; L175-Y434 HydrophobicContact CD2-CG 3.81Å; L175-V436 HydrophobicContact CD2-CG2 4.42Å; L175-T441 HydrophobicContact CD2-CG2 4.49Å; L175-P470 HydrophobicContact CD1-CB 4.28Å
176	M	95.9	Very high	83.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	160.4	178.4	-62.4	-179.5	-174.5	0	0	110.1	T174 Y215 C216 L227 P470 F471 L473 L475	T174-M176 HydrophobicContact CG2-CE 4.43Å; M176-Y215 CarbonylContact C-O 3.48Å; M176-Y215 WeakPolarHBondContact CA-O 3.24Å; M176-Y215 WeakPolarHBondContact CB-O 3.35Å; M176-C216 HydrophobicContact CG-CB 4.02Å; M176-L227 HydrophobicContact CE-CD2 3.8Å; M176-L227 HydrophobicContact SD-CD2 3.57Å; M176-L227 VanDerWaalsContact SD-CD2 3.57Å; M176-P470 CarbonylContact O-C 3.53Å; M176-P470 WeakPolarHBondContact O-CA 3.3Å; M176-F471 HydrophobicContact CB-CD1 4.46Å; M176-F471 HydrophobicContact CB-CD2 3.94Å; M176-F471 HydrophobicContact CB-CE1 4.04Å; M176-F471 HydrophobicContact CB-CE2 3.47Å; M176-F471 VanDerWaalsContact CB-CE2 3.47Å; M176-F471 HydrophobicContact CB-CG 4.41Å; M176-F471 HydrophobicContact CB-CZ 3.52Å; M176-F471 HydrophobicContact CG-CE2 4.12Å; M176-F471 HydrophobicContact CG-CZ 4.46Å; M176-F471 PolarHBondContact N-O 3.47Å; M176-F471 PolarHBondContact O-N 2.75Å; M176-F471 VanDerWaalsContact O-O 3.14Å; M176-F471 HydrophobicContact SD-CD2 4.43Å; M176-F471 HydrophobicContact SD-CE2 3.58Å; M176-F471 VanDerWaalsContact SD-CE2 3.58Å; M176-F471 HydrophobicContact SD-CZ 4.13Å; M176-L473 HydrophobicContact CE-CB 3.79Å; M176-L473 HydrophobicContact CE-CD1 4.41Å; M176-L473 HydrophobicContact SD-CB 3.91Å; M176-L473 HydrophobicContact SD-CD1 3.78Å; M176-L473 HydrophobicContact SD-CG 4.03Å; M176-L475 HydrophobicContact CE-CD1 3.63Å; M176-L475 HydrophobicContact CE-CD2 3.58Å; M176-L475 HydrophobicContact CE-CG 3.49Å; M176-L475 VanDerWaalsContact CE-CG 3.49Å
177	V	95.1	Very high	80.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	130.3	179.1	167.9	0	0	0	0	109.3	I214 Y215 W224 V436 P461 L468 F469 P470	V177-I214 CarbonylContact O-C 3.56Å; V177-I214 WeakPolarHBondContact O-CA 3.41Å; V177-Y215 PolarHBondContact N-O 3.08Å; V177-Y215 PolarHBondContact O-N 3.08Å; V177-W224 HydrophobicContact CB-CH2 4.19Å; V177-W224 HydrophobicContact CB-CZ3 3.83Å; V177-W224 HydrophobicContact CG2-CE3 4.42Å; V177-W224 HydrophobicContact CG2-CH2 3.27Å; V177-W224 HydrophobicContact CG2-CZ2 4.17Å; V177-W224 HydrophobicContact CG2-CZ3 3.42Å; V177-W224 VanDerWaalsContact CG2-CZ3 3.42Å; V177-V436 HydrophobicContact CG2-CB 4.44Å; V177-V436 HydrophobicContact CG2-CG1 3.86Å; V177-V436 HydrophobicContact CG2-CG2 4.43Å; V177-P461 HydrophobicContact CG1-CG 4.44Å; V177-L468 HydrophobicContact CG1-CB 3.57Å; V177-L468 HydrophobicContact CG1-CD1 4.12Å; V177-L468 HydrophobicContact CG1-CD2 3.57Å; V177-L468 HydrophobicContact CG1-CG 3.92Å; V177-F469 WeakPolarHBondContact CA-O 3.34Å; V177-P470 HydrophobicContact CG2-CB 4.04Å
178	A	94.3	Very high	77.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.3	165.4	0	0	0	0	0	109.1	I214 M230 I241 F469 F471	A178-I214 HydrophobicContact CB-CD1 4.49Å; A178-I214 HydrophobicContact CB-CG1 4.17Å; A178-M230 HydrophobicContact CB-CE 4.23Å; A178-I241 HydrophobicContact CB-CD1 4.05Å; A178-F469 PolarHBondContact N-O 3.29Å; A178-F469 PolarHBondContact O-N 3.37Å; A178-F471 HydrophobicContact CB-CE1 3.88Å
179	E	90.8	Very high	74.5	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.009	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	120.3	169.6	-168.7	173	178.6	0	0	109.6	S211 M213 M230 K465 G466 L468	E179-S211 VanDerWaalsContact CD-CB 3.44Å; E179-S211 WeakPolarHBondContact OE2-CB 3.46Å; E179-S211 PolarHBondContact OE2-OG 2.69Å; E179-M213 PolarHBondContact N-O 2.99Å; E179-M213 VanDerWaalsContact N-O 3.1Å; E179-M230 VanDerWaalsContact O-CE 3.3Å; E179-M230 WeakPolarHBondContact O-CE 3.47Å; E179-K465 PolarHBondContact OE1-N 2.74Å; E179-G466 PolarHBondContact OE1-N 3.04Å; E179-L468 HydrophobicContact CB-CD2 4.49Å; E179-L468 HydrophobicContact CG-CD2 4.45Å
180	V	89.4	Confident	71.3	Confident	15 Å²	15	74.2 Å²	74.2	9%	0.091	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	166.1	178.7	-67.5	0	0	0	0	109.9	I236 I241 G466 V467 F469	V180-I236 WeakPolarHBondContact CB-O 3.11Å; V180-I241 HydrophobicContact CG1-CD1 3.49Å; V180-I241 VanDerWaalsContact CG1-CD1 3.49Å; V180-G466 CarbonylContact O-C 3.56Å; V180-G466 WeakPolarHBondContact O-CA 3.45Å; V180-V467 HydrophobicContact CG2-CB 4.17Å; V180-V467 HydrophobicContact CG2-CG1 4.37Å; V180-V467 VanDerWaalsContact CG2-O 3.26Å; V180-V467 WeakPolarHBondContact CG2-O 3.37Å; V180-V467 PolarHBondContact N-O 2.86Å; V180-V467 WeakPolarHBondContact O-CA 3.39Å; V180-V467 PolarHBondContact O-N 3.38Å; V180-F469 HydrophobicContact CG2-CB 4.08Å
181	N	82.8	Confident	68.3	Low	26 Å²	26	74.9 Å²	74.9	14%	0.139	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-114.5	137	179.5	-76.7	-28.6	0	0	0	110.5	I236 K237 G238	N181-I236 PolarHBondContact N-O 2.8Å; N181-I236 WeakPolarHBondContact ND2-CD1 3.37Å; N181-K237 HydrophobicContact CB-CD 4.39Å; N181-K237 HydrophobicContact CB-CG 3.43Å; N181-K237 VanDerWaalsContact CB-CG 3.43Å; N181-K237 WeakPolarHBondContact O-CA 3.24Å; N181-G238 PolarHBondContact O-N 2.9Å
182	D	68.1	Low	65.6	Low	69 Å²	69	79 Å²	79	37%	0.369	42%	0.415	S	S	.	.			trans	-74.6	144	171.3	-156.5	-14.2	0	0	0	109.7	F184 V467	D182-F184 PolarHBondContact O-N 3.27Å; D182-F184 WeakPolarHBondContact OD1-CD2 3.06Å; D182-F184 PolarHBondContact OD1-N 2.84Å; D182-V467 HydrophobicContact CB-CG2 3.99Å
183	V	60.9	Low	63.1	Low	46 Å²	46	78.6 Å²	78.6	28%	0.279	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.9	175.3	174.3	0	0	0	0	110.5	K237 I254 Q289	V183-K237 HydrophobicContact CG2-CB 4.32Å; V183-I254 HydrophobicContact CG2-CG2 3.93Å; V183-Q289 HydrophobicContact CB-CG 4.24Å; V183-Q289 VanDerWaalsContact CB-NE2 3.25Å; V183-Q289 HydrophobicContact CG2-CG 4Å
184	F	53.6	Low	60.7	Low	130 Å²	130	84.4 Å²	84.4	57%	0.57	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	12.1	-174.5	-63.8	-71.8	0	0	0	116.4	D182 R186	D182-F184 PolarHBondContact O-N 3.27Å; D182-F184 WeakPolarHBondContact OD1-CD2 3.06Å; D182-F184 PolarHBondContact OD1-N 2.84Å; F184-R186 PolarHBondContact O-N 3.12Å
185	D	43.1	Very low	57.6	Low	141 Å²	141	90 Å²	90	75%	0.754	49%	0.486	S	S	*	.			trans	-70.5	61.5	165.1	-92.5	-23.7	0	0	0	110.8	V187	D185-V187 PolarHBondContact O-N 2.97Å
186	R	38.3	Very low	54.6	Low	190 Å²	190	93.1 Å²	93.1	72%	0.717	52%	0.52	S	S	*	.			trans	-76.2	104.4	159.2	-73.2	-173.4	-178.1	-175.3	0.9	107.1	F184 G188	F184-R186 PolarHBondContact O-N 3.12Å; R186-G188 VanDerWaalsContact C-N 3.33Å; R186-G188 PolarHBondContact O-N 2.88Å
187	V	32.4	Very low	52	Low	155 Å²	155	99 Å²	99	94%	0.939	56%	0.561	S	S	*	*	S	Bend	trans	-57.7	101.9	153.9	-178.6	0	0	0	0	107	D185	D185-V187 PolarHBondContact O-N 2.97Å
188	G	32.6	Very low	49.1	Very low	67 Å²	67	110.2 Å²	110.2	69%	0.691	60%	0.603	S	S	*	*			trans	89.9	76.8	169.7	0	0	0	0	0	116.1	R186 R190	R186-G188 VanDerWaalsContact C-N 3.33Å; R186-G188 PolarHBondContact O-N 2.88Å; G188-R190 PolarHBondContact O-N 3.19Å; G188-R190 VanDerWaalsContact O-N 3.09Å
189	S	29.8	Very low	46.4	Very low	97 Å²	97	116.4 Å²	116.4	68%	0.678	64%	0.643	S	S	*	*			trans	-77.5	85.4	161.9	-62.5	0	0	0	0	111
190	R	27.9	Very low	43.7	Very low	229 Å²	229	124.8 Å²	124.8	86%	0.864	68%	0.682	S	S	*	*			trans	-135.4	129.4	148.2	-88.3	-171.7	178.5	-178.7	0.1	108.3	G188	G188-R190 PolarHBondContact O-N 3.19Å; G188-R190 VanDerWaalsContact O-N 3.09Å
191	P	31.1	Very low	40.9	Very low	115 Å²	115	129 Å²	129	75%	0.747	71%	0.713	S	S	*	*			trans	-62.4	139.5	164.9	27.9	-30.9	0	0	0	107.8	S193	P191-S193 VanDerWaalsContact C-N 3.29Å; P191-S193 PolarHBondContact O-N 2.97Å
192	P	34.2	Very low	38.7	Very low	126 Å²	126	134 Å²	134	82%	0.818	75%	0.747	S	S	*	*			trans	-67.8	94.9	172.6	26.1	-29.4	0	0	0	108.1	R194	P192-R194 PolarHBondContact O-N 2.9Å
193	S	39.1	Very low	37.1	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	77%	0.768	S	S	*	*			trans	-56.1	120.3	153.2	54.2	0	0	0	0	106.8	P191 C195	P191-S193 VanDerWaalsContact C-N 3.29Å; P191-S193 PolarHBondContact O-N 2.97Å; S193-C195 PolarHBondContact O-N 3.41Å
194	R	44.4	Very low	35.7	Very low	245 Å²	245	141.4 Å²	141.4	93%	0.925	79%	0.792	S	S	*	*	S	Bend	trans	-46.8	108.2	172.5	-77.2	178.6	166.8	-173.3	-3.8	110	P192	P192-R194 PolarHBondContact O-N 2.9Å
195	C	29.1	Very low	34.9	Very low	128 Å²	128	142.1 Å²	142.1	87%	0.865	81%	0.807	S	S	*	*			trans	-169.3	113.5	153.7	-102.9	0	0	0	0	110.8	S193	S193-C195 PolarHBondContact O-N 3.41Å
196	G	34.3	Very low	34.5	Very low	70 Å²	70	138.3 Å²	138.3	72%	0.722	80%	0.801	S	S	*	*			trans	63.6	102.6	139.5	0	0	0	0	0	120.9
197	S	41.5	Very low	34.7	Very low	123 Å²	123	134.4 Å²	134.4	86%	0.86	80%	0.803	S	S	*	*				55.3	87.6	126	-42.6	0	0	0	0	120.3
198	R	33.7	Very low	35.7	Very low	235 Å²	235	130.2 Å²	130.2	89%	0.887	78%	0.781	S	S	*	*			trans	-168	137	135.9	-112.4	174.4	-176.5	-175.4	0.9	110.4	Q200	R198-Q200 PolarHBondContact O-N 3.07Å; R198-Q200 VanDerWaalsContact O-N 3.16Å
199	P	36.5	Very low	36.9	Very low	130 Å²	130	133.6 Å²	133.6	84%	0.844	78%	0.779	S	S	*	*			trans	-70.7	111.7	174.2	28.1	-30.1	0	0	0	108.7
200	Q	35.2	Very low	38.7	Very low	179 Å²	179	133.1 Å²	133.1	84%	0.836	77%	0.765	S	S	*	*			trans	-77.6	134.5	167.6	-81	-166.4	-30.9	0	0	109.4	R198	R198-Q200 PolarHBondContact O-N 3.07Å; R198-Q200 VanDerWaalsContact O-N 3.16Å
201	S	31.5	Very low	41	Very low	104 Å²	104	123.5 Å²	123.5	73%	0.727	73%	0.733	S	S	*	*			trans	-45.9	151.9	173.5	-46.2	0	0	0	0	112.7	L203	S201-L203 PolarHBondContact O-N 2.78Å; S201-L203 VanDerWaalsContact O-N 3.1Å
202	P	35.9	Very low	43.6	Very low	131 Å²	131	119.3 Å²	119.3	85%	0.851	70%	0.704	S	S	*	*			trans	-60.7	120	-175	25.5	-32.7	0	0	0	109.8	S204	P202-S204 PolarHBondContact O-N 2.9Å
203	L	33.7	Very low	46.3	Very low	155 Å²	155	115.4 Å²	115.4	81%	0.812	68%	0.675	S	S	*	*			trans	-52.4	121.1	172.1	-74.5	155.8	0	0	0	108.3	S201 V205	S201-L203 PolarHBondContact O-N 2.78Å; S201-L203 VanDerWaalsContact O-N 3.1Å; L203-V205 PolarHBondContact O-N 2.67Å
204	S	32.1	Very low	48.9	Very low	114 Å²	114	110.4 Å²	110.4	80%	0.797	64%	0.64	S	S	*	*			trans	-55.2	110.6	168.9	40.2	0	0	0	0	108.3	P202 G206	P202-S204 PolarHBondContact O-N 2.9Å; S204-G206 PolarHBondContact O-N 2.99Å
205	V	37	Very low	51.2	Low	145 Å²	145	100 Å²	100	88%	0.879	60%	0.601	S	S	*	*			trans	-66.1	79.4	162.2	-176.1	0	0	0	0	105.9	L203 S207	L203-V205 PolarHBondContact O-N 2.67Å; V205-S207 PolarHBondContact O-N 3.28Å
206	G	34.7	Very low	54.3	Low	61 Å²	61	94.8 Å²	94.8	63%	0.629	57%	0.566	S	S	*	*			trans	-69.9	98.8	170	0	0	0	0	0	107.1	S204 S208	S204-G206 PolarHBondContact O-N 2.99Å; G206-S208 PolarHBondContact O-N 3.31Å
207	S	42	Very low	57.1	Low	108 Å²	108	92.2 Å²	92.2	76%	0.755	53%	0.534	S	S	*	.			trans	-59.6	88.6	155.4	52.9	0	0	0	0	106.6	V205 E209	V205-S207 PolarHBondContact O-N 3.28Å; S207-E209 PolarHBondContact O-N 3.15Å; S207-E209 VanDerWaalsContact O-N 3.07Å
208	S	52.9	Low	59.4	Low	68 Å²	68	87.2 Å²	87.2	48%	0.476	50%	0.5	S	S	.	.			trans	-61.4	112.2	169.9	-154.5	0	0	0	0	105.6	G206 E210	G206-S208 PolarHBondContact O-N 3.31Å; S208-E210 PolarHBondContact O-N 3.14Å
209	E	58.2	Low	61.8	Low	138 Å²	138	82.1 Å²	82.1	65%	0.645	49%	0.486	S	S	*	.			trans	-56.7	109.4	175.4	-70.7	171.8	156.4	0	0	107.7	S207 S211 K465	S207-E209 PolarHBondContact O-N 3.15Å; S207-E209 VanDerWaalsContact O-N 3.07Å; E209-S211 PolarHBondContact O-N 2.73Å; E209-S211 VanDerWaalsContact O-N 3.14Å; E209-K465 IonicContact OE2-NZ 2.76Å; E209-K465 PolarHBondContact OE2-NZ 3.05Å
210	E	68.3	Low	64.2	Low	86 Å²	86	80.8 Å²	80.8	40%	0.402	49%	0.486	S	S	.	.			trans	-70.3	108.2	176.5	-70.1	-177.3	-176.8	0	0	107.4	S208 H212 I236 K237	S208-E210 PolarHBondContact O-N 3.14Å; E210-H212 PolarHBondContact O-CD2 2.86Å; E210-I236 HydrophobicContact CB-CD1 3.78Å; E210-I236 HydrophobicContact CG-CD1 4.21Å; E210-K237 VanDerWaalsContact OE1-CE 3.3Å; E210-K237 WeakPolarHBondContact OE1-CE 3.21Å; E210-K237 IonicContact OE1-NZ 3.71Å; E210-K237 PolarHBondContact OE1-NZ 2.81Å
211	S	76.4	Confident	66.7	Low	27 Å²	27	77.5 Å²	77.5	19%	0.189	47%	0.47	C	S	.	.			trans	-85.2	114.7	175.5	172	0	0	0	0	108.9	E179 E209 M213	E179-S211 VanDerWaalsContact CD-CB 3.44Å; E179-S211 WeakPolarHBondContact OE2-CB 3.46Å; E179-S211 PolarHBondContact OE2-OG 2.69Å; E209-S211 PolarHBondContact O-N 2.73Å; E209-S211 VanDerWaalsContact O-N 3.14Å; S211-M213 PolarHBondContact O-N 2.83Å; S211-M213 WeakPolarHBondContact OG-CG 3.26Å
212	H	86.1	Confident	69.3	Low	28 Å²	28	76 Å²	76	13%	0.13	45%	0.454	C	S	.	.			trans	-89.6	19.7	177.1	-72.5	-103.9	0	0	0	111.8	E210 V229 M230 P231 V234	E210-H212 PolarHBondContact O-CD2 2.86Å; H212-V229 HydrophobicContact CB-CG1 3.69Å; H212-V229 CarbonylContact O-C 3.54Å; H212-V229 WeakPolarHBondContact O-CA 3.29Å; H212-M230 HydrophobicContact CB-CB 3.98Å; H212-M230 WeakPolarHBondContact CB-O 3.48Å; H212-M230 WeakPolarHBondContact O-CG 3.23Å; H212-M230 PolarHBondContact O-N 2.95Å; H212-P231 PolarHBondContact ND1-O 3.4Å; H212-V234 PolarHBondContact CE1-O 2.78Å; H212-V234 VanDerWaalsContact CE1-O 3.27Å
213	M	90.8	Very high	71.9	Confident	43 Å²	43	71.6 Å²	71.6	21%	0.212	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	141.3	-169.8	-67	-54.7	-56.3	0	0	113.2	E179 S211 Y215 P226 V229	E179-M213 PolarHBondContact N-O 2.99Å; E179-M213 VanDerWaalsContact N-O 3.1Å; S211-M213 PolarHBondContact O-N 2.83Å; S211-M213 WeakPolarHBondContact OG-CG 3.26Å; M213-Y215 HydrophobicContact CB-CD2 4.33Å; M213-Y215 HydrophobicContact CB-CE2 3.55Å; M213-P226 HydrophobicContact CE-CB 3.69Å; M213-V229 HydrophobicContact CE-CG2 4.01Å; M213-V229 HydrophobicContact SD-CB 4.23Å; M213-V229 HydrophobicContact SD-CG1 4.12Å; M213-V229 HydrophobicContact SD-CG2 3.47Å; M213-V229 WeakPolarHBondContact SD-CG2 3.23Å
214	I	93.6	Very high	74.6	Confident	0 Å²	0	65 Å²	65	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.9	165.1	-61.3	-171.5	0	0	0	108.7	V177 A178 L227 T228 M230 L248 W277 F471	V177-I214 CarbonylContact O-C 3.56Å; V177-I214 WeakPolarHBondContact O-CA 3.41Å; A178-I214 HydrophobicContact CB-CD1 4.49Å; A178-I214 HydrophobicContact CB-CG1 4.17Å; I214-L227 HydrophobicContact CG2-CB 4.38Å; I214-L227 HydrophobicContact CG2-CD2 4.21Å; I214-L227 WeakPolarHBondContact O-CB 3.07Å; I214-L227 PolarHBondContact O-N 3.2Å; I214-T228 HydrophobicContact CB-CG2 4.03Å; I214-T228 HydrophobicContact CD1-CG2 4.05Å; I214-T228 HydrophobicContact CG1-CG2 4.32Å; I214-T228 PolarHBondContact N-O 2.75Å; I214-T228 PolarHBondContact O-N 3.21Å; I214-M230 HydrophobicContact CD1-CG 3.97Å; I214-M230 HydrophobicContact CD1-SD 4.45Å; I214-M230 HydrophobicContact CG1-CE 4.41Å; I214-M230 HydrophobicContact CG1-CG 4.04Å; I214-M230 HydrophobicContact CG1-SD 4.5Å; I214-L248 HydrophobicContact CD1-CD2 3.5Å; I214-W277 HydrophobicContact CD1-CH2 4Å; I214-W277 HydrophobicContact CD1-CZ2 3.61Å; I214-F471 HydrophobicContact CD1-CZ 4.34Å; I214-F471 HydrophobicContact CG2-CE1 4.29Å; I214-F471 HydrophobicContact CG2-CZ 3.72Å
215	Y	92.9	Very high	77.4	Confident	28 Å²	28	64.7 Å²	64.7	11%	0.11	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	147.7	178	-57.9	-92.6	0	0	0	110.9	M176 V177 M213 R225 P461	M176-Y215 CarbonylContact C-O 3.48Å; M176-Y215 WeakPolarHBondContact CA-O 3.24Å; M176-Y215 WeakPolarHBondContact CB-O 3.35Å; V177-Y215 PolarHBondContact N-O 3.08Å; V177-Y215 PolarHBondContact O-N 3.08Å; M213-Y215 HydrophobicContact CB-CD2 4.33Å; M213-Y215 HydrophobicContact CB-CE2 3.55Å; Y215-R225 CarbonylContact C-O 3.59Å; Y215-R225 VanDerWaalsContact CA-O 3.25Å; Y215-R225 WeakPolarHBondContact CA-O 3.46Å; Y215-P461 HydrophobicContact CD2-CB 4.27Å; Y215-P461 HydrophobicContact CG-CB 4.2Å
216	C	93.8	Very high	79.9	Confident	17 Å²	17	62.2 Å²	62.2	12%	0.115	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139.7	170	66.2	0	0	0	0	110.4	T174 M176 W224 R225 L227	T174-C216 HydrophobicContact CG2-CB 4.2Å; M176-C216 HydrophobicContact CG-CB 4.02Å; C216-W224 WeakPolarHBondContact O-CA 3.22Å; C216-R225 PolarHBondContact N-O 3.01Å; C216-R225 PolarHBondContact O-N 3.02Å; C216-L227 HydrophobicContact CB-CB 4.36Å
217	F	92.4	Very high	82.6	Confident	16 Å²	16	61.4 Å²	61.4	7%	0.07	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	126.9	177.3	-174.2	-109.1	0	0	0	110.2	T174 L175 E219 N222 W224 L458	T174-F217 WeakPolarHBondContact CG2-O 3.46Å; L175-F217 HydrophobicContact CB-CB 4.06Å; L175-F217 HydrophobicContact CD2-CB 4.43Å; L175-F217 HydrophobicContact CG-CB 4.5Å; L175-F217 PolarHBondContact O-N 3.22Å; F217-E219 HydrophobicContact CD1-CG 4.13Å; F217-E219 HydrophobicContact CE1-CG 4.03Å; F217-N222 WeakPolarHBondContact CZ-OD1 3.29Å; F217-W224 HydrophobicContact CB-CD2 4.24Å; F217-W224 HydrophobicContact CB-CE3 3.98Å; F217-W224 HydrophobicContact CB-CH2 4.01Å; F217-W224 HydrophobicContact CB-CZ2 4.27Å; F217-W224 HydrophobicContact CB-CZ3 3.87Å; F217-W224 HydrophobicContact CD2-CD2 4.02Å; F217-W224 AromaticContact CD2-CE2 3.71Å; F217-W224 HydrophobicContact CD2-CG 4.34Å; F217-W224 HydrophobicContact CD2-CZ2 4.06Å; F217-W224 AromaticContact CD2-NE1 3.79Å; F217-W224 HydrophobicContact CG-CZ2 4.47Å; F217-L458 HydrophobicContact CE1-CD1 4.2Å; F217-L458 HydrophobicContact CZ-CD1 3.84Å
218	S	89.7	Confident	85	Confident	18 Å²	18	57.3 Å²	57.3	13%	0.126	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	100.7	176.5	172.1	0	0	0	0	109.3	A220 E221 N222 D223 R225	S218-A220 PolarHBondContact O-N 3.41Å; S218-E221 PolarHBondContact O-N 3.07Å; S218-E221 VanDerWaalsContact O-N 3.1Å; S218-N222 WeakPolarHBondContact O-CA 3.4Å; S218-N222 PolarHBondContact O-N 2.89Å; S218-D223 WeakPolarHBondContact CB-O 3.2Å; S218-D223 PolarHBondContact N-O 3.02Å; S218-D223 PolarHBondContact O-N 3.42Å; S218-R225 PolarHBondContact OG-NH2 3.01Å; S218-R225 VanDerWaalsContact OG-NH2 3.12Å
219	E	85.4	Confident	87	Confident	129 Å²	129	57.8 Å²	57.8	60%	0.603	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-37.9	177.5	-66.6	-179.7	171.7	0	0	112.4	F217 E221 N222	F217-E219 HydrophobicContact CD1-CG 4.13Å; F217-E219 HydrophobicContact CE1-CG 4.03Å; E219-E221 VanDerWaalsContact C-N 3.26Å; E219-E221 PolarHBondContact O-N 3.39Å; E219-N222 PolarHBondContact O-N 3.09Å
220	A	86.4	Confident	88.7	Confident	101 Å²	101	51.4 Å²	51.4	84%	0.835	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.5	-179.7	0	0	0	0	0	114.1	S218	S218-A220 PolarHBondContact O-N 3.41Å
221	E	86.4	Confident	89.9	Confident	111 Å²	111	49.2 Å²	49.2	52%	0.519	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-7.4	179.7	-73.9	176.5	-174.7	0	0	112.3	S218 E219 D223 R225	S218-E221 PolarHBondContact O-N 3.07Å; S218-E221 VanDerWaalsContact O-N 3.1Å; E219-E221 VanDerWaalsContact C-N 3.26Å; E219-E221 PolarHBondContact O-N 3.39Å; E221-D223 HydrophobicContact CB-CB 4.28Å; E221-D223 PolarHBondContact O-N 3.08Å; E221-R225 IonicContact OE1-CZ 3.07Å; E221-R225 IonicContact OE1-NE 3.32Å; E221-R225 IonicContact OE1-NH1 3.29Å; E221-R225 IonicContact OE1-NH2 2.69Å; E221-R225 PolarHBondContact OE1-NH2 2.96Å; E221-R225 IonicContact OE2-CZ 2.72Å; E221-R225 IonicContact OE2-NE 2.69Å; E221-R225 PolarHBondContact OE2-NE 2.76Å; E221-R225 IonicContact OE2-NH2 3.86Å; E221-R225 PolarHBondContact OE2-NH2 2.82Å
222	N	86.9	Confident	90.5	Very high	71 Å²	71	56.6 Å²	56.6	38%	0.38	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	43.3	-168.2	-166.8	21.7	0	0	0	112.2	F217 S218 E219 L458	F217-N222 WeakPolarHBondContact CZ-OD1 3.29Å; S218-N222 WeakPolarHBondContact O-CA 3.4Å; S218-N222 PolarHBondContact O-N 2.89Å; E219-N222 PolarHBondContact O-N 3.09Å; N222-L458 WeakPolarHBondContact OD1-CD2 3.48Å
223	D	89.6	Confident	90.8	Very high	40 Å²	40	59.7 Å²	59.7	21%	0.214	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	165.5	-175.2	-152	-3.1	0	0	0	112.7	S218 E221	S218-D223 WeakPolarHBondContact CB-O 3.2Å; S218-D223 PolarHBondContact N-O 3.02Å; S218-D223 PolarHBondContact O-N 3.42Å; E221-D223 HydrophobicContact CB-CB 4.28Å; E221-D223 PolarHBondContact O-N 3.08Å
224	W	91	Very high	90.9	Very high	17 Å²	17	57.9 Å²	57.9	6%	0.064	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.7	-179.4	-65	86.5	0	0	0	111.5	L175 V177 C216 F217 V436 K459 A460 P461	L175-W224 HydrophobicContact CD2-CH2 3.73Å; L175-W224 HydrophobicContact CD2-CZ2 4.15Å; L175-W224 HydrophobicContact CG-CH2 3.87Å; V177-W224 HydrophobicContact CB-CH2 4.19Å; V177-W224 HydrophobicContact CB-CZ3 3.83Å; V177-W224 HydrophobicContact CG2-CE3 4.42Å; V177-W224 HydrophobicContact CG2-CH2 3.27Å; V177-W224 HydrophobicContact CG2-CZ2 4.17Å; V177-W224 HydrophobicContact CG2-CZ3 3.42Å; V177-W224 VanDerWaalsContact CG2-CZ3 3.42Å; C216-W224 WeakPolarHBondContact O-CA 3.22Å; F217-W224 HydrophobicContact CB-CD2 4.24Å; F217-W224 HydrophobicContact CB-CE3 3.98Å; F217-W224 HydrophobicContact CB-CH2 4.01Å; F217-W224 HydrophobicContact CB-CZ2 4.27Å; F217-W224 HydrophobicContact CB-CZ3 3.87Å; F217-W224 HydrophobicContact CD2-CD2 4.02Å; F217-W224 AromaticContact CD2-CE2 3.71Å; F217-W224 HydrophobicContact CD2-CG 4.34Å; F217-W224 HydrophobicContact CD2-CZ2 4.06Å; F217-W224 AromaticContact CD2-NE1 3.79Å; F217-W224 HydrophobicContact CG-CZ2 4.47Å; W224-V436 HydrophobicContact CZ2-CG1 4.42Å; W224-K459 PolarHBondContact NE1-O 2.87Å; W224-A460 VanDerWaalsContact CD1-C 3.5Å; W224-P461 HydrophobicContact CB-CB 4.06Å; W224-P461 HydrophobicContact CB-CG 4.42Å; W224-P461 VanDerWaalsContact CD1-N 3.32Å; W224-P461 HydrophobicContact CD2-CB 4.19Å; W224-P461 HydrophobicContact CD2-CG 3.57Å; W224-P461 HydrophobicContact CE3-CG 3.98Å; W224-P461 HydrophobicContact CG-CB 3.88Å; W224-P461 HydrophobicContact CG-CG 3.76Å; W224-P461 HydrophobicContact CZ2-CG 4.26Å; W224-P461 HydrophobicContact CZ3-CG 4.48Å
225	R	90.6	Very high	90.8	Very high	106 Å²	106	59 Å²	59	40%	0.4	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.7	175.8	-57.4	-168.9	-164.7	178.1	18.5	111	Y215 C216 S218 E221 L227	Y215-R225 CarbonylContact C-O 3.59Å; Y215-R225 VanDerWaalsContact CA-O 3.25Å; Y215-R225 WeakPolarHBondContact CA-O 3.46Å; C216-R225 PolarHBondContact N-O 3.01Å; C216-R225 PolarHBondContact O-N 3.02Å; S218-R225 PolarHBondContact OG-NH2 3.01Å; S218-R225 VanDerWaalsContact OG-NH2 3.12Å; E221-R225 IonicContact OE1-CZ 3.07Å; E221-R225 IonicContact OE1-NE 3.32Å; E221-R225 IonicContact OE1-NH1 3.29Å; E221-R225 IonicContact OE1-NH2 2.69Å; E221-R225 PolarHBondContact OE1-NH2 2.96Å; E221-R225 IonicContact OE2-CZ 2.72Å; E221-R225 IonicContact OE2-NE 2.69Å; E221-R225 PolarHBondContact OE2-NE 2.76Å; E221-R225 IonicContact OE2-NH2 3.86Å; E221-R225 PolarHBondContact OE2-NH2 2.82Å; R225-L227 PolarHBondContact O-N 2.81Å
226	P	90.4	Very high	90.7	Very high	94 Å²	94	57.8 Å²	57.8	61%	0.61	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	132.2	172.5	27.9	-33.7	0	0	0	110.1	M213	M213-P226 HydrophobicContact CE-CB 3.69Å
227	L	90.9	Very high	90.5	Very high	44 Å²	44	57.4 Å²	57.4	23%	0.23	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-54.7	178.4	178.9	67.1	0	0	0	111.4	M176 I214 C216 R225 Y270	M176-L227 HydrophobicContact CE-CD2 3.8Å; M176-L227 HydrophobicContact SD-CD2 3.57Å; M176-L227 VanDerWaalsContact SD-CD2 3.57Å; I214-L227 HydrophobicContact CG2-CB 4.38Å; I214-L227 HydrophobicContact CG2-CD2 4.21Å; I214-L227 WeakPolarHBondContact O-CB 3.07Å; I214-L227 PolarHBondContact O-N 3.2Å; C216-L227 HydrophobicContact CB-CB 4.36Å; R225-L227 PolarHBondContact O-N 2.81Å; L227-Y270 HydrophobicContact CD2-CE1 4.18Å
228	T	93.1	Very high	90.4	Very high	21 Å²	21	57 Å²	57	13%	0.129	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	166	-176.4	-166.9	0	0	0	0	110.3	I214 Y270 W277	I214-T228 HydrophobicContact CB-CG2 4.03Å; I214-T228 HydrophobicContact CD1-CG2 4.05Å; I214-T228 HydrophobicContact CG1-CG2 4.32Å; I214-T228 PolarHBondContact N-O 2.75Å; I214-T228 PolarHBondContact O-N 3.21Å; T228-Y270 HydrophobicContact CG2-CD2 4.26Å; T228-Y270 HydrophobicContact CG2-CE1 4.17Å; T228-Y270 HydrophobicContact CG2-CE2 3.82Å; T228-W277 HydrophobicContact CG2-CZ2 4.27Å
229	V	93.5	Very high	90.6	Very high	78 Å²	78	57.2 Å²	57.2	47%	0.473	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.9	173.8	-165.2	0	0	0	0	108.1	H212 M213 W277	H212-V229 HydrophobicContact CB-CG1 3.69Å; H212-V229 CarbonylContact O-C 3.54Å; H212-V229 WeakPolarHBondContact O-CA 3.29Å; M213-V229 HydrophobicContact CE-CG2 4.01Å; M213-V229 HydrophobicContact SD-CB 4.23Å; M213-V229 HydrophobicContact SD-CG1 4.12Å; M213-V229 HydrophobicContact SD-CG2 3.47Å; M213-V229 WeakPolarHBondContact SD-CG2 3.23Å; V229-W277 PolarHBondContact O-NE1 3.43Å; V229-W277 VanDerWaalsContact O-NE1 3.12Å
230	M	94.3	Very high	91.1	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.02	28%	0.283	C	S	.	.			trans	-65.9	142	170.7	-61.6	-177.6	-91.4	0	0	109.3	A178 E179 H212 I214 V234 I236 W277	A178-M230 HydrophobicContact CB-CE 4.23Å; E179-M230 VanDerWaalsContact O-CE 3.3Å; E179-M230 WeakPolarHBondContact O-CE 3.47Å; H212-M230 HydrophobicContact CB-CB 3.98Å; H212-M230 WeakPolarHBondContact CB-O 3.48Å; H212-M230 WeakPolarHBondContact O-CG 3.23Å; H212-M230 PolarHBondContact O-N 2.95Å; I214-M230 HydrophobicContact CD1-CG 3.97Å; I214-M230 HydrophobicContact CD1-SD 4.45Å; I214-M230 HydrophobicContact CG1-CE 4.41Å; I214-M230 HydrophobicContact CG1-CG 4.04Å; I214-M230 HydrophobicContact CG1-SD 4.5Å; M230-V234 HydrophobicContact CB-CB 4.34Å; M230-V234 HydrophobicContact CB-CG2 4.36Å; M230-V234 HydrophobicContact SD-CG1 4.31Å; M230-I236 HydrophobicContact CE-CG2 3.88Å; M230-I236 HydrophobicContact SD-CG2 4.39Å; M230-W277 HydrophobicContact CB-CH2 4.41Å; M230-W277 HydrophobicContact CB-CZ2 4.2Å; M230-W277 HydrophobicContact CG-CH2 3.71Å; M230-W277 HydrophobicContact CG-CZ2 3.58Å; M230-W277 HydrophobicContact SD-CH2 4.42Å
231	P	94.1	Very high	91.7	Very high	40 Å²	40	46.7 Å²	46.7	26%	0.26	25%	0.245	S	C	.	.			trans	-54.8	148.1	174.1	-25	32.4	0	0	0	112.2	H212 D233 V234 W277	H212-P231 PolarHBondContact ND1-O 3.4Å; P231-D233 PolarHBondContact O-N 2.83Å; P231-V234 HydrophobicContact CB-CG2 4.19Å; P231-V234 HydrophobicContact CG-CG2 4.29Å; P231-V234 VanDerWaalsContact O-CB 3.27Å; P231-V234 WeakPolarHBondContact O-CB 3.37Å; P231-V234 WeakPolarHBondContact O-CG2 3.42Å; P231-V234 PolarHBondContact O-N 2.82Å; P231-W277 HydrophobicContact CG-CB 3.72Å; P231-W277 HydrophobicContact CG-CD2 4.13Å; P231-W277 HydrophobicContact CG-CE3 4.46Å; P231-W277 HydrophobicContact CG-CG 3.81Å
232	E	89.4	Confident	92.2	Very high	183 Å²	183	42.2 Å²	42.2	86%	0.855	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.2	179.9	-63.7	-178.9	177.8	0	0	112.8	V234	E232-V234 PolarHBondContact O-N 2.96Å
233	D	90.8	Very high	92.7	Very high	93 Å²	93	40.9 Å²	40.9	50%	0.497	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-13.4	175	-81.1	-59.5	0	0	0	114.2	P231 N235 K266 F268	P231-D233 PolarHBondContact O-N 2.83Å; D233-N235 PolarHBondContact O-N 2.91Å; D233-K266 IonicContact OD1-NZ 2.78Å; D233-K266 PolarHBondContact OD1-NZ 3.04Å; D233-F268 HydrophobicContact CB-CE1 4.27Å; D233-F268 HydrophobicContact CB-CE2 4.39Å; D233-F268 HydrophobicContact CB-CZ 3.62Å
234	V	93.4	Very high	93.1	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.024	21%	0.213	C	C	.	.	S	Bend	trans	-77.5	115.7	177.7	177.9	0	0	0	0	109.2	H212 M230 P231 E232 I236 V250 F268	H212-V234 PolarHBondContact CE1-O 2.78Å; H212-V234 VanDerWaalsContact CE1-O 3.27Å; M230-V234 HydrophobicContact CB-CB 4.34Å; M230-V234 HydrophobicContact CB-CG2 4.36Å; M230-V234 HydrophobicContact SD-CG1 4.31Å; P231-V234 HydrophobicContact CB-CG2 4.19Å; P231-V234 HydrophobicContact CG-CG2 4.29Å; P231-V234 VanDerWaalsContact O-CB 3.27Å; P231-V234 WeakPolarHBondContact O-CB 3.37Å; P231-V234 WeakPolarHBondContact O-CG2 3.42Å; P231-V234 PolarHBondContact O-N 2.82Å; E232-V234 PolarHBondContact O-N 2.96Å; V234-I236 HydrophobicContact CG1-CG2 4.46Å; V234-I236 PolarHBondContact O-N 2.69Å; V234-I236 VanDerWaalsContact O-N 3.16Å; V234-V250 HydrophobicContact CG1-CB 4.23Å; V234-V250 HydrophobicContact CG1-CG1 3.59Å; V234-F268 HydrophobicContact CB-CD2 4.48Å; V234-F268 HydrophobicContact CG2-CB 4.1Å; V234-F268 HydrophobicContact CG2-CD1 4.18Å; V234-F268 HydrophobicContact CG2-CD2 3.56Å; V234-F268 HydrophobicContact CG2-CE2 3.97Å; V234-F268 HydrophobicContact CG2-CG 3.67Å; V234-F268 HydrophobicContact CG2-CZ 4.45Å
235	N	92.1	Very high	93.4	Very high	25 Å²	25	40.5 Å²	40.5	13%	0.134	22%	0.218	C	C	.	.			trans	-73	109.8	170.7	-58.6	-78.9	0	0	0	109.4	D233 K237 C239 S255 S264	D233-N235 PolarHBondContact O-N 2.91Å; N235-K237 VanDerWaalsContact C-N 3.25Å; N235-K237 PolarHBondContact O-N 2.96Å; N235-C239 WeakPolarHBondContact O-CB 3.37Å; N235-C239 PolarHBondContact O-SG 2.81Å; N235-C239 VanDerWaalsContact O-SG 3.41Å; N235-S255 WeakPolarHBondContact OD1-CB 3.26Å; N235-S255 PolarHBondContact OD1-N 3.47Å; N235-S255 PolarHBondContact OD1-OG 2.93Å; N235-S264 WeakPolarHBondContact ND2-CB 3.39Å; N235-S264 PolarHBondContact ND2-OG 2.97Å
236	I	90.2	Very high	93.7	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	20%	0.2	C	C	.	.			trans	-79.7	-7.3	178.4	62.4	171.1	0	0	0	113.3	V180 N181 E210 M230 V234	V180-I236 WeakPolarHBondContact CB-O 3.11Å; N181-I236 PolarHBondContact N-O 2.8Å; N181-I236 WeakPolarHBondContact ND2-CD1 3.37Å; E210-I236 HydrophobicContact CB-CD1 3.78Å; E210-I236 HydrophobicContact CG-CD1 4.21Å; M230-I236 HydrophobicContact CE-CG2 3.88Å; M230-I236 HydrophobicContact SD-CG2 4.39Å; V234-I236 HydrophobicContact CG1-CG2 4.46Å; V234-I236 PolarHBondContact O-N 2.69Å; V234-I236 VanDerWaalsContact O-N 3.16Å
237	K	90.1	Very high	94.1	Very high	10 Å²	10	31.5 Å²	31.5	4%	0.043	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-93.3	120.3	177.2	-72.7	171.8	-164	158.7	0	111.2	N181 V183 E210 N235 C239 G253 I254 Y257	N181-K237 HydrophobicContact CB-CD 4.39Å; N181-K237 HydrophobicContact CB-CG 3.43Å; N181-K237 VanDerWaalsContact CB-CG 3.43Å; N181-K237 WeakPolarHBondContact O-CA 3.24Å; V183-K237 HydrophobicContact CG2-CB 4.32Å; E210-K237 VanDerWaalsContact OE1-CE 3.3Å; E210-K237 WeakPolarHBondContact OE1-CE 3.21Å; E210-K237 IonicContact OE1-NZ 3.71Å; E210-K237 PolarHBondContact OE1-NZ 2.81Å; N235-K237 VanDerWaalsContact C-N 3.25Å; N235-K237 PolarHBondContact O-N 2.96Å; K237-C239 PolarHBondContact O-N 2.8Å; K237-G253 CarbonylContact O-C 3.59Å; K237-G253 WeakPolarHBondContact O-CA 3.05Å; K237-I254 HydrophobicContact CB-CG2 4.08Å; K237-I254 WeakPolarHBondContact CB-O 3.5Å; K237-I254 PolarHBondContact O-N 3.15Å; K237-Y257 WeakPolarHBondContact CE-OH 3.38Å; K237-Y257 PolarHBondContact NZ-OH 2.88Å
238	G	89.8	Confident	94.4	Very high	8 Å²	8	29.4 Å²	29.4	8%	0.082	16%	0.161	C	C	.	.	S	Bend	trans	60.5	23.2	176.1	0	0	0	0	0	114.3	N181 A288 Q289 L290	N181-G238 PolarHBondContact O-N 2.9Å; G238-A288 CarbonylContact O-C 3.5Å; G238-Q289 WeakPolarHBondContact O-CA 3.38Å; G238-Q289 PolarHBondContact O-N 2.89Å; G238-L290 WeakPolarHBondContact O-CD2 3.48Å
239	C	94.8	Very high	94.7	Very high	21 Å²	21	28.4 Å²	28.4	14%	0.142	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	159.4	171.8	59.2	0	0	0	0	111.5	N235 K237 V250 A251	N235-C239 WeakPolarHBondContact O-CB 3.37Å; N235-C239 PolarHBondContact O-SG 2.81Å; N235-C239 VanDerWaalsContact O-SG 3.41Å; K237-C239 PolarHBondContact O-N 2.8Å; C239-V250 HydrophobicContact CB-CG1 3.82Å; C239-A251 WeakPolarHBondContact CA-O 3.38Å; C239-A251 WeakPolarHBondContact CB-O 3.33Å
240	G	96.1	Very high	94.9	Very high	3 Å²	3	24.8 Å²	24.8	3%	0.031	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.8	170.5	0	0	0	0	0	109.3	V250 A251 L292	G240-V250 CarbonylContact O-C 3.58Å; G240-V250 WeakPolarHBondContact O-CA 3.41Å; G240-A251 PolarHBondContact N-O 2.92Å; G240-A251 PolarHBondContact O-N 3.42Å; G240-L292 WeakPolarHBondContact O-CD2 3.4Å
241	I	97.3	Very high	95.1	Very high	6 Å²	6	24.6 Å²	24.6	3%	0.031	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.1	179	-59.3	-175.2	0	0	0	109.7	A178 V180 L248 F249 V250 F469	A178-I241 HydrophobicContact CB-CD1 4.05Å; V180-I241 HydrophobicContact CG1-CD1 3.49Å; V180-I241 VanDerWaalsContact CG1-CD1 3.49Å; I241-L248 HydrophobicContact CG2-CD1 3.43Å; I241-L248 VanDerWaalsContact CG2-CD1 3.43Å; I241-L248 HydrophobicContact CG2-CG 4.34Å; I241-F249 VanDerWaalsContact CA-O 3.3Å; I241-F249 WeakPolarHBondContact CA-O 3.27Å; I241-V250 HydrophobicContact CG1-CG1 4.23Å; I241-V250 HydrophobicContact CG1-CG2 4.22Å; I241-F469 HydrophobicContact CB-CD1 3.76Å; I241-F469 HydrophobicContact CB-CD2 4.41Å; I241-F469 HydrophobicContact CB-CE1 3.62Å; I241-F469 HydrophobicContact CB-CE2 4.28Å; I241-F469 HydrophobicContact CB-CG 4.17Å; I241-F469 HydrophobicContact CB-CZ 3.89Å; I241-F469 HydrophobicContact CD1-CB 4.23Å; I241-F469 HydrophobicContact CD1-CD1 4.3Å; I241-F469 HydrophobicContact CD1-CG 4.17Å; I241-F469 HydrophobicContact CG2-CD1 3.62Å; I241-F469 HydrophobicContact CG2-CE1 3.56Å; I241-F469 HydrophobicContact CG2-CG 4.43Å; I241-F469 HydrophobicContact CG2-CZ 4.31Å; I241-F469 VanDerWaalsContact O-CZ 3.31Å; I241-F469 WeakPolarHBondContact O-CZ 3.15Å
242	C	97.4	Very high	95.2	Very high	17 Å²	17	22.9 Å²	22.9	12%	0.115	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	155	177.9	-173.1	0	0	0	0	111.5	F249 L292 V293 S294	C242-F249 PolarHBondContact N-O 2.82Å; C242-F249 PolarHBondContact O-N 2.87Å; C242-L292 HydrophobicContact CB-CB 4.09Å; C242-L292 HydrophobicContact CB-CD2 3.78Å; C242-L292 HydrophobicContact CB-CG 3.68Å; C242-L292 WeakPolarHBondContact CB-O 3.47Å; C242-V293 VanDerWaalsContact SG-CA 3.52Å; C242-S294 PolarHBondContact SG-N 3.09Å
243	T	98	Very high	95.4	Very high	44 Å²	44	14.2 Å²	14.2	27%	0.27	8%	0.081	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.4	169.8	61.2	0	0	0	0	111.7	Y247 L248 S294 F471 L473	T243-Y247 CarbonylContact C-O 3.58Å; T243-Y247 WeakPolarHBondContact CA-O 3.31Å; T243-L248 HydrophobicContact CG2-CD1 4.02Å; T243-S294 WeakPolarHBondContact O-CB 3.46Å; T243-S294 PolarHBondContact O-OG 2.79Å; T243-F471 HydrophobicContact CG2-CB 3.94Å; T243-F471 HydrophobicContact CG2-CD2 3.91Å; T243-F471 HydrophobicContact CG2-CG 4.26Å; T243-L473 HydrophobicContact CG2-CD2 3.79Å
244	M	97.8	Very high	95.5	Very high	10 Å²	10	11 Å²	11	5%	0.049	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	134.1	173.7	-176.8	-177.2	71.4	0	0	109.5	N246 Y247 F249 L299 P315	M244-N246 PolarHBondContact O-N 3.04Å; M244-N246 VanDerWaalsContact O-N 3.14Å; M244-Y247 PolarHBondContact N-O 2.9Å; M244-Y247 WeakPolarHBondContact O-CB 3.36Å; M244-Y247 PolarHBondContact O-N 3.33Å; M244-F249 HydrophobicContact CB-CD2 4.2Å; M244-F249 HydrophobicContact CB-CE2 3.71Å; M244-F249 HydrophobicContact CE-CE2 4.03Å; M244-F249 HydrophobicContact CE-CZ 3.8Å; M244-L299 HydrophobicContact CB-CD2 3.87Å; M244-L299 HydrophobicContact CE-CD1 4.44Å; M244-L299 HydrophobicContact CE-CD2 3.94Å; M244-L299 HydrophobicContact CE-CG 3.9Å; M244-L299 HydrophobicContact CG-CD2 4.4Å; M244-L299 HydrophobicContact SD-CD2 3.7Å; M244-L299 HydrophobicContact SD-CG 4.05Å; M244-P315 HydrophobicContact CE-CG 4.15Å
245	H	97	Very high	95.3	Very high	38 Å²	38	13.2 Å²	13.2	18%	0.176	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	38.4	-178.9	-56.8	-49.4	0	0	0	114	F143 L165 R168 Y247 G297	F143-H245 HydrophobicContact CD1-CB 3.91Å; F143-H245 HydrophobicContact CE1-CB 4.01Å; F143-H245 AromaticContact CE1-CD2 3.79Å; F143-H245 AromaticContact CE1-CG 3.68Å; F143-H245 AromaticContact CE1-ND1 3.97Å; L165-H245 HydrophobicContact CD1-CB 4.43Å; L165-H245 WeakPolarHBondContact CD1-ND1 3.38Å; R168-H245 WeakPolarHBondContact CG-O 3.48Å; H245-Y247 HydrophobicContact CB-CD2 4.17Å; H245-Y247 HydrophobicContact CB-CE2 4.48Å; H245-Y247 WeakPolarHBondContact O-CD2 3.19Å; H245-Y247 WeakPolarHBondContact O-CE2 3.45Å; H245-Y247 PolarHBondContact O-N 3.25Å; H245-G297 WeakPolarHBondContact NE2-CA 3.5Å
246	N	97.6	Very high	94.6	Very high	5 Å²	5	13.8 Å²	13.8	3%	0.027	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	26.9	-175.8	-165.5	26.8	0	0	0	114.2	R168 M169 M244 P272 L473 S474	R168-N246 HydrophobicContact CG-CB 4.42Å; R168-N246 VanDerWaalsContact CZ-O 3.29Å; R168-N246 VanDerWaalsContact NH1-CG 3.28Å; R168-N246 PolarHBondContact NH1-ND2 3.01Å; R168-N246 PolarHBondContact NH1-O 2.75Å; R168-N246 VanDerWaalsContact NH1-O 3.15Å; R168-N246 VanDerWaalsContact NH2-C 3.28Å; R168-N246 PolarHBondContact NH2-O 2.63Å; R168-N246 WeakPolarHBondContact O-CB 3.4Å; R168-N246 PolarHBondContact O-ND2 3.21Å; M169-N246 HydrophobicContact CE-CB 4.37Å; M169-N246 HydrophobicContact SD-CB 3.77Å; M244-N246 PolarHBondContact O-N 3.04Å; M244-N246 VanDerWaalsContact O-N 3.14Å; N246-P272 WeakPolarHBondContact O-CD 3.39Å; N246-P272 WeakPolarHBondContact O-CG 3.5Å; N246-L473 WeakPolarHBondContact OD1-CA 3.31Å; N246-L473 WeakPolarHBondContact OD1-CB 3.36Å; N246-S474 PolarHBondContact ND2-O 2.89Å; N246-S474 PolarHBondContact OD1-N 3.14Å; N246-S474 PolarHBondContact OD1-O 2.73Å
247	Y	98.3	Very high	93.5	Very high	7 Å²	7	21.2 Å²	21.2	3%	0.027	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	151.8	163.9	-63.5	-96	0	0	0	109.4	D141 F143 L144 R168 T243 M244 H245 Y270 N271	D141-Y247 PolarHBondContact O-OH 3.2Å; F143-Y247 HydrophobicContact CB-CE2 4.22Å; F143-Y247 PolarHBondContact N-OH 3.49Å; F143-Y247 VanDerWaalsContact N-OH 3.15Å; L144-Y247 HydrophobicContact CD1-CD1 3.81Å; L144-Y247 HydrophobicContact CD1-CD2 3.98Å; L144-Y247 HydrophobicContact CD1-CE1 3.93Å; L144-Y247 HydrophobicContact CD1-CE2 4.13Å; L144-Y247 HydrophobicContact CD1-CG 3.84Å; L144-Y247 HydrophobicContact CD2-CD2 4.39Å; L144-Y247 HydrophobicContact CD2-CE2 4.38Å; L144-Y247 HydrophobicContact CG-CD1 4.37Å; L144-Y247 HydrophobicContact CG-CD2 3.89Å; L144-Y247 HydrophobicContact CG-CE1 4.14Å; L144-Y247 HydrophobicContact CG-CE2 3.65Å; L144-Y247 HydrophobicContact CG-CG 4.27Å; R168-Y247 VanDerWaalsContact NH2-CE1 3.3Å; R168-Y247 VanDerWaalsContact NH2-CG 3.32Å; T243-Y247 CarbonylContact C-O 3.58Å; T243-Y247 WeakPolarHBondContact CA-O 3.31Å; M244-Y247 PolarHBondContact N-O 2.9Å; M244-Y247 WeakPolarHBondContact O-CB 3.36Å; M244-Y247 PolarHBondContact O-N 3.33Å; H245-Y247 HydrophobicContact CB-CD2 4.17Å; H245-Y247 HydrophobicContact CB-CE2 4.48Å; H245-Y247 WeakPolarHBondContact O-CD2 3.19Å; H245-Y247 WeakPolarHBondContact O-CE2 3.45Å; H245-Y247 PolarHBondContact O-N 3.25Å; Y247-Y270 WeakPolarHBondContact CA-O 3.4Å; Y247-Y270 WeakPolarHBondContact CD1-O 3.18Å; Y247-N271 HydrophobicContact CD1-CB 3.87Å; Y247-N271 HydrophobicContact CE1-CB 3.6Å; Y247-N271 WeakPolarHBondContact CE1-ND2 3.16Å
248	L	98.5	Very high	92.5	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.5	167.1	176.8	74.4	0	0	0	108.6	I214 I241 T243 C269 Y270 W277 F471 L473	I214-L248 HydrophobicContact CD1-CD2 3.5Å; I241-L248 HydrophobicContact CG2-CD1 3.43Å; I241-L248 VanDerWaalsContact CG2-CD1 3.43Å; I241-L248 HydrophobicContact CG2-CG 4.34Å; T243-L248 HydrophobicContact CG2-CD1 4.02Å; L248-C269 CarbonylContact O-C 3.56Å; L248-C269 WeakPolarHBondContact O-CA 3.2Å; L248-Y270 HydrophobicContact CB-CD1 4.5Å; L248-Y270 PolarHBondContact N-O 3.01Å; L248-Y270 VanDerWaalsContact N-O 3.13Å; L248-Y270 PolarHBondContact O-N 3.49Å; L248-W277 HydrophobicContact CD2-CH2 4.01Å; L248-F471 HydrophobicContact CD1-CD1 3.95Å; L248-F471 HydrophobicContact CD1-CD2 3.79Å; L248-F471 HydrophobicContact CD1-CE1 4.05Å; L248-F471 HydrophobicContact CD1-CE2 3.88Å; L248-F471 HydrophobicContact CD1-CG 3.83Å; L248-F471 HydrophobicContact CD1-CZ 4.01Å; L248-F471 HydrophobicContact CD2-CE1 4.03Å; L248-F471 HydrophobicContact CD2-CE2 4.03Å; L248-F471 HydrophobicContact CD2-CZ 3.63Å; L248-F471 HydrophobicContact CG-CE2 4.38Å; L248-F471 HydrophobicContact CG-CZ 4.38Å; L248-L473 HydrophobicContact CB-CD1 4.28Å
249	F	98.6	Very high	91.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.9	176.6	-64.7	-94.7	0	0	0	109.9	L144 I241 C242 M244 F268 C269 I280 L292 L299	L144-F249 HydrophobicContact CD1-CE1 4.05Å; L144-F249 HydrophobicContact CD1-CZ 3.75Å; L144-F249 HydrophobicContact CD2-CZ 4.27Å; I241-F249 VanDerWaalsContact CA-O 3.3Å; I241-F249 WeakPolarHBondContact CA-O 3.27Å; C242-F249 PolarHBondContact N-O 2.82Å; C242-F249 PolarHBondContact O-N 2.87Å; M244-F249 HydrophobicContact CB-CD2 4.2Å; M244-F249 HydrophobicContact CB-CE2 3.71Å; M244-F249 HydrophobicContact CE-CE2 4.03Å; M244-F249 HydrophobicContact CE-CZ 3.8Å; F249-F268 CarbonylContact C-O 3.51Å; F249-F268 WeakPolarHBondContact CA-O 3.47Å; F249-C269 HydrophobicContact CD1-CB 3.62Å; F249-C269 HydrophobicContact CE1-CB 3.59Å; F249-C269 HydrophobicContact CG-CB 4.34Å; F249-C269 HydrophobicContact CZ-CB 4.28Å; F249-I280 HydrophobicContact CD1-CD1 3.73Å; F249-I280 HydrophobicContact CE1-CD1 3.69Å; F249-L292 HydrophobicContact CB-CD2 3.97Å; F249-L299 HydrophobicContact CB-CD1 4.17Å; F249-L299 HydrophobicContact CD1-CD1 3.51Å; F249-L299 HydrophobicContact CD2-CD1 4.19Å; F249-L299 HydrophobicContact CD2-CD2 4.1Å; F249-L299 HydrophobicContact CE1-CD1 3.85Å; F249-L299 HydrophobicContact CE2-CD1 4.5Å; F249-L299 HydrophobicContact CE2-CD2 4.41Å; F249-L299 HydrophobicContact CG-CD1 3.68Å; F249-L299 HydrophobicContact CG-CD2 4.33Å; F249-L299 HydrophobicContact CZ-CD1 4.33Å
250	V	98.3	Very high	90.3	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123	173.9	-171.8	0	0	0	0	107.9	V234 C239 G240 I241 V267 F268 W277	V234-V250 HydrophobicContact CG1-CB 4.23Å; V234-V250 HydrophobicContact CG1-CG1 3.59Å; C239-V250 HydrophobicContact CB-CG1 3.82Å; G240-V250 CarbonylContact O-C 3.58Å; G240-V250 WeakPolarHBondContact O-CA 3.41Å; I241-V250 HydrophobicContact CG1-CG1 4.23Å; I241-V250 HydrophobicContact CG1-CG2 4.22Å; V250-V267 CarbonylContact O-C 3.56Å; V250-V267 WeakPolarHBondContact O-CA 3.22Å; V250-F268 PolarHBondContact N-O 3.19Å; V250-F268 PolarHBondContact O-N 3.3Å; V250-W277 HydrophobicContact CG2-CH2 4.18Å; V250-W277 HydrophobicContact CG2-CZ3 4.14Å
251	A	97.9	Very high	89.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.9	-174.6	0	0	0	0	0	111.8	C239 G240 V267 L283 L290 L292	C239-A251 WeakPolarHBondContact CA-O 3.38Å; C239-A251 WeakPolarHBondContact CB-O 3.33Å; G240-A251 PolarHBondContact N-O 2.92Å; G240-A251 PolarHBondContact O-N 3.42Å; A251-V267 HydrophobicContact CB-CG1 4.08Å; A251-V267 HydrophobicContact CB-CG2 3.95Å; A251-L283 HydrophobicContact CB-CD1 4.47Å; A251-L290 HydrophobicContact CB-CD1 4.2Å; A251-L290 WeakPolarHBondContact O-CD2 3.36Å; A251-L292 HydrophobicContact CB-CD1 4.29Å; A251-L292 HydrophobicContact CB-CD2 3.99Å
252	G	96.5	Very high	89.3	Confident	4 Å²	4	48.6 Å²	48.6	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	65.4	-136.1	171.4	0	0	0	0	0	113.9	S264 K266 R287	G252-S264 VanDerWaalsContact CA-O 3.31Å; G252-S264 WeakPolarHBondContact CA-O 3.37Å; G252-K266 PolarHBondContact N-O 2.91Å; G252-R287 CarbonylContact C-O 3.56Å; G252-R287 WeakPolarHBondContact CA-O 3.34Å
253	G	94.1	Very high	89.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.282	C	S	.	.			trans	95	-175.8	-174.9	0	0	0	0	0	113.2	K237 S264 R287	K237-G253 CarbonylContact O-C 3.59Å; K237-G253 WeakPolarHBondContact O-CA 3.05Å; G253-S264 PolarHBondContact O-N 3.06Å; G253-R287 PolarHBondContact N-O 3.1Å
254	I	91.6	Very high	89	Confident	26 Å²	26	49.1 Å²	49.1	13%	0.133	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.4	-177.4	-172	168.7	0	0	0	110.8	V183 K237 K262 V263 A288	V183-I254 HydrophobicContact CG2-CG2 3.93Å; K237-I254 HydrophobicContact CB-CG2 4.08Å; K237-I254 WeakPolarHBondContact CB-O 3.5Å; K237-I254 PolarHBondContact O-N 3.15Å; I254-K262 WeakPolarHBondContact CA-O 3.46Å; I254-V263 HydrophobicContact CD1-CG2 4.23Å; I254-V263 HydrophobicContact CG1-CG2 4.48Å; I254-A288 HydrophobicContact CB-CB 3.99Å; I254-A288 HydrophobicContact CG2-CB 4.28Å
255	S	88.8	Confident	89	Confident	50 Å²	50	51.8 Å²	51.8	35%	0.35	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	153.7	169.5	42.2	0	0	0	0	110.8	N235 G261 K262	N235-S255 WeakPolarHBondContact OD1-CB 3.26Å; N235-S255 PolarHBondContact OD1-N 3.47Å; N235-S255 PolarHBondContact OD1-OG 2.93Å; S255-G261 CarbonylContact O-C 3.57Å; S255-G261 VanDerWaalsContact O-CA 3.31Å; S255-G261 WeakPolarHBondContact O-CA 3.32Å; S255-K262 PolarHBondContact N-O 3.07Å; S255-K262 PolarHBondContact O-N 3Å; S255-K262 PolarHBondContact OG-O 3.2Å
256	G	79.1	Confident	89.1	Confident	37 Å²	37	52.8 Å²	52.8	38%	0.381	29%	0.292	S	S	.	.	S	Bend	trans	75.7	-175.7	-177.8	0	0	0	0	0	113.5
257	Y	67.1	Low	89.1	Confident	158 Å²	158	52.6 Å²	52.6	62%	0.62	29%	0.29	S	S	*	.	S	Bend	trans	-136.5	150.1	-178.2	-64.6	-83.6	0	0	0	110.9	K237 K260	K237-Y257 WeakPolarHBondContact CE-OH 3.38Å; K237-Y257 PolarHBondContact NZ-OH 2.88Å; Y257-K260 PolarHBondContact O-N 3.09Å
258	G	67.9	Low	89.1	Confident	68 Å²	68	52.8 Å²	52.8	70%	0.701	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	61.9	-139.8	176.4	0	0	0	0	0	113	K260 G261	G258-K260 PolarHBondContact O-N 3.01Å; G258-G261 PolarHBondContact O-N 2.92Å
259	D	64.9	Low	89.1	Confident	184 Å²	184	53.2 Å²	53.2	98%	0.984	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-64.3	-9.8	-177.8	-61.1	-17.7	0	0	0	114
260	K	73.6	Confident	89.1	Confident	186 Å²	186	53.3 Å²	53.3	81%	0.809	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-97.8	5.9	174.8	-62.9	-173.9	179.7	-178.5	0	113.2	Y257 G258 K262	Y257-K260 PolarHBondContact O-N 3.09Å; G258-K260 PolarHBondContact O-N 3.01Å; K260-K262 PolarHBondContact O-N 3.5Å
261	G	82.8	Confident	89	Confident	30 Å²	30	53.8 Å²	53.8	31%	0.309	30%	0.297	S	S	.	.			trans	-61.9	119.3	178.2	0	0	0	0	0	111.7	S255 G258	S255-G261 CarbonylContact O-C 3.57Å; S255-G261 VanDerWaalsContact O-CA 3.31Å; S255-G261 WeakPolarHBondContact O-CA 3.32Å; G258-G261 PolarHBondContact O-N 2.92Å
262	K	90.4	Very high	88.9	Confident	155 Å²	155	54.2 Å²	54.2	67%	0.674	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.7	176.5	-172.9	179	179	-176.1	0	109.9	I254 S255 K260	I254-K262 WeakPolarHBondContact CA-O 3.46Å; S255-K262 PolarHBondContact N-O 3.07Å; S255-K262 PolarHBondContact O-N 3Å; S255-K262 PolarHBondContact OG-O 3.2Å; K260-K262 PolarHBondContact O-N 3.5Å
263	V	93.6	Very high	88.8	Confident	59 Å²	59	56.3 Å²	56.3	36%	0.358	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	138.8	174.2	-172.3	0	0	0	0	109.4	I254 A286 R287 A288	I254-V263 HydrophobicContact CD1-CG2 4.23Å; I254-V263 HydrophobicContact CG1-CG2 4.48Å; V263-A286 HydrophobicContact CB-CB 4.28Å; V263-A286 HydrophobicContact CG1-CB 3.86Å; V263-R287 VanDerWaalsContact CG1-N 3.31Å; V263-A288 HydrophobicContact CG1-CB 4.07Å; V263-A288 HydrophobicContact CG2-CB 4.35Å
264	S	95.5	Very high	88.7	Confident	13 Å²	13	58.7 Å²	58.7	9%	0.091	33%	0.325	C	S	.	.			trans	-107.5	149.1	-177.9	-173.2	0	0	0	0	112.2	N235 G252 G253 K266 A286 R287	N235-S264 WeakPolarHBondContact ND2-CB 3.39Å; N235-S264 PolarHBondContact ND2-OG 2.97Å; G252-S264 VanDerWaalsContact CA-O 3.31Å; G252-S264 WeakPolarHBondContact CA-O 3.37Å; G253-S264 PolarHBondContact O-N 3.06Å; S264-K266 PolarHBondContact OG-N 3.04Å; S264-A286 WeakPolarHBondContact O-CA 3.47Å; S264-R287 PolarHBondContact O-N 2.78Å
265	D	97.3	Very high	88.8	Confident	66 Å²	66	61.7 Å²	61.7	35%	0.353	34%	0.341	S	S	.	.			trans	-106.2	-9.1	169.1	57.9	-7.6	0	0	0	112.7	P282 L283 A286	D265-P282 HydrophobicContact CB-CB 4.32Å; D265-P282 CarbonylContact O-C 3.5Å; D265-P282 VanDerWaalsContact O-CA 3.3Å; D265-P282 WeakPolarHBondContact O-CA 3.45Å; D265-P282 WeakPolarHBondContact O-CB 3.03Å; D265-L283 HydrophobicContact CB-CB 4.19Å; D265-L283 PolarHBondContact O-N 3.02Å; D265-A286 HydrophobicContact CB-CB 4.02Å
266	K	98.1	Very high	89.1	Confident	59 Å²	59	68 Å²	68	26%	0.257	36%	0.357	S	S	.	.			trans	-58.2	145.8	-178.4	-63.6	-169.4	178.3	-172.8	0	112.1	D233 G252 S264 F268	D233-K266 IonicContact OD1-NZ 2.78Å; D233-K266 PolarHBondContact OD1-NZ 3.04Å; G252-K266 PolarHBondContact N-O 2.91Å; S264-K266 PolarHBondContact OG-N 3.04Å; K266-F268 HydrophobicContact CB-CD2 4.43Å; K266-F268 HydrophobicContact CB-CE2 3.68Å; K266-F268 HydrophobicContact CB-CZ 4.3Å; K266-F268 HydrophobicContact CD-CE2 3.98Å; K266-F268 HydrophobicContact CD-CZ 3.89Å
267	V	98.4	Very high	90	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129.4	176.2	-172.1	0	0	0	0	109.4	V250 A251 I280 L283 W320	V250-V267 CarbonylContact O-C 3.56Å; V250-V267 WeakPolarHBondContact O-CA 3.22Å; A251-V267 HydrophobicContact CB-CG1 4.08Å; A251-V267 HydrophobicContact CB-CG2 3.95Å; V267-I280 HydrophobicContact CB-CD1 4.34Å; V267-I280 HydrophobicContact CB-CG1 3.75Å; V267-I280 HydrophobicContact CG1-CD1 3.65Å; V267-I280 HydrophobicContact CG1-CG1 3.58Å; V267-I280 PolarHBondContact O-N 2.89Å; V267-L283 HydrophobicContact CG2-CD2 4.37Å; V267-L283 HydrophobicContact CG2-CG 3.88Å; V267-W320 HydrophobicContact CG1-CZ2 4.5Å; V267-W320 HydrophobicContact CG2-CZ2 4.05Å
268	F	98.4	Very high	91.4	Very high	12 Å²	12	63.3 Å²	63.3	5%	0.053	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.7	179.3	-64.4	-91.7	0	0	0	110.2	D233 V234 F249 V250 K266 W277 A278 E279	D233-F268 HydrophobicContact CB-CE1 4.27Å; D233-F268 HydrophobicContact CB-CE2 4.39Å; D233-F268 HydrophobicContact CB-CZ 3.62Å; V234-F268 HydrophobicContact CB-CD2 4.48Å; V234-F268 HydrophobicContact CG2-CB 4.1Å; V234-F268 HydrophobicContact CG2-CD1 4.18Å; V234-F268 HydrophobicContact CG2-CD2 3.56Å; V234-F268 HydrophobicContact CG2-CE2 3.97Å; V234-F268 HydrophobicContact CG2-CG 3.67Å; V234-F268 HydrophobicContact CG2-CZ 4.45Å; F249-F268 CarbonylContact C-O 3.51Å; F249-F268 WeakPolarHBondContact CA-O 3.47Å; V250-F268 PolarHBondContact N-O 3.19Å; V250-F268 PolarHBondContact O-N 3.3Å; K266-F268 HydrophobicContact CB-CD2 4.43Å; K266-F268 HydrophobicContact CB-CE2 3.68Å; K266-F268 HydrophobicContact CB-CZ 4.3Å; K266-F268 HydrophobicContact CD-CE2 3.98Å; K266-F268 HydrophobicContact CD-CZ 3.89Å; F268-W277 HydrophobicContact CB-CE3 4.14Å; F268-W277 HydrophobicContact CB-CZ3 4.25Å; F268-A278 CarbonylContact C-O 3.52Å; F268-A278 WeakPolarHBondContact CA-O 3.25Å; F268-E279 HydrophobicContact CD1-CB 4.03Å; F268-E279 HydrophobicContact CD1-CG 4.36Å; F268-E279 HydrophobicContact CE1-CB 3.84Å; F268-E279 HydrophobicContact CE1-CG 4.02Å; F268-E279 HydrophobicContact CZ-CG 4.28Å
269	C	97.9	Very high	92.9	Very high	9 Å²	9	65 Å²	65	6%	0.061	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.9	170.4	77	0	0	0	0	111.3	L144 L248 F249 W277 A278 I280	L144-C269 HydrophobicContact CD1-CB 4.47Å; L248-C269 CarbonylContact O-C 3.56Å; L248-C269 WeakPolarHBondContact O-CA 3.2Å; F249-C269 HydrophobicContact CD1-CB 3.62Å; F249-C269 HydrophobicContact CE1-CB 3.59Å; F249-C269 HydrophobicContact CG-CB 4.34Å; F249-C269 HydrophobicContact CZ-CB 4.28Å; C269-W277 CarbonylContact O-C 3.53Å; C269-W277 WeakPolarHBondContact O-CA 3.46Å; C269-A278 PolarHBondContact N-O 2.85Å; C269-A278 PolarHBondContact O-N 2.77Å; C269-I280 HydrophobicContact CB-CG2 4.27Å
270	Y	98.2	Very high	94.4	Very high	2 Å²	2	57 Å²	57	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.7	174	172.9	-114.4	0	0	0	110.6	L227 T228 Y247 L248 P272 N275 W277 L473	L227-Y270 HydrophobicContact CD2-CE1 4.18Å; T228-Y270 HydrophobicContact CG2-CD2 4.26Å; T228-Y270 HydrophobicContact CG2-CE1 4.17Å; T228-Y270 HydrophobicContact CG2-CE2 3.82Å; Y247-Y270 WeakPolarHBondContact CA-O 3.4Å; Y247-Y270 WeakPolarHBondContact CD1-O 3.18Å; L248-Y270 HydrophobicContact CB-CD1 4.5Å; L248-Y270 PolarHBondContact N-O 3.01Å; L248-Y270 VanDerWaalsContact N-O 3.13Å; L248-Y270 PolarHBondContact O-N 3.49Å; Y270-P272 HydrophobicContact CE1-CB 3.92Å; Y270-N275 WeakPolarHBondContact CE2-OD1 3.34Å; Y270-N275 PolarHBondContact OH-OD1 3.22Å; Y270-W277 AromaticContact CD2-CD1 3.77Å; Y270-W277 HydrophobicContact CD2-CD2 4.01Å; Y270-W277 AromaticContact CD2-CE2 3.67Å; Y270-W277 HydrophobicContact CD2-CG 4.06Å; Y270-W277 HydrophobicContact CD2-CZ2 4.24Å; Y270-W277 AromaticContact CD2-NE1 3.52Å; Y270-W277 HydrophobicContact CG-CD2 4.24Å; Y270-W277 AromaticContact CG-CE2 3.87Å; Y270-W277 HydrophobicContact CG-CH2 4.48Å; Y270-W277 HydrophobicContact CG-CZ2 4Å; Y270-L473 HydrophobicContact CD1-CD1 4.23Å; Y270-L473 HydrophobicContact CE1-CD1 4.37Å
271	N	97.2	Very high	95.5	Very high	12 Å²	12	54.6 Å²	54.6	6%	0.064	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	109.3	173	-171.9	-17	0	0	0	110.1	D141 R168 Y247 I273 T274 N275 R276	D141-N271 PolarHBondContact O-ND2 3.01Å; R168-N271 PolarHBondContact NH2-OD1 3.44Å; Y247-N271 HydrophobicContact CD1-CB 3.87Å; Y247-N271 HydrophobicContact CE1-CB 3.6Å; Y247-N271 WeakPolarHBondContact CE1-ND2 3.16Å; N271-I273 VanDerWaalsContact C-N 3.26Å; N271-I273 PolarHBondContact O-N 2.91Å; N271-I273 PolarHBondContact OD1-N 2.83Å; N271-T274 WeakPolarHBondContact CB-OG1 3.34Å; N271-T274 VanDerWaalsContact CG-OG1 3.26Å; N271-T274 PolarHBondContact ND2-OG1 2.72Å; N271-T274 PolarHBondContact OD1-N 2.95Å; N271-N275 VanDerWaalsContact O-CA 3.23Å; N271-N275 WeakPolarHBondContact O-CA 3.49Å; N271-N275 PolarHBondContact O-N 2.78Å; N271-R276 PolarHBondContact N-O 2.66Å; N271-R276 PolarHBondContact O-N 3.07Å
272	P	95.5	Very high	96.3	Very high	9 Å²	9	55.9 Å²	55.9	6%	0.058	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.3	-179.9	29.9	-37.2	0	0	0	113.9	N246 Y270 L473 L475	N246-P272 WeakPolarHBondContact O-CD 3.39Å; N246-P272 WeakPolarHBondContact O-CG 3.5Å; Y270-P272 HydrophobicContact CE1-CB 3.92Å; P272-L473 HydrophobicContact CB-CD1 3.98Å; P272-L473 HydrophobicContact CG-CB 4.37Å; P272-L473 HydrophobicContact CG-CD1 3.95Å; P272-L475 HydrophobicContact CB-CD2 3.93Å
273	I	94.1	Very high	96.7	Very high	48 Å²	48	48.7 Å²	48.7	25%	0.246	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-46.5	179.7	-63.8	176.6	0	0	0	110.2	D141 N271	D141-I273 HydrophobicContact CB-CG2 4.11Å; N271-I273 VanDerWaalsContact C-N 3.26Å; N271-I273 PolarHBondContact O-N 2.91Å; N271-I273 PolarHBondContact OD1-N 2.83Å
274	T	92.8	Very high	96.9	Very high	50 Å²	50	50.9 Å²	50.9	31%	0.307	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-6	179.8	62.6	0	0	0	0	113.2	D141 N271 R276	D141-T274 HydrophobicContact CB-CG2 4.48Å; N271-T274 WeakPolarHBondContact CB-OG1 3.34Å; N271-T274 VanDerWaalsContact CG-OG1 3.26Å; N271-T274 PolarHBondContact ND2-OG1 2.72Å; N271-T274 PolarHBondContact OD1-N 2.95Å; T274-R276 VanDerWaalsContact C-N 3.31Å; T274-R276 WeakPolarHBondContact O-CG 3.05Å; T274-R276 PolarHBondContact O-N 3.39Å
275	N	93.6	Very high	97	Very high	89 Å²	89	53.4 Å²	53.4	48%	0.476	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	46.6	-173.4	-168.4	34.1	0	0	0	112.8	Y270 N271	Y270-N275 WeakPolarHBondContact CE2-OD1 3.34Å; Y270-N275 PolarHBondContact OH-OD1 3.22Å; N271-N275 VanDerWaalsContact O-CA 3.23Å; N271-N275 WeakPolarHBondContact O-CA 3.49Å; N271-N275 PolarHBondContact O-N 2.78Å
276	R	95.6	Very high	96.9	Very high	181 Å²	181	52.1 Å²	52.1	68%	0.683	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.5	-177.1	-71.9	176.9	-175.7	-171.8	0.2	111.7	N271 T274	N271-R276 PolarHBondContact N-O 2.66Å; N271-R276 PolarHBondContact O-N 3.07Å; T274-R276 VanDerWaalsContact C-N 3.31Å; T274-R276 WeakPolarHBondContact O-CG 3.05Å; T274-R276 PolarHBondContact O-N 3.39Å
277	W	97.8	Very high	96.8	Very high	49 Å²	49	49.3 Å²	49.3	19%	0.186	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	148.3	167.1	-72.1	93.2	0	0	0	110.4	I214 T228 V229 M230 P231 L248 V250 F268 C269 Y270	I214-W277 HydrophobicContact CD1-CH2 4Å; I214-W277 HydrophobicContact CD1-CZ2 3.61Å; T228-W277 HydrophobicContact CG2-CZ2 4.27Å; V229-W277 PolarHBondContact O-NE1 3.43Å; V229-W277 VanDerWaalsContact O-NE1 3.12Å; M230-W277 HydrophobicContact CB-CH2 4.41Å; M230-W277 HydrophobicContact CB-CZ2 4.2Å; M230-W277 HydrophobicContact CG-CH2 3.71Å; M230-W277 HydrophobicContact CG-CZ2 3.58Å; M230-W277 HydrophobicContact SD-CH2 4.42Å; P231-W277 HydrophobicContact CG-CB 3.72Å; P231-W277 HydrophobicContact CG-CD2 4.13Å; P231-W277 HydrophobicContact CG-CE3 4.46Å; P231-W277 HydrophobicContact CG-CG 3.81Å; L248-W277 HydrophobicContact CD2-CH2 4.01Å; V250-W277 HydrophobicContact CG2-CH2 4.18Å; V250-W277 HydrophobicContact CG2-CZ3 4.14Å; F268-W277 HydrophobicContact CB-CE3 4.14Å; F268-W277 HydrophobicContact CB-CZ3 4.25Å; C269-W277 CarbonylContact O-C 3.53Å; C269-W277 WeakPolarHBondContact O-CA 3.46Å; Y270-W277 AromaticContact CD2-CD1 3.77Å; Y270-W277 HydrophobicContact CD2-CD2 4.01Å; Y270-W277 AromaticContact CD2-CE2 3.67Å; Y270-W277 HydrophobicContact CD2-CG 4.06Å; Y270-W277 HydrophobicContact CD2-CZ2 4.24Å; Y270-W277 AromaticContact CD2-NE1 3.52Å; Y270-W277 HydrophobicContact CG-CD2 4.24Å; Y270-W277 AromaticContact CG-CE2 3.87Å; Y270-W277 HydrophobicContact CG-CH2 4.48Å; Y270-W277 HydrophobicContact CG-CZ2 4Å
278	A	96.9	Very high	96.6	Very high	49 Å²	49	49.4 Å²	49.4	41%	0.405	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142.1	171	0	0	0	0	0	110	F268 C269	F268-A278 CarbonylContact C-O 3.52Å; F268-A278 WeakPolarHBondContact CA-O 3.25Å; C269-A278 PolarHBondContact N-O 2.85Å; C269-A278 PolarHBondContact O-N 2.77Å
279	E	97.6	Very high	96.2	Very high	102 Å²	102	50.9 Å²	50.9	48%	0.477	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	137.2	164.9	-167.7	171.8	157.6	0	0	109	F268	F268-E279 HydrophobicContact CD1-CB 4.03Å; F268-E279 HydrophobicContact CD1-CG 4.36Å; F268-E279 HydrophobicContact CE1-CB 3.84Å; F268-E279 HydrophobicContact CE1-CG 4.02Å; F268-E279 HydrophobicContact CZ-CG 4.28Å
280	I	96.9	Very high	96.1	Very high	18 Å²	18	50.6 Å²	50.6	9%	0.092	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-175.6	175.1	68.8	171.3	0	0	0	109.4	F249 V267 C269 Y313	F249-I280 HydrophobicContact CD1-CD1 3.73Å; F249-I280 HydrophobicContact CE1-CD1 3.69Å; V267-I280 HydrophobicContact CB-CD1 4.34Å; V267-I280 HydrophobicContact CB-CG1 3.75Å; V267-I280 HydrophobicContact CG1-CD1 3.65Å; V267-I280 HydrophobicContact CG1-CG1 3.58Å; V267-I280 PolarHBondContact O-N 2.89Å; C269-I280 HydrophobicContact CB-CG2 4.27Å; I280-Y313 HydrophobicContact CD1-CE1 4.03Å
281	R	98	Very high	96	Very high	134 Å²	134	52 Å²	52	51%	0.506	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-51	126.4	-178.5	-71.6	-78.3	-172.7	-168.5	-0.9	112	Y313 D318 W320	R281-Y313 HydrophobicContact CB-CE2 3.95Å; R281-Y313 HydrophobicContact CG-CE2 4.3Å; R281-D318 HydrophobicContact CG-CB 4.35Å; R281-D318 VanDerWaalsContact CG-O 3.31Å; R281-D318 WeakPolarHBondContact CG-O 3.49Å; R281-D318 WeakPolarHBondContact CG-OD1 3.43Å; R281-D318 WeakPolarHBondContact CG-OD2 3.43Å; R281-D318 IonicContact CZ-OD2 3.31Å; R281-D318 VanDerWaalsContact CZ-OD2 3.29Å; R281-D318 VanDerWaalsContact NE-CG 3.33Å; R281-D318 PolarHBondContact NE-O 3.45Å; R281-D318 IonicContact NE-OD1 3.11Å; R281-D318 IonicContact NE-OD2 3.5Å; R281-D318 PolarHBondContact NE-OD2 2.8Å; R281-D318 IonicContact NH2-OD2 3.98Å; R281-D318 PolarHBondContact NH2-OD2 2.92Å; R281-D318 VanDerWaalsContact NH2-OD2 3.08Å; R281-W320 PolarHBondContact O-NE1 3.17Å
282	P	98.4	Very high	96.1	Very high	57 Å²	57	52 Å²	52	37%	0.37	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-67	156.4	175.1	30.1	-35.2	0	0	0	110.5	D265 W320	D265-P282 HydrophobicContact CB-CB 4.32Å; D265-P282 CarbonylContact O-C 3.5Å; D265-P282 VanDerWaalsContact O-CA 3.3Å; D265-P282 WeakPolarHBondContact O-CA 3.45Å; D265-P282 WeakPolarHBondContact O-CB 3.03Å; P282-W320 PolarHBondContact O-NE1 3.44Å
283	L	98.5	Very high	96.2	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-58.5	152.4	171.8	-62.1	162.5	0	0	0	110.3	A251 D265 V267 Q285 R287 L290 A301 W320	A251-L283 HydrophobicContact CB-CD1 4.47Å; D265-L283 HydrophobicContact CB-CB 4.19Å; D265-L283 PolarHBondContact O-N 3.02Å; V267-L283 HydrophobicContact CG2-CD2 4.37Å; V267-L283 HydrophobicContact CG2-CG 3.88Å; L283-Q285 VanDerWaalsContact CB-O 3.27Å; L283-Q285 WeakPolarHBondContact CB-O 3.11Å; L283-Q285 PolarHBondContact O-N 2.85Å; L283-R287 HydrophobicContact CD1-CB 4.25Å; L283-R287 HydrophobicContact CD1-CG 4.41Å; L283-L290 HydrophobicContact CD1-CD1 4.26Å; L283-A301 HydrophobicContact CD2-CB 3.61Å; L283-W320 HydrophobicContact CD2-CD2 3.93Å; L283-W320 HydrophobicContact CD2-CE3 3.92Å; L283-W320 HydrophobicContact CD2-CH2 3.66Å; L283-W320 HydrophobicContact CD2-CZ2 3.66Å; L283-W320 HydrophobicContact CD2-CZ3 3.79Å
284	N	98.2	Very high	96.4	Very high	104 Å²	104	51.1 Å²	51.1	56%	0.556	26%	0.257	S	S	*	.	S	Bend	trans	-71.7	-24.3	171.9	-55.9	-64.8	0	0	0	111.5	E311 W320	N284-E311 WeakPolarHBondContact CA-OE2 3.47Å; N284-E311 WeakPolarHBondContact CB-OE2 3.25Å; N284-E311 VanDerWaalsContact CG-OE2 3.26Å; N284-E311 PolarHBondContact N-OE2 2.81Å; N284-E311 PolarHBondContact ND2-OE2 2.81Å; N284-W320 VanDerWaalsContact ND2-CB 3.33Å; N284-W320 WeakPolarHBondContact ND2-CB 3.38Å; N284-W320 PolarHBondContact ND2-O 2.82Å
285	Q	96.8	Very high	96.6	Very high	67 Å²	67	49 Å²	49	31%	0.313	24%	0.244	S	C	.	.	S	Bend	trans	-127.7	127.5	176.5	-175	169.9	37.9	0	0	110.2	L283 R287 L307 T309 E311	L283-Q285 VanDerWaalsContact CB-O 3.27Å; L283-Q285 WeakPolarHBondContact CB-O 3.11Å; L283-Q285 PolarHBondContact O-N 2.85Å; Q285-R287 WeakPolarHBondContact O-CG 3.12Å; Q285-L307 HydrophobicContact CG-CD1 4.19Å; Q285-L307 VanDerWaalsContact NE2-CD2 3.26Å; Q285-T309 PolarHBondContact OE1-OG1 2.82Å; Q285-E311 PolarHBondContact N-OE1 2.9Å
286	A	96.7	Very high	96.6	Very high	38 Å²	38	50.6 Å²	50.6	31%	0.314	25%	0.253	S	S	.	.			trans	-61.1	135.5	172.7	0	0	0	0	0	110.8	V263 S264 D265	V263-A286 HydrophobicContact CB-CB 4.28Å; V263-A286 HydrophobicContact CG1-CB 3.86Å; S264-A286 WeakPolarHBondContact O-CA 3.47Å; D265-A286 HydrophobicContact CB-CB 4.02Å
287	R	95.5	Very high	96.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.232	C	C	.	.			trans	-138.2	130.9	-171.7	-70.7	166.9	-169.7	-79.4	-4.9	111.7	G252 G253 V263 S264 L283 Q285 L290 G303 L307 T309 E311	G252-R287 CarbonylContact C-O 3.56Å; G252-R287 WeakPolarHBondContact CA-O 3.34Å; G253-R287 PolarHBondContact N-O 3.1Å; V263-R287 VanDerWaalsContact CG1-N 3.31Å; S264-R287 PolarHBondContact O-N 2.78Å; L283-R287 HydrophobicContact CD1-CB 4.25Å; L283-R287 HydrophobicContact CD1-CG 4.41Å; Q285-R287 WeakPolarHBondContact O-CG 3.12Å; R287-L290 HydrophobicContact CB-CB 4.04Å; R287-L290 HydrophobicContact CB-CD1 3.93Å; R287-L290 HydrophobicContact CB-CD2 4.39Å; R287-L290 HydrophobicContact CB-CG 4.35Å; R287-G303 PolarHBondContact NH1-O 2.88Å; R287-L307 HydrophobicContact CB-CD1 4.45Å; R287-L307 HydrophobicContact CG-CD1 3.7Å; R287-T309 PolarHBondContact NH1-O 2.82Å; R287-T309 PolarHBondContact NH1-OG1 2.87Å; R287-T309 PolarHBondContact NH2-OG1 2.82Å; R287-E311 IonicContact CZ-OE1 2.83Å; R287-E311 IonicContact NE-OE1 3.12Å; R287-E311 PolarHBondContact NE-OE1 2.87Å; R287-E311 VanDerWaalsContact NE-OE1 3.07Å; R287-E311 IonicContact NH2-OE1 3.84Å; R287-E311 PolarHBondContact NH2-OE1 3.43Å
288	A	93.3	Very high	96.6	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.025	23%	0.226	C	C	.	.	S	Bend	trans	-112.7	150.8	164.5	0	0	0	0	0	109.4	G238 I254 V263 L290 G304 E305	G238-A288 CarbonylContact O-C 3.5Å; I254-A288 HydrophobicContact CB-CB 3.99Å; I254-A288 HydrophobicContact CG2-CB 4.28Å; V263-A288 HydrophobicContact CG1-CB 4.07Å; V263-A288 HydrophobicContact CG2-CB 4.35Å; A288-L290 PolarHBondContact O-N 2.8Å; A288-G304 CarbonylContact O-C 3.49Å; A288-G304 WeakPolarHBondContact O-CA 3.27Å; A288-E305 PolarHBondContact O-N 3.35Å
289	Q	91.6	Very high	96.7	Very high	42 Å²	42	38.9 Å²	38.9	20%	0.196	21%	0.207	C	C	.	.	S	Bend	trans	57.5	25.1	-178.9	-69.7	-73.3	-28.2	0	0	114.3	V183 G238	V183-Q289 HydrophobicContact CB-CG 4.24Å; V183-Q289 VanDerWaalsContact CB-NE2 3.25Å; V183-Q289 HydrophobicContact CG2-CG 4Å; G238-Q289 WeakPolarHBondContact O-CA 3.38Å; G238-Q289 PolarHBondContact O-N 2.89Å
290	L	95.1	Very high	96.7	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	19%	0.185	C	C	.	.			trans	-69.2	162.3	175.3	72.8	175	0	0	0	112.5	G238 A251 L283 R287 A288 A301	G238-L290 WeakPolarHBondContact O-CD2 3.48Å; A251-L290 HydrophobicContact CB-CD1 4.2Å; A251-L290 WeakPolarHBondContact O-CD2 3.36Å; L283-L290 HydrophobicContact CD1-CD1 4.26Å; R287-L290 HydrophobicContact CB-CB 4.04Å; R287-L290 HydrophobicContact CB-CD1 3.93Å; R287-L290 HydrophobicContact CB-CD2 4.39Å; R287-L290 HydrophobicContact CB-CG 4.35Å; A288-L290 PolarHBondContact O-N 2.8Å; L290-A301 HydrophobicContact CD1-CB 4.1Å
291	K	96.8	Very high	96.8	Very high	32 Å²	32	33.3 Å²	33.3	14%	0.139	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.9	164	-53	-63.6	139.9	169.2	0	109.5	I302 A334 H335 A337	K291-I302 HydrophobicContact CB-CB 4.32Å; K291-I302 PolarHBondContact N-O 2.88Å; K291-I302 PolarHBondContact O-N 3.43Å; K291-A334 HydrophobicContact CG-CB 4.26Å; K291-H335 VanDerWaalsContact CD-O 3.31Å; K291-H335 WeakPolarHBondContact CD-O 3.33Å; K291-H335 WeakPolarHBondContact CE-O 3.06Å; K291-H335 PolarHBondContact NZ-O 2.79Å; K291-A337 HydrophobicContact CB-CB 3.77Å; K291-A337 HydrophobicContact CG-CB 4.32Å
292	L	98	Very high	96.8	Very high	11 Å²	11	27 Å²	27	6%	0.058	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.8	177.1	-169.9	69.6	0	0	0	108.3	G240 C242 F249 A251 L299 Y300 A301 W320	G240-L292 WeakPolarHBondContact O-CD2 3.4Å; C242-L292 HydrophobicContact CB-CB 4.09Å; C242-L292 HydrophobicContact CB-CD2 3.78Å; C242-L292 HydrophobicContact CB-CG 3.68Å; C242-L292 WeakPolarHBondContact CB-O 3.47Å; F249-L292 HydrophobicContact CB-CD2 3.97Å; A251-L292 HydrophobicContact CB-CD1 4.29Å; A251-L292 HydrophobicContact CB-CD2 3.99Å; L292-L299 HydrophobicContact CD1-CB 4.3Å; L292-Y300 WeakPolarHBondContact CA-O 3.39Å; L292-A301 HydrophobicContact CD1-CB 4.29Å; L292-W320 HydrophobicContact CD1-CH2 4.26Å
293	V	98.1	Very high	96.6	Very high	11 Å²	11	24.2 Å²	24.2	7%	0.067	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.1	177.6	-63.6	0	0	0	0	110.7	C242 L299 Y300 I302 A337 T339 L344	C242-V293 VanDerWaalsContact SG-CA 3.52Å; V293-L299 CarbonylContact O-C 3.51Å; V293-L299 WeakPolarHBondContact O-CA 3.27Å; V293-Y300 PolarHBondContact N-O 3.27Å; V293-Y300 VanDerWaalsContact N-O 3.1Å; V293-Y300 PolarHBondContact O-N 2.86Å; V293-I302 HydrophobicContact CG2-CD1 3.72Å; V293-A337 HydrophobicContact CG1-CB 3.57Å; V293-T339 HydrophobicContact CB-CG2 4.17Å; V293-T339 HydrophobicContact CG2-CG2 4.23Å; V293-L344 HydrophobicContact CG2-CD1 3.62Å; V293-L344 HydrophobicContact CG2-CG 3.96Å
294	S	97.7	Very high	96.1	Very high	28 Å²	28	24.2 Å²	24.2	20%	0.196	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.2	176.9	65.9	0	0	0	0	110.9	C242 T243 S298 T339	C242-S294 PolarHBondContact SG-N 3.09Å; T243-S294 WeakPolarHBondContact O-CB 3.46Å; T243-S294 PolarHBondContact O-OG 2.79Å; S294-S298 VanDerWaalsContact CA-O 3.29Å; S294-S298 WeakPolarHBondContact CA-O 3.46Å; S294-T339 VanDerWaalsContact O-CG2 3.25Å; S294-T339 WeakPolarHBondContact O-CG2 3.31Å; S294-T339 PolarHBondContact O-OG1 3.28Å
295	M	96.7	Very high	95.5	Very high	7 Å²	7	24.5 Å²	24.5	3%	0.034	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	131.3	177.2	-169.7	-178.8	71.8	0	0	108.6	G297 S298 Y300 T339 G342 L344 Y358 P360	M295-G297 VanDerWaalsContact C-N 3.27Å; M295-G297 PolarHBondContact O-N 2.93Å; M295-S298 PolarHBondContact N-O 2.79Å; M295-S298 PolarHBondContact O-N 3.04Å; M295-Y300 HydrophobicContact CB-CD2 4.16Å; M295-Y300 HydrophobicContact CB-CE2 3.74Å; M295-Y300 HydrophobicContact CE-CE1 4.47Å; M295-Y300 HydrophobicContact CE-CE2 4.06Å; M295-Y300 WeakPolarHBondContact CE-OH 3.3Å; M295-T339 HydrophobicContact CB-CG2 3.98Å; M295-T339 HydrophobicContact CG-CG2 4.44Å; M295-G342 VanDerWaalsContact SD-O 3.36Å; M295-L344 HydrophobicContact CE-CB 4.41Å; M295-L344 HydrophobicContact SD-CB 3.67Å; M295-Y358 HydrophobicContact CE-CD1 4.4Å; M295-P360 HydrophobicContact CE-CB 4.25Å; M295-P360 HydrophobicContact CE-CG 4.27Å
296	D	94.3	Very high	94.8	Very high	122 Å²	122	27 Å²	27	65%	0.652	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	43.6	176.1	-57.2	-26.1	0	0	0	114.2	S298	D296-S298 PolarHBondContact O-N 2.77Å
297	G	95.5	Very high	94.5	Very high	24 Å²	24	26.6 Å²	26.6	25%	0.247	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	15.2	178.9	0	0	0	0	0	114.8	H245 M295 P315	H245-G297 WeakPolarHBondContact NE2-CA 3.5Å; M295-G297 VanDerWaalsContact C-N 3.27Å; M295-G297 PolarHBondContact O-N 2.93Å; G297-P315 WeakPolarHBondContact O-CD 3.23Å; G297-P315 VanDerWaalsContact O-CG 3.22Å; G297-P315 WeakPolarHBondContact O-CG 3.37Å
298	S	97.8	Very high	94.4	Very high	8 Å²	8	30.4 Å²	30.4	6%	0.056	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	153.2	173.6	-56.9	0	0	0	0	110.9	S294 M295 D296 K312 Y313	S294-S298 VanDerWaalsContact CA-O 3.29Å; S294-S298 WeakPolarHBondContact CA-O 3.46Å; M295-S298 PolarHBondContact N-O 2.79Å; M295-S298 PolarHBondContact O-N 3.04Å; D296-S298 PolarHBondContact O-N 2.77Å; S298-K312 VanDerWaalsContact CB-CE 3.41Å; S298-K312 WeakPolarHBondContact OG-CE 3.18Å; S298-Y313 VanDerWaalsContact CA-O 3.29Å; S298-Y313 WeakPolarHBondContact CA-O 3.36Å; S298-Y313 VanDerWaalsContact CB-O 3.26Å; S298-Y313 WeakPolarHBondContact CB-O 3.21Å
299	L	98.5	Very high	94.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	147.9	170.3	-53.5	172	0	0	0	110.2	M244 F249 L292 V293 K312 Y313 W320	M244-L299 HydrophobicContact CB-CD2 3.87Å; M244-L299 HydrophobicContact CE-CD1 4.44Å; M244-L299 HydrophobicContact CE-CD2 3.94Å; M244-L299 HydrophobicContact CE-CG 3.9Å; M244-L299 HydrophobicContact CG-CD2 4.4Å; M244-L299 HydrophobicContact SD-CD2 3.7Å; M244-L299 HydrophobicContact SD-CG 4.05Å; F249-L299 HydrophobicContact CB-CD1 4.17Å; F249-L299 HydrophobicContact CD1-CD1 3.51Å; F249-L299 HydrophobicContact CD2-CD1 4.19Å; F249-L299 HydrophobicContact CD2-CD2 4.1Å; F249-L299 HydrophobicContact CE1-CD1 3.85Å; F249-L299 HydrophobicContact CE2-CD1 4.5Å; F249-L299 HydrophobicContact CE2-CD2 4.41Å; F249-L299 HydrophobicContact CG-CD1 3.68Å; F249-L299 HydrophobicContact CG-CD2 4.33Å; F249-L299 HydrophobicContact CZ-CD1 4.33Å; L292-L299 HydrophobicContact CD1-CB 4.3Å; V293-L299 CarbonylContact O-C 3.51Å; V293-L299 WeakPolarHBondContact O-CA 3.27Å; L299-K312 CarbonylContact O-C 3.58Å; L299-K312 VanDerWaalsContact O-CA 3.26Å; L299-K312 WeakPolarHBondContact O-CA 3.42Å; L299-Y313 HydrophobicContact CD1-CD1 3.9Å; L299-Y313 HydrophobicContact CG-CD1 4.21Å; L299-Y313 PolarHBondContact N-O 2.95Å; L299-Y313 VanDerWaalsContact N-O 3.12Å; L299-Y313 PolarHBondContact O-N 3.13Å; L299-W320 HydrophobicContact CB-CH2 4.09Å
300	Y	98.6	Very high	94.8	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.8	176.6	-67	-102.5	0	0	0	109	L292 V293 M295 E311 K312 I323 L344 Y358	L292-Y300 WeakPolarHBondContact CA-O 3.39Å; V293-Y300 PolarHBondContact N-O 3.27Å; V293-Y300 VanDerWaalsContact N-O 3.1Å; V293-Y300 PolarHBondContact O-N 2.86Å; M295-Y300 HydrophobicContact CB-CD2 4.16Å; M295-Y300 HydrophobicContact CB-CE2 3.74Å; M295-Y300 HydrophobicContact CE-CE1 4.47Å; M295-Y300 HydrophobicContact CE-CE2 4.06Å; M295-Y300 WeakPolarHBondContact CE-OH 3.3Å; Y300-E311 CarbonylContact C-O 3.52Å; Y300-E311 VanDerWaalsContact CA-O 3.32Å; Y300-E311 WeakPolarHBondContact CA-O 3.32Å; Y300-K312 HydrophobicContact CD1-CB 4.12Å; Y300-K312 HydrophobicContact CD1-CG 4.31Å; Y300-K312 HydrophobicContact CE1-CB 3.92Å; Y300-K312 HydrophobicContact CE1-CD 3.91Å; Y300-K312 HydrophobicContact CE1-CG 3.81Å; Y300-K312 HydrophobicContact CE2-CG 4.25Å; Y300-K312 WeakPolarHBondContact OH-CD 3.36Å; Y300-K312 WeakPolarHBondContact OH-CE 3.26Å; Y300-I323 HydrophobicContact CD1-CD1 3.55Å; Y300-I323 HydrophobicContact CE1-CD1 3.66Å; Y300-L344 HydrophobicContact CD1-CD1 3.81Å; Y300-L344 HydrophobicContact CD2-CD1 3.98Å; Y300-L344 HydrophobicContact CE1-CD1 4.42Å; Y300-L344 HydrophobicContact CG-CD1 3.56Å; Y300-Y358 HydrophobicContact CE1-CE1 4.06Å
301	A	98.4	Very high	95	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.2	173.8	0	0	0	0	0	108.8	L283 L290 L292 V310 E311 W320	L283-A301 HydrophobicContact CD2-CB 3.61Å; L290-A301 HydrophobicContact CD1-CB 4.1Å; L292-A301 HydrophobicContact CD1-CB 4.29Å; A301-V310 WeakPolarHBondContact O-CA 3.41Å; A301-V310 WeakPolarHBondContact O-CG1 3.48Å; A301-E311 PolarHBondContact N-O 2.79Å; A301-E311 PolarHBondContact O-N 2.77Å; A301-W320 HydrophobicContact CB-CH2 4.07Å; A301-W320 HydrophobicContact CB-CZ3 3.69Å
302	I	97.6	Very high	95	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.3	-166.3	-57.2	163.4	0	0	0	109.5	K291 V293 V310 L326 A334 A337 L344 V346	K291-I302 HydrophobicContact CB-CB 4.32Å; K291-I302 PolarHBondContact N-O 2.88Å; K291-I302 PolarHBondContact O-N 3.43Å; V293-I302 HydrophobicContact CG2-CD1 3.72Å; I302-V310 HydrophobicContact CB-CG1 4.4Å; I302-V310 HydrophobicContact CG1-CG1 3.81Å; I302-V310 HydrophobicContact CG2-CG2 4.12Å; I302-L326 HydrophobicContact CG2-CD1 3.94Å; I302-L326 HydrophobicContact CG2-CD2 4.21Å; I302-L326 HydrophobicContact CG2-CG 4.35Å; I302-A334 HydrophobicContact CG2-CB 4.16Å; I302-A337 HydrophobicContact CD1-CB 3.88Å; I302-L344 HydrophobicContact CD1-CD1 4.19Å; I302-L344 HydrophobicContact CD1-CD2 3.92Å; I302-L344 HydrophobicContact CD1-CG 4.43Å; I302-V346 HydrophobicContact CD1-CG2 3.79Å; I302-V346 HydrophobicContact CG2-CG1 4.25Å; I302-V346 HydrophobicContact CG2-CG2 4.09Å
303	G	94.5	Very high	95.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.7	-141.3	172.9	0	0	0	0	0	113.4	R287 L307 T309	R287-G303 PolarHBondContact NH1-O 2.88Å; G303-L307 WeakPolarHBondContact CA-O 3.44Å; G303-T309 WeakPolarHBondContact CA-O 3.44Å; G303-T309 PolarHBondContact N-O 2.85Å
304	G	88.9	Confident	95.1	Very high	4 Å²	4	32.1 Å²	32.1	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.6	-179.8	-172.7	0	0	0	0	0	109.9	A288 C306 L307	A288-G304 CarbonylContact O-C 3.49Å; A288-G304 WeakPolarHBondContact O-CA 3.27Å; G304-C306 PolarHBondContact O-N 2.81Å; G304-C306 VanDerWaalsContact O-N 3.12Å; G304-L307 PolarHBondContact O-N 2.94Å; G304-L307 VanDerWaalsContact O-N 3.09Å
305	E	85.1	Confident	95	Very high	110 Å²	110	30.9 Å²	30.9	51%	0.514	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	118.9	175.3	-171.7	169.4	-161.9	0	0	110.1	A288 L307	A288-E305 PolarHBondContact O-N 3.35Å; E305-L307 PolarHBondContact O-N 3.35Å
306	C	82.8	Confident	95	Very high	119 Å²	119	36.3 Å²	36.3	80%	0.804	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	19.9	-177.1	-60	0	0	0	0	115.6	G304	G304-C306 PolarHBondContact O-N 2.81Å; G304-C306 VanDerWaalsContact O-N 3.12Å
307	L	89.9	Confident	95	Very high	31 Å²	31	35.3 Å²	35.3	16%	0.162	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.6	-179.9	-63.9	178.1	0	0	0	111.9	Q285 R287 G303 G304 E305	Q285-L307 HydrophobicContact CG-CD1 4.19Å; Q285-L307 VanDerWaalsContact NE2-CD2 3.26Å; R287-L307 HydrophobicContact CB-CD1 4.45Å; R287-L307 HydrophobicContact CG-CD1 3.7Å; G303-L307 WeakPolarHBondContact CA-O 3.44Å; G304-L307 PolarHBondContact O-N 2.94Å; G304-L307 VanDerWaalsContact O-N 3.09Å; E305-L307 PolarHBondContact O-N 3.35Å
308	F	93.1	Very high	95.1	Very high	79 Å²	79	35.6 Å²	35.6	35%	0.346	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-8.6	170	53.1	-96.1	0	0	0	112.2	P325 L326 K328	F308-P325 HydrophobicContact CD2-CB 3.59Å; F308-P325 HydrophobicContact CD2-CG 4.5Å; F308-P325 HydrophobicContact CE2-CB 4.23Å; F308-P325 CarbonylContact O-C 3.53Å; F308-P325 VanDerWaalsContact O-CA 3.31Å; F308-P325 WeakPolarHBondContact O-CA 3.2Å; F308-P325 WeakPolarHBondContact O-CB 3.46Å; F308-L326 HydrophobicContact CB-CB 4.35Å; F308-L326 PolarHBondContact O-N 2.67Å; F308-K328 HydrophobicContact CD1-CG 4.33Å; F308-K328 HydrophobicContact CD2-CG 4.4Å; F308-K328 HydrophobicContact CG-CG 4.23Å; F308-K328 HydrophobicContact CZ-CD 4.46Å
309	T	96.1	Very high	95.1	Very high	23 Å²	23	41.1 Å²	41.1	14%	0.141	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	151.3	-177.7	55.3	0	0	0	0	111.3	Q285 R287 G303 M322	Q285-T309 PolarHBondContact OE1-OG1 2.82Å; R287-T309 PolarHBondContact NH1-O 2.82Å; R287-T309 PolarHBondContact NH1-OG1 2.87Å; R287-T309 PolarHBondContact NH2-OG1 2.82Å; G303-T309 WeakPolarHBondContact CA-O 3.44Å; G303-T309 PolarHBondContact N-O 2.85Å; T309-M322 HydrophobicContact CG2-CE 3.84Å
310	V	97.9	Very high	95.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.5	176.8	-173.7	0	0	0	0	108.7	A301 I302 I323 L326 W365	A301-V310 WeakPolarHBondContact O-CA 3.41Å; A301-V310 WeakPolarHBondContact O-CG1 3.48Å; I302-V310 HydrophobicContact CB-CG1 4.4Å; I302-V310 HydrophobicContact CG1-CG1 3.81Å; I302-V310 HydrophobicContact CG2-CG2 4.12Å; V310-I323 HydrophobicContact CB-CD1 4.22Å; V310-I323 HydrophobicContact CB-CG1 3.75Å; V310-I323 HydrophobicContact CG1-CD1 3.61Å; V310-I323 HydrophobicContact CG1-CG1 3.67Å; V310-I323 PolarHBondContact O-N 3.04Å; V310-L326 HydrophobicContact CG2-CG 4.02Å; V310-W365 HydrophobicContact CG1-CZ2 4.47Å; V310-W365 HydrophobicContact CG2-CZ2 4.02Å
311	E	98.1	Very high	95.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.2	-179	-70.3	178.7	-100.3	0	0	111.2	N284 Q285 R287 Y300 A301 W320 T321 M322	N284-E311 WeakPolarHBondContact CA-OE2 3.47Å; N284-E311 WeakPolarHBondContact CB-OE2 3.25Å; N284-E311 VanDerWaalsContact CG-OE2 3.26Å; N284-E311 PolarHBondContact N-OE2 2.81Å; N284-E311 PolarHBondContact ND2-OE2 2.81Å; Q285-E311 PolarHBondContact N-OE1 2.9Å; R287-E311 IonicContact CZ-OE1 2.83Å; R287-E311 IonicContact NE-OE1 3.12Å; R287-E311 PolarHBondContact NE-OE1 2.87Å; R287-E311 VanDerWaalsContact NE-OE1 3.07Å; R287-E311 IonicContact NH2-OE1 3.84Å; R287-E311 PolarHBondContact NH2-OE1 3.43Å; Y300-E311 CarbonylContact C-O 3.52Å; Y300-E311 VanDerWaalsContact CA-O 3.32Å; Y300-E311 WeakPolarHBondContact CA-O 3.32Å; A301-E311 PolarHBondContact N-O 2.79Å; A301-E311 PolarHBondContact O-N 2.77Å; E311-W320 HydrophobicContact CB-CE3 3.8Å; E311-W320 HydrophobicContact CB-CZ3 4.37Å; E311-T321 CarbonylContact C-O 3.51Å; E311-T321 WeakPolarHBondContact CA-O 3.44Å; E311-M322 VanDerWaalsContact CD-SD 3.53Å; E311-M322 HydrophobicContact CG-CE 3.86Å; E311-M322 HydrophobicContact CG-SD 3.27Å; E311-M322 WeakPolarHBondContact CG-SD 3.21Å
312	K	98.4	Very high	95.1	Very high	67 Å²	67	48.6 Å²	48.6	29%	0.291	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.9	176.4	179	-172.7	175.8	-178.7	0	110.3	S298 L299 Y300 W320 T321 I323	S298-K312 VanDerWaalsContact CB-CE 3.41Å; S298-K312 WeakPolarHBondContact OG-CE 3.18Å; L299-K312 CarbonylContact O-C 3.58Å; L299-K312 VanDerWaalsContact O-CA 3.26Å; L299-K312 WeakPolarHBondContact O-CA 3.42Å; Y300-K312 HydrophobicContact CD1-CB 4.12Å; Y300-K312 HydrophobicContact CD1-CG 4.31Å; Y300-K312 HydrophobicContact CE1-CB 3.92Å; Y300-K312 HydrophobicContact CE1-CD 3.91Å; Y300-K312 HydrophobicContact CE1-CG 3.81Å; Y300-K312 HydrophobicContact CE2-CG 4.25Å; Y300-K312 WeakPolarHBondContact OH-CD 3.36Å; Y300-K312 WeakPolarHBondContact OH-CE 3.26Å; K312-W320 CarbonylContact O-C 3.59Å; K312-W320 WeakPolarHBondContact O-CA 3.32Å; K312-T321 PolarHBondContact N-O 3.42Å; K312-T321 PolarHBondContact O-N 3.3Å; K312-I323 HydrophobicContact CB-CG2 3.84Å
313	Y	98.6	Very high	95.1	Very high	3 Å²	3	49.7 Å²	49.7	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.4	170.4	-179.5	-118	0	0	0	110.9	I280 R281 S298 L299 P315 D318 R319 W320	I280-Y313 HydrophobicContact CD1-CE1 4.03Å; R281-Y313 HydrophobicContact CB-CE2 3.95Å; R281-Y313 HydrophobicContact CG-CE2 4.3Å; S298-Y313 VanDerWaalsContact CA-O 3.29Å; S298-Y313 WeakPolarHBondContact CA-O 3.36Å; S298-Y313 VanDerWaalsContact CB-O 3.26Å; S298-Y313 WeakPolarHBondContact CB-O 3.21Å; L299-Y313 HydrophobicContact CD1-CD1 3.9Å; L299-Y313 HydrophobicContact CG-CD1 4.21Å; L299-Y313 PolarHBondContact N-O 2.95Å; L299-Y313 VanDerWaalsContact N-O 3.12Å; L299-Y313 PolarHBondContact O-N 3.13Å; Y313-P315 HydrophobicContact CD1-CB 4.48Å; Y313-P315 HydrophobicContact CE1-CB 3.86Å; Y313-D318 PolarHBondContact OH-OD1 2.83Å; Y313-R319 WeakPolarHBondContact CA-O 3.42Å; Y313-W320 AromaticContact CD2-CD1 3.79Å; Y313-W320 HydrophobicContact CD2-CD2 4.08Å; Y313-W320 AromaticContact CD2-CE2 3.79Å; Y313-W320 HydrophobicContact CD2-CG 4.08Å; Y313-W320 HydrophobicContact CD2-CZ2 4.37Å; Y313-W320 AromaticContact CD2-NE1 3.61Å; Y313-W320 HydrophobicContact CG-CD2 4.2Å; Y313-W320 AromaticContact CG-CE2 3.86Å; Y313-W320 HydrophobicContact CG-CH2 4.46Å; Y313-W320 HydrophobicContact CG-CZ2 4.01Å
314	D	97.6	Very high	95.2	Very high	45 Å²	45	50.3 Å²	50.3	24%	0.241	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.6	167.4	-174.3	-26.4	0	0	0	109.3	R316 M317 D318 R319	D314-R316 PolarHBondContact O-N 2.89Å; D314-R316 WeakPolarHBondContact OD1-CA 3.46Å; D314-R316 VanDerWaalsContact OD1-CB 3.26Å; D314-R316 WeakPolarHBondContact OD1-CB 3.3Å; D314-R316 PolarHBondContact OD1-N 2.97Å; D314-M317 HydrophobicContact CB-CB 4.23Å; D314-M317 HydrophobicContact CB-CG 4.38Å; D314-M317 PolarHBondContact O-N 3.04Å; D314-M317 PolarHBondContact OD1-N 3.19Å; D314-D318 WeakPolarHBondContact O-CA 3.33Å; D314-D318 PolarHBondContact O-N 2.88Å; D314-R319 PolarHBondContact N-O 3.09Å; D314-R319 PolarHBondContact O-N 2.82Å
315	P	96.7	Very high	95.5	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.019	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.5	179.8	28.2	-35	0	0	0	113.6	L144 L147 K148 M244 G297 Y313	L144-P315 HydrophobicContact CD2-CB 4.26Å; L147-P315 HydrophobicContact CD1-CB 4.33Å; L147-P315 HydrophobicContact CD1-CG 4.24Å; K148-P315 WeakPolarHBondContact CG-O 3.31Å; M244-P315 HydrophobicContact CE-CG 4.15Å; G297-P315 WeakPolarHBondContact O-CD 3.23Å; G297-P315 VanDerWaalsContact O-CG 3.22Å; G297-P315 WeakPolarHBondContact O-CG 3.37Å; Y313-P315 HydrophobicContact CD1-CB 4.48Å; Y313-P315 HydrophobicContact CE1-CB 3.86Å
316	R	95.7	Very high	95.9	Very high	120 Å²	120	48.1 Å²	48.1	45%	0.453	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-36.9	177.1	-58.8	-177.4	63.1	159.4	-1.4	111.8	L147 Y153 D314	L147-R316 HydrophobicContact CB-CG 4.47Å; L147-R316 HydrophobicContact CD2-CG 4.13Å; Y153-R316 VanDerWaalsContact CE1-CZ 3.46Å; D314-R316 PolarHBondContact O-N 2.89Å; D314-R316 WeakPolarHBondContact OD1-CA 3.46Å; D314-R316 VanDerWaalsContact OD1-CB 3.26Å; D314-R316 WeakPolarHBondContact OD1-CB 3.3Å; D314-R316 PolarHBondContact OD1-N 2.97Å
317	M	95.9	Very high	96.3	Very high	101 Å²	101	45 Å²	45	50%	0.498	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-11.4	176.7	-58.3	-163.3	77.5	0	0	112.8	D314 R319	D314-M317 HydrophobicContact CB-CB 4.23Å; D314-M317 HydrophobicContact CB-CG 4.38Å; D314-M317 PolarHBondContact O-N 3.04Å; D314-M317 PolarHBondContact OD1-N 3.19Å; M317-R319 VanDerWaalsContact C-N 3.28Å; M317-R319 HydrophobicContact CB-CB 4.22Å; M317-R319 VanDerWaalsContact CE-NH1 3.33Å; M317-R319 PolarHBondContact O-N 3.18Å; M317-R319 PolarHBondContact SD-NH2 2.99Å
318	D	96.6	Very high	95.9	Very high	30 Å²	30	50.8 Å²	50.8	16%	0.16	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	50	-175.1	-165.8	44.3	0	0	0	110.6	K148 R281 Y313 D314	K148-D318 HydrophobicContact CD-CB 4.11Å; K148-D318 VanDerWaalsContact CE-OD1 3.24Å; K148-D318 WeakPolarHBondContact CE-OD1 3.26Å; K148-D318 HydrophobicContact CG-CB 4.25Å; K148-D318 IonicContact NZ-OD1 3.53Å; K148-D318 PolarHBondContact NZ-OD1 3.02Å; K148-D318 IonicContact NZ-OD2 3.63Å; R281-D318 HydrophobicContact CG-CB 4.35Å; R281-D318 VanDerWaalsContact CG-O 3.31Å; R281-D318 WeakPolarHBondContact CG-O 3.49Å; R281-D318 WeakPolarHBondContact CG-OD1 3.43Å; R281-D318 WeakPolarHBondContact CG-OD2 3.43Å; R281-D318 IonicContact CZ-OD2 3.31Å; R281-D318 VanDerWaalsContact CZ-OD2 3.29Å; R281-D318 VanDerWaalsContact NE-CG 3.33Å; R281-D318 PolarHBondContact NE-O 3.45Å; R281-D318 IonicContact NE-OD1 3.11Å; R281-D318 IonicContact NE-OD2 3.5Å; R281-D318 PolarHBondContact NE-OD2 2.8Å; R281-D318 IonicContact NH2-OD2 3.98Å; R281-D318 PolarHBondContact NH2-OD2 2.92Å; R281-D318 VanDerWaalsContact NH2-OD2 3.08Å; Y313-D318 PolarHBondContact OH-OD1 2.83Å; D314-D318 WeakPolarHBondContact O-CA 3.33Å; D314-D318 PolarHBondContact O-N 2.88Å
319	R	97.9	Very high	95.1	Very high	124 Å²	124	50.3 Å²	50.3	47%	0.468	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	135.1	-171.5	-172.7	173.3	69.5	-141	-0.2	113.1	Y313 D314 M317	Y313-R319 WeakPolarHBondContact CA-O 3.42Å; D314-R319 PolarHBondContact N-O 3.09Å; D314-R319 PolarHBondContact O-N 2.82Å; M317-R319 VanDerWaalsContact C-N 3.28Å; M317-R319 HydrophobicContact CB-CB 4.22Å; M317-R319 VanDerWaalsContact CE-NH1 3.33Å; M317-R319 PolarHBondContact O-N 3.18Å; M317-R319 PolarHBondContact SD-NH2 2.99Å
320	W	98.6	Very high	93.9	Very high	9 Å²	9	51.5 Å²	51.5	3%	0.034	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	131.9	165.8	-69	94.6	0	0	0	110.5	V267 R281 P282 L283 N284 L292 L299 A301 E311 K312 Y313	V267-W320 HydrophobicContact CG1-CZ2 4.5Å; V267-W320 HydrophobicContact CG2-CZ2 4.05Å; R281-W320 PolarHBondContact O-NE1 3.17Å; P282-W320 PolarHBondContact O-NE1 3.44Å; L283-W320 HydrophobicContact CD2-CD2 3.93Å; L283-W320 HydrophobicContact CD2-CE3 3.92Å; L283-W320 HydrophobicContact CD2-CH2 3.66Å; L283-W320 HydrophobicContact CD2-CZ2 3.66Å; L283-W320 HydrophobicContact CD2-CZ3 3.79Å; N284-W320 VanDerWaalsContact ND2-CB 3.33Å; N284-W320 WeakPolarHBondContact ND2-CB 3.38Å; N284-W320 PolarHBondContact ND2-O 2.82Å; L292-W320 HydrophobicContact CD1-CH2 4.26Å; L299-W320 HydrophobicContact CB-CH2 4.09Å; A301-W320 HydrophobicContact CB-CH2 4.07Å; A301-W320 HydrophobicContact CB-CZ3 3.69Å; E311-W320 HydrophobicContact CB-CE3 3.8Å; E311-W320 HydrophobicContact CB-CZ3 4.37Å; K312-W320 CarbonylContact O-C 3.59Å; K312-W320 WeakPolarHBondContact O-CA 3.32Å; Y313-W320 AromaticContact CD2-CD1 3.79Å; Y313-W320 HydrophobicContact CD2-CD2 4.08Å; Y313-W320 AromaticContact CD2-CE2 3.79Å; Y313-W320 HydrophobicContact CD2-CG 4.08Å; Y313-W320 HydrophobicContact CD2-CZ2 4.37Å; Y313-W320 AromaticContact CD2-NE1 3.61Å; Y313-W320 HydrophobicContact CG-CD2 4.2Å; Y313-W320 AromaticContact CG-CE2 3.86Å; Y313-W320 HydrophobicContact CG-CH2 4.46Å; Y313-W320 HydrophobicContact CG-CZ2 4.01Å
321	T	98.4	Very high	93	Very high	63 Å²	63	51.7 Å²	51.7	39%	0.387	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133	177.7	-50.3	0	0	0	0	109.1	E311 K312	E311-T321 CarbonylContact C-O 3.51Å; E311-T321 WeakPolarHBondContact CA-O 3.44Å; K312-T321 PolarHBondContact N-O 3.42Å; K312-T321 PolarHBondContact O-N 3.3Å
322	M	98.1	Very high	91.9	Very high	90 Å²	90	54.1 Å²	54.1	44%	0.443	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	135.7	172.7	-53.6	-60.9	-59	0	0	109.6	T309 E311	T309-M322 HydrophobicContact CG2-CE 3.84Å; E311-M322 VanDerWaalsContact CD-SD 3.53Å; E311-M322 HydrophobicContact CG-CE 3.86Å; E311-M322 HydrophobicContact CG-SD 3.27Å; E311-M322 WeakPolarHBondContact CG-SD 3.21Å
323	I	97.8	Very high	91.3	Very high	23 Å²	23	53.5 Å²	53.5	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-176.5	171.6	67.5	173.7	0	0	0	109.3	Y300 V310 K312 Y358	Y300-I323 HydrophobicContact CD1-CD1 3.55Å; Y300-I323 HydrophobicContact CE1-CD1 3.66Å; V310-I323 HydrophobicContact CB-CD1 4.22Å; V310-I323 HydrophobicContact CB-CG1 3.75Å; V310-I323 HydrophobicContact CG1-CD1 3.61Å; V310-I323 HydrophobicContact CG1-CG1 3.67Å; V310-I323 PolarHBondContact O-N 3.04Å; K312-I323 HydrophobicContact CB-CG2 3.84Å; I323-Y358 HydrophobicContact CD1-CE1 4.01Å; I323-Y358 HydrophobicContact CD1-CE2 4.06Å
324	A	96.7	Very high	90.8	Very high	12 Å²	12	53.7 Å²	53.7	10%	0.099	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-49.4	125.6	-179.7	0	0	0	0	0	112.2	Y358 D363 W365	A324-Y358 HydrophobicContact CB-CE2 4.21Å; A324-D363 WeakPolarHBondContact CB-O 3.43Å; A324-D363 WeakPolarHBondContact CB-OD1 3.48Å; A324-D363 PolarHBondContact N-OD1 3.17Å; A324-D363 PolarHBondContact N-OD2 2.95Å; A324-W365 PolarHBondContact O-NE1 3.34Å
325	P	95.9	Very high	90.4	Very high	65 Å²	65	52.7 Å²	52.7	42%	0.422	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-68.9	155.8	175.8	26.6	-31.8	0	0	0	111.6	F308 W365	F308-P325 HydrophobicContact CD2-CB 3.59Å; F308-P325 HydrophobicContact CD2-CG 4.5Å; F308-P325 HydrophobicContact CE2-CB 4.23Å; F308-P325 CarbonylContact O-C 3.53Å; F308-P325 VanDerWaalsContact O-CA 3.31Å; F308-P325 WeakPolarHBondContact O-CA 3.2Å; F308-P325 WeakPolarHBondContact O-CB 3.46Å; P325-W365 PolarHBondContact O-NE1 3.12Å
326	L	93.9	Very high	90.3	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-56.8	144.1	166.4	-63.3	169.8	0	0	0	110.4	I302 F308 V310 K328 F331 A334 L356 W365	I302-L326 HydrophobicContact CG2-CD1 3.94Å; I302-L326 HydrophobicContact CG2-CD2 4.21Å; I302-L326 HydrophobicContact CG2-CG 4.35Å; F308-L326 HydrophobicContact CB-CB 4.35Å; F308-L326 PolarHBondContact O-N 2.67Å; V310-L326 HydrophobicContact CG2-CG 4.02Å; L326-K328 PolarHBondContact O-N 2.91Å; L326-F331 HydrophobicContact CB-CD1 4.13Å; L326-F331 HydrophobicContact CD1-CD1 4.03Å; L326-F331 HydrophobicContact CD1-CE1 3.93Å; L326-F331 HydrophobicContact CD2-CD1 4.15Å; L326-F331 HydrophobicContact CD2-CE1 3.92Å; L326-F331 HydrophobicContact CG-CD1 4.34Å; L326-F331 HydrophobicContact CG-CE1 4.4Å; L326-A334 HydrophobicContact CD1-CB 4.03Å; L326-L356 HydrophobicContact CD2-CD1 4.18Å; L326-W365 HydrophobicContact CD2-CD2 4.16Å; L326-W365 HydrophobicContact CD2-CE3 4.38Å; L326-W365 HydrophobicContact CD2-CH2 4.02Å; L326-W365 HydrophobicContact CD2-CZ2 3.83Å; L326-W365 HydrophobicContact CD2-CZ3 4.3Å
327	P	90.1	Very high	90.3	Very high	55 Å²	55	47.9 Å²	47.9	36%	0.357	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-57	120.2	179.5	-25.2	34.1	0	0	0	112.7	F331 L356 W365	P327-F331 WeakPolarHBondContact O-CB 3.4Å; P327-L356 HydrophobicContact CG-CD1 4.01Å; P327-W365 HydrophobicContact CG-CB 4.25Å
328	K	81.3	Confident	90.3	Very high	152 Å²	152	44 Å²	44	66%	0.661	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	146.8	179.2	-66.3	-177.6	-178.9	-178.6	0	111.6	F308 L326 A330	F308-K328 HydrophobicContact CD1-CG 4.33Å; F308-K328 HydrophobicContact CD2-CG 4.4Å; F308-K328 HydrophobicContact CG-CG 4.23Å; F308-K328 HydrophobicContact CZ-CD 4.46Å; L326-K328 PolarHBondContact O-N 2.91Å; K328-A330 PolarHBondContact O-N 2.93Å
329	G	77.3	Confident	90.3	Very high	68 Å²	68	44.8 Å²	44.8	70%	0.701	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-83	175.3	0	0	0	0	0	113.1	F331	G329-F331 VanDerWaalsContact C-N 3.27Å; G329-F331 PolarHBondContact O-N 3.29Å
330	A	70.1	Confident	90.2	Very high	48 Å²	48	39 Å²	39	40%	0.397	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.5	-172.3	0	0	0	0	0	114.3	K328	K328-A330 PolarHBondContact O-N 2.93Å
331	F	79.3	Confident	89.9	Confident	5 Å²	5	42.4 Å²	42.4	2%	0.022	27%	0.27	C	S	.	.			trans	-116.4	66.7	177.6	-157.7	-85.8	0	0	0	110.3	L326 P327 G329 V333 A334 V346 G348 R354 L356	L326-F331 HydrophobicContact CB-CD1 4.13Å; L326-F331 HydrophobicContact CD1-CD1 4.03Å; L326-F331 HydrophobicContact CD1-CE1 3.93Å; L326-F331 HydrophobicContact CD2-CD1 4.15Å; L326-F331 HydrophobicContact CD2-CE1 3.92Å; L326-F331 HydrophobicContact CG-CD1 4.34Å; L326-F331 HydrophobicContact CG-CE1 4.4Å; P327-F331 WeakPolarHBondContact O-CB 3.4Å; G329-F331 VanDerWaalsContact C-N 3.27Å; G329-F331 PolarHBondContact O-N 3.29Å; F331-V333 VanDerWaalsContact C-N 3.35Å; F331-V333 PolarHBondContact O-N 2.9Å; F331-A334 HydrophobicContact CE1-CB 4.17Å; F331-V346 HydrophobicContact CE1-CG1 3.98Å; F331-V346 HydrophobicContact CZ-CB 4.29Å; F331-V346 HydrophobicContact CZ-CG1 3.75Å; F331-G348 VanDerWaalsContact CE2-CA 3.5Å; F331-R354 HydrophobicContact CD2-CB 4.14Å; F331-R354 HydrophobicContact CE2-CB 4.23Å; F331-L356 HydrophobicContact CB-CD1 4.39Å; F331-L356 HydrophobicContact CD1-CD1 4.02Å; F331-L356 HydrophobicContact CD2-CD1 3.54Å; F331-L356 HydrophobicContact CD2-CG 3.85Å; F331-L356 HydrophobicContact CE1-CD1 4.12Å; F331-L356 HydrophobicContact CE2-CD1 3.64Å; F331-L356 HydrophobicContact CE2-CG 3.67Å; F331-L356 HydrophobicContact CG-CD1 3.72Å; F331-L356 HydrophobicContact CZ-CD1 3.92Å; F331-L356 HydrophobicContact CZ-CG 4.22Å
332	A	75.6	Confident	89.5	Confident	50 Å²	50	41.4 Å²	41.4	41%	0.413	27%	0.272	S	S	.	.			trans	-68.5	-29.7	-172.5	0	0	0	0	0	114.2
333	V	84.4	Confident	89.3	Confident	55 Å²	55	39.8 Å²	39.8	33%	0.333	26%	0.264	S	S	.	.			trans	-143	131.4	-175.6	-176	0	0	0	0	110.2	F331 G348 G349	F331-V333 VanDerWaalsContact C-N 3.35Å; F331-V333 PolarHBondContact O-N 2.9Å; V333-G348 CarbonylContact O-C 3.58Å; V333-G348 WeakPolarHBondContact O-CA 3.32Å; V333-G349 PolarHBondContact O-N 2.93Å
334	A	89.3	Confident	89.3	Confident	7 Å²	7	38.7 Å²	38.7	6%	0.058	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.2	167.1	0	0	0	0	0	109.8	K291 I302 L326 F331 V346	K291-A334 HydrophobicContact CG-CB 4.26Å; I302-A334 HydrophobicContact CG2-CB 4.16Å; L326-A334 HydrophobicContact CD1-CB 4.03Å; F331-A334 HydrophobicContact CE1-CB 4.17Å; A334-V346 HydrophobicContact CB-CG1 3.64Å
335	H	89.4	Confident	89.3	Confident	24 Å²	24	38.2 Å²	38.2	11%	0.111	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-50.7	-179.7	-65.6	151.7	0	0	0	111.9	K291 S347 G349 Y353	K291-H335 VanDerWaalsContact CD-O 3.31Å; K291-H335 WeakPolarHBondContact CD-O 3.33Å; K291-H335 WeakPolarHBondContact CE-O 3.06Å; K291-H335 PolarHBondContact NZ-O 2.79Å; H335-S347 PolarHBondContact N-O 2.88Å; H335-G349 PolarHBondContact CE1-O 2.94Å; H335-Y353 AromaticContact CE1-CD1 3.94Å; H335-Y353 AromaticContact CE1-CE1 3.45Å; H335-Y353 VanDerWaalsContact CE1-CE1 3.45Å; H335-Y353 WeakPolarHBondContact CE1-CE1 3.35Å; H335-Y353 AromaticContact ND1-CD1 3.61Å; H335-Y353 AromaticContact ND1-CE1 3.47Å; H335-Y353 WeakPolarHBondContact ND1-CE1 3.31Å
336	E	93.1	Very high	89.3	Confident	7 Å²	7	35.1 Å²	35.1	3%	0.033	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.1	175.9	-58.6	-55	154.5	0	0	111.4	V346 S347 M380 R425	E336-V346 CarbonylContact O-C 3.39Å; E336-V346 WeakPolarHBondContact O-CA 3.41Å; E336-V346 WeakPolarHBondContact O-CG1 3.46Å; E336-S347 WeakPolarHBondContact CB-OG 3.4Å; E336-S347 PolarHBondContact N-O 3.12Å; E336-S347 VanDerWaalsContact N-O 3.12Å; E336-S347 PolarHBondContact N-OG 2.69Å; E336-S347 PolarHBondContact O-N 3.03Å; E336-M380 HydrophobicContact CB-CB 3.81Å; E336-M380 HydrophobicContact CB-CE 4.12Å; E336-M380 HydrophobicContact CG-CB 4.29Å; E336-R425 VanDerWaalsContact CD-NH1 3.34Å; E336-R425 IonicContact OE1-CZ 3.04Å; E336-R425 IonicContact OE1-NH1 3.9Å; E336-R425 PolarHBondContact OE1-NH1 2.72Å; E336-R425 IonicContact OE1-NH2 2.58Å; E336-R425 IonicContact OE2-CZ 2.7Å; E336-R425 VanDerWaalsContact OE2-CZ 3.3Å; E336-R425 IonicContact OE2-NH1 3Å; E336-R425 PolarHBondContact OE2-NH1 2.88Å; E336-R425 IonicContact OE2-NH2 3.45Å; E336-R425 PolarHBondContact OE2-NH2 3.5Å
337	A	96.1	Very high	89.2	Confident	15 Å²	15	35.5 Å²	35.5	12%	0.124	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.4	173.8	0	0	0	0	0	109.8	K291 V293 I302 Y345 V346	K291-A337 HydrophobicContact CB-CB 3.77Å; K291-A337 HydrophobicContact CG-CB 4.32Å; V293-A337 HydrophobicContact CG1-CB 3.57Å; I302-A337 HydrophobicContact CD1-CB 3.88Å; A337-Y345 CarbonylContact C-O 3.59Å; A337-Y345 WeakPolarHBondContact CA-O 3.48Å; A337-V346 HydrophobicContact CB-CG2 4.07Å
338	T	97	Very high	89.2	Confident	19 Å²	19	32.9 Å²	32.9	12%	0.117	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	165.3	176.4	-158	0	0	0	0	110.1	Y345 M380 A382 I387	T338-Y345 PolarHBondContact N-O 2.83Å; T338-Y345 PolarHBondContact O-N 3.34Å; T338-M380 HydrophobicContact CG2-CE 3.99Å; T338-M380 HydrophobicContact CG2-CG 4.25Å; T338-A382 HydrophobicContact CG2-CB 4.24Å; T338-A382 PolarHBondContact OG1-N 3.12Å; T338-I387 HydrophobicContact CG2-CD1 4.21Å; T338-I387 HydrophobicContact CG2-CG1 4.16Å; T338-I387 HydrophobicContact CG2-CG2 4.04Å
339	T	96.8	Very high	89.3	Confident	46 Å²	46	25.6 Å²	25.6	28%	0.282	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.2	175	54.9	0	0	0	0	110	V293 S294 M295 E343 L344 A382	V293-T339 HydrophobicContact CB-CG2 4.17Å; V293-T339 HydrophobicContact CG2-CG2 4.23Å; S294-T339 VanDerWaalsContact O-CG2 3.25Å; S294-T339 WeakPolarHBondContact O-CG2 3.31Å; S294-T339 PolarHBondContact O-OG1 3.28Å; M295-T339 HydrophobicContact CB-CG2 3.98Å; M295-T339 HydrophobicContact CG-CG2 4.44Å; T339-E343 CarbonylContact C-O 3.52Å; T339-E343 VanDerWaalsContact CA-O 3.23Å; T339-E343 WeakPolarHBondContact CA-O 3.04Å; T339-L344 HydrophobicContact CG2-CB 4.25Å; T339-L344 HydrophobicContact CG2-CG 4.34Å; T339-A382 WeakPolarHBondContact O-CB 3.4Å
340	C	96.1	Very high	89.2	Confident	3 Å²	3	25.8 Å²	25.8	2%	0.02	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	127.4	-177	-172.8	0	0	0	0	108.7	G342 E343 Y345 A382 K384 I387 T405	C340-G342 VanDerWaalsContact C-N 3.26Å; C340-G342 PolarHBondContact O-N 2.78Å; C340-E343 PolarHBondContact N-O 3.12Å; C340-E343 WeakPolarHBondContact O-CB 3.2Å; C340-E343 PolarHBondContact O-N 3.31Å; C340-Y345 HydrophobicContact CB-CD2 4.25Å; C340-Y345 HydrophobicContact CB-CE2 4.1Å; C340-A382 HydrophobicContact CB-CB 3.67Å; C340-K384 PolarHBondContact SG-O 2.68Å; C340-I387 HydrophobicContact CB-CD1 4.25Å; C340-I387 HydrophobicContact CB-CG1 3.87Å; C340-T405 HydrophobicContact CB-CG2 4Å; C340-T405 VanDerWaalsContact SG-CG2 3.58Å
341	S	90.8	Very high	89.3	Confident	81 Å²	81	30.3 Å²	30.3	57%	0.566	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	37.7	178	-57.1	0	0	0	0	114.8	E343	S341-E343 VanDerWaalsContact C-N 3.3Å
342	G	90.2	Very high	89	Confident	41 Å²	41	35.8 Å²	35.8	42%	0.423	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	14.7	-179.3	0	0	0	0	0	114.3	M295 C340	M295-G342 VanDerWaalsContact SD-O 3.36Å; C340-G342 VanDerWaalsContact C-N 3.26Å; C340-G342 PolarHBondContact O-N 2.78Å
343	E	94.3	Very high	89.3	Confident	56 Å²	56	36.4 Å²	36.4	26%	0.262	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	148.9	-179.6	-54	-178.5	142.9	0	0	110.2	T339 C340 S341 Y345 K357	T339-E343 CarbonylContact C-O 3.52Å; T339-E343 VanDerWaalsContact CA-O 3.23Å; T339-E343 WeakPolarHBondContact CA-O 3.04Å; C340-E343 PolarHBondContact N-O 3.12Å; C340-E343 WeakPolarHBondContact O-CB 3.2Å; C340-E343 PolarHBondContact O-N 3.31Å; S341-E343 VanDerWaalsContact C-N 3.3Å; E343-Y345 HydrophobicContact CB-CD2 4.41Å; E343-Y345 HydrophobicContact CB-CE2 3.66Å; E343-Y345 PolarHBondContact OE2-OH 2.74Å; E343-K357 VanDerWaalsContact OE1-CE 3.23Å; E343-K357 WeakPolarHBondContact OE1-CE 3.47Å; E343-K357 IonicContact OE1-NZ 3.54Å; E343-K357 PolarHBondContact OE1-NZ 3.45Å; E343-K357 VanDerWaalsContact OE2-CE 3.23Å; E343-K357 WeakPolarHBondContact OE2-CE 3.44Å; E343-K357 IonicContact OE2-NZ 3.13Å; E343-K357 PolarHBondContact OE2-NZ 3.31Å
344	L	97.2	Very high	89.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.7	-176.7	-177	163.7	0	0	0	110.1	V293 M295 Y300 I302 T339 V346 K357 Y358 W365	V293-L344 HydrophobicContact CG2-CD1 3.62Å; V293-L344 HydrophobicContact CG2-CG 3.96Å; M295-L344 HydrophobicContact CE-CB 4.41Å; M295-L344 HydrophobicContact SD-CB 3.67Å; Y300-L344 HydrophobicContact CD1-CD1 3.81Å; Y300-L344 HydrophobicContact CD2-CD1 3.98Å; Y300-L344 HydrophobicContact CE1-CD1 4.42Å; Y300-L344 HydrophobicContact CG-CD1 3.56Å; I302-L344 HydrophobicContact CD1-CD1 4.19Å; I302-L344 HydrophobicContact CD1-CD2 3.92Å; I302-L344 HydrophobicContact CD1-CG 4.43Å; T339-L344 HydrophobicContact CG2-CB 4.25Å; T339-L344 HydrophobicContact CG2-CG 4.34Å; L344-V346 HydrophobicContact CD2-CG2 3.62Å; L344-K357 WeakPolarHBondContact O-CA 3.17Å; L344-Y358 PolarHBondContact O-N 2.86Å; L344-W365 HydrophobicContact CD2-CH2 3.41Å; L344-W365 VanDerWaalsContact CD2-CH2 3.41Å; L344-W365 HydrophobicContact CD2-CZ3 3.72Å
345	Y	97.1	Very high	89.7	Confident	1 Å²	1	37.4 Å²	37.4	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.2	-178.5	-67.4	-94	0	0	0	111.4	A337 T338 C340 E343 L355 L356 K357 I387 Y403 T405	A337-Y345 CarbonylContact C-O 3.59Å; A337-Y345 WeakPolarHBondContact CA-O 3.48Å; T338-Y345 PolarHBondContact N-O 2.83Å; T338-Y345 PolarHBondContact O-N 3.34Å; C340-Y345 HydrophobicContact CB-CD2 4.25Å; C340-Y345 HydrophobicContact CB-CE2 4.1Å; E343-Y345 HydrophobicContact CB-CD2 4.41Å; E343-Y345 HydrophobicContact CB-CE2 3.66Å; E343-Y345 PolarHBondContact OE2-OH 2.74Å; Y345-L355 HydrophobicContact CD1-CD1 4.3Å; Y345-L355 HydrophobicContact CD1-CD2 4.15Å; Y345-L355 HydrophobicContact CD1-CG 4.21Å; Y345-L356 CarbonylContact C-O 3.6Å; Y345-L356 WeakPolarHBondContact CA-O 3.42Å; Y345-K357 HydrophobicContact CD1-CB 3.98Å; Y345-K357 HydrophobicContact CD1-CG 4.48Å; Y345-K357 HydrophobicContact CE1-CB 3.8Å; Y345-K357 HydrophobicContact CE1-CD 4.04Å; Y345-K357 HydrophobicContact CE1-CG 4.02Å; Y345-I387 HydrophobicContact CD1-CD1 3.67Å; Y345-I387 HydrophobicContact CD2-CD1 3.5Å; Y345-I387 VanDerWaalsContact CD2-CD1 3.5Å; Y345-I387 HydrophobicContact CE1-CD1 4.09Å; Y345-I387 HydrophobicContact CE2-CD1 3.93Å; Y345-I387 HydrophobicContact CG-CD1 3.35Å; Y345-Y403 HydrophobicContact CE1-CE1 4.02Å; Y345-T405 HydrophobicContact CE2-CG2 3.98Å
346	V	95.6	Very high	90	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	126.3	178.4	-171.6	0	0	0	0	109.4	I302 F331 A334 E336 A337 L344 L356 W365	I302-V346 HydrophobicContact CD1-CG2 3.79Å; I302-V346 HydrophobicContact CG2-CG1 4.25Å; I302-V346 HydrophobicContact CG2-CG2 4.09Å; F331-V346 HydrophobicContact CE1-CG1 3.98Å; F331-V346 HydrophobicContact CZ-CB 4.29Å; F331-V346 HydrophobicContact CZ-CG1 3.75Å; A334-V346 HydrophobicContact CB-CG1 3.64Å; E336-V346 CarbonylContact O-C 3.39Å; E336-V346 WeakPolarHBondContact O-CA 3.41Å; E336-V346 WeakPolarHBondContact O-CG1 3.46Å; A337-V346 HydrophobicContact CB-CG2 4.07Å; L344-V346 HydrophobicContact CD2-CG2 3.62Å; V346-L356 PolarHBondContact N-O 2.82Å; V346-L356 PolarHBondContact O-N 2.86Å; V346-W365 HydrophobicContact CB-CH2 4.45Å; V346-W365 HydrophobicContact CB-CZ3 4.13Å; V346-W365 HydrophobicContact CG2-CH2 3.47Å; V346-W365 VanDerWaalsContact CG2-CH2 3.47Å; V346-W365 HydrophobicContact CG2-CZ3 3.52Å
347	S	92.8	Very high	90.1	Very high	11 Å²	11	37.5 Å²	37.5	8%	0.077	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	141	169.9	75.8	0	0	0	0	110.4	H335 E336 R354	H335-S347 PolarHBondContact N-O 2.88Å; E336-S347 WeakPolarHBondContact CB-OG 3.4Å; E336-S347 PolarHBondContact N-O 3.12Å; E336-S347 VanDerWaalsContact N-O 3.12Å; E336-S347 PolarHBondContact N-OG 2.69Å; E336-S347 PolarHBondContact O-N 3.03Å; S347-R354 VanDerWaalsContact CA-O 3.26Å; S347-R354 WeakPolarHBondContact CA-O 3.36Å
348	G	89.4	Confident	90.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.7	-169.7	-174.2	0	0	0	0	0	114.2	F331 V333 Y353 R354	F331-G348 VanDerWaalsContact CE2-CA 3.5Å; V333-G348 CarbonylContact O-C 3.58Å; V333-G348 WeakPolarHBondContact O-CA 3.32Å; G348-Y353 CarbonylContact O-C 3.5Å; G348-Y353 WeakPolarHBondContact O-CA 3.16Å; G348-R354 PolarHBondContact N-O 2.87Å; G348-R354 VanDerWaalsContact N-O 3.09Å; G348-R354 PolarHBondContact O-N 2.86Å
349	G	83.4	Confident	90	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.			trans	102.9	158.9	-175.5	0	0	0	0	0	113.4	V333 H335	V333-G349 PolarHBondContact O-N 2.93Å; H335-G349 PolarHBondContact CE1-O 2.94Å
350	S	75	Confident	89.8	Confident	72 Å²	72	38.7 Å²	38.7	50%	0.503	21%	0.213	S	C	.	.	S	Bend	trans	-101.6	-27.6	-171.5	-54.8	0	0	0	0	114.9
351	L	71.4	Confident	89.5	Confident	143 Å²	143	48.1 Å²	48.1	75%	0.749	25%	0.254	S	S	*	.	S	Bend	trans	-117.1	-36.9	-177.4	-66.1	173.9	0	0	0	112.2
352	F	74.2	Confident	89.7	Confident	119 Å²	119	51.5 Å²	51.5	52%	0.522	25%	0.254	S	S	.	.	S	Bend	trans	-127.3	119.5	175.3	-55.4	-77	0	0	0	107.4	R354	F352-R354 PolarHBondContact O-N 2.95Å
353	Y	82.3	Confident	90	Very high	64 Å²	64	52.9 Å²	52.9	25%	0.251	25%	0.252	S	S	.	.			trans	-76.3	112	177.7	-61.4	-83.7	0	0	0	108.8	H335 G348 R374 K375 K376	H335-Y353 AromaticContact CE1-CD1 3.94Å; H335-Y353 AromaticContact CE1-CE1 3.45Å; H335-Y353 VanDerWaalsContact CE1-CE1 3.45Å; H335-Y353 WeakPolarHBondContact CE1-CE1 3.35Å; H335-Y353 AromaticContact ND1-CD1 3.61Å; H335-Y353 AromaticContact ND1-CE1 3.47Å; H335-Y353 WeakPolarHBondContact ND1-CE1 3.31Å; G348-Y353 CarbonylContact O-C 3.5Å; G348-Y353 WeakPolarHBondContact O-CA 3.16Å; Y353-R374 VanDerWaalsContact CD2-C 3.5Å; Y353-R374 VanDerWaalsContact CD2-O 3.28Å; Y353-R374 WeakPolarHBondContact CD2-O 3.18Å; Y353-R374 WeakPolarHBondContact CE2-O 3.44Å; Y353-K375 VanDerWaalsContact CD2-C 3.42Å; Y353-K375 WeakPolarHBondContact CD2-O 2.94Å; Y353-K376 HydrophobicContact CD1-CB 4.45Å; Y353-K376 VanDerWaalsContact CE1-CA 3.46Å; Y353-K376 HydrophobicContact CE1-CB 3.55Å; Y353-K376 HydrophobicContact CE1-CG 3.96Å; Y353-K376 VanDerWaalsContact CZ-N 3.3Å
354	R	88.6	Confident	90	Very high	75 Å²	75	54.2 Å²	54.2	28%	0.283	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	154.5	-178.9	-61.5	177	-176.7	-147.1	1.9	109.9	F331 S347 G348 F352 E367	F331-R354 HydrophobicContact CD2-CB 4.14Å; F331-R354 HydrophobicContact CE2-CB 4.23Å; S347-R354 VanDerWaalsContact CA-O 3.26Å; S347-R354 WeakPolarHBondContact CA-O 3.36Å; G348-R354 PolarHBondContact N-O 2.87Å; G348-R354 VanDerWaalsContact N-O 3.09Å; G348-R354 PolarHBondContact O-N 2.86Å; F352-R354 PolarHBondContact O-N 2.95Å; R354-E367 VanDerWaalsContact CD-OE1 3.27Å; R354-E367 WeakPolarHBondContact CD-OE1 3.38Å; R354-E367 WeakPolarHBondContact CG-OE1 3.47Å; R354-E367 IonicContact CZ-OE1 3.78Å; R354-E367 IonicContact CZ-OE2 3.55Å; R354-E367 IonicContact NE-OE1 2.64Å; R354-E367 IonicContact NH1-OE1 2.95Å; R354-E367 IonicContact NH1-OE2 3.61Å; R354-E367 PolarHBondContact NH1-OE2 3Å
355	L	93.3	Very high	90	Very high	7 Å²	7	55.6 Å²	55.6	4%	0.037	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121	166.6	-178.5	66.8	0	0	0	107.6	Y345 C368 M380 Y403 W410	Y345-L355 HydrophobicContact CD1-CD1 4.3Å; Y345-L355 HydrophobicContact CD1-CD2 4.15Å; Y345-L355 HydrophobicContact CD1-CG 4.21Å; L355-C368 HydrophobicContact CB-CB 4.03Å; L355-C368 HydrophobicContact CD2-CB 3.9Å; L355-C368 HydrophobicContact CG-CB 3.96Å; L355-C368 WeakPolarHBondContact O-CB 3.43Å; L355-C368 PolarHBondContact O-N 2.82Å; L355-M380 HydrophobicContact CD1-CE 4.34Å; L355-M380 HydrophobicContact CD1-SD 3.96Å; L355-Y403 HydrophobicContact CD2-CD1 3.9Å; L355-Y403 HydrophobicContact CD2-CE1 4.04Å; L355-Y403 HydrophobicContact CD2-CG 4.14Å; L355-W410 HydrophobicContact CB-CZ2 4.39Å; L355-W410 HydrophobicContact CD2-CH2 4.44Å; L355-W410 HydrophobicContact CD2-CZ2 3.7Å
356	L	94.9	Very high	89.8	Confident	4 Å²	4	59 Å²	59	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	147.5	173.4	-58.6	-178.6	0	0	0	109.8	L326 P327 F331 Y345 V346 W365 Q366 E367	L326-L356 HydrophobicContact CD2-CD1 4.18Å; P327-L356 HydrophobicContact CG-CD1 4.01Å; F331-L356 HydrophobicContact CB-CD1 4.39Å; F331-L356 HydrophobicContact CD1-CD1 4.02Å; F331-L356 HydrophobicContact CD2-CD1 3.54Å; F331-L356 HydrophobicContact CD2-CG 3.85Å; F331-L356 HydrophobicContact CE1-CD1 4.12Å; F331-L356 HydrophobicContact CE2-CD1 3.64Å; F331-L356 HydrophobicContact CE2-CG 3.67Å; F331-L356 HydrophobicContact CG-CD1 3.72Å; F331-L356 HydrophobicContact CZ-CD1 3.92Å; F331-L356 HydrophobicContact CZ-CG 4.22Å; Y345-L356 CarbonylContact C-O 3.6Å; Y345-L356 WeakPolarHBondContact CA-O 3.42Å; V346-L356 PolarHBondContact N-O 2.82Å; V346-L356 PolarHBondContact O-N 2.86Å; L356-W365 HydrophobicContact CB-CE3 3.73Å; L356-W365 HydrophobicContact CB-CZ3 4.24Å; L356-W365 HydrophobicContact CD1-CE3 4.4Å; L356-Q366 CarbonylContact C-O 3.55Å; L356-Q366 WeakPolarHBondContact CA-O 3.23Å; L356-E367 HydrophobicContact CD2-CB 4.11Å; L356-E367 HydrophobicContact CD2-CG 4.34Å
357	K	96.1	Very high	89.7	Confident	29 Å²	29	64.2 Å²	64.2	13%	0.126	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134	171.2	171.3	-179.3	169.2	166.8	0	108.9	E343 L344 Y345 Q366	E343-K357 VanDerWaalsContact OE1-CE 3.23Å; E343-K357 WeakPolarHBondContact OE1-CE 3.47Å; E343-K357 IonicContact OE1-NZ 3.54Å; E343-K357 PolarHBondContact OE1-NZ 3.45Å; E343-K357 VanDerWaalsContact OE2-CE 3.23Å; E343-K357 WeakPolarHBondContact OE2-CE 3.44Å; E343-K357 IonicContact OE2-NZ 3.13Å; E343-K357 PolarHBondContact OE2-NZ 3.31Å; L344-K357 WeakPolarHBondContact O-CA 3.17Å; Y345-K357 HydrophobicContact CD1-CB 3.98Å; Y345-K357 HydrophobicContact CD1-CG 4.48Å; Y345-K357 HydrophobicContact CE1-CB 3.8Å; Y345-K357 HydrophobicContact CE1-CD 4.04Å; Y345-K357 HydrophobicContact CE1-CG 4.02Å; K357-Q366 PolarHBondContact N-O 3.37Å; K357-Q366 PolarHBondContact O-N 2.88Å
358	Y	96.8	Very high	89.7	Confident	9 Å²	9	64.3 Å²	64.3	4%	0.035	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132	174.8	178.7	-115.8	0	0	0	111	M295 Y300 I323 A324 L344 P360 D363 W365	M295-Y358 HydrophobicContact CE-CD1 4.4Å; Y300-Y358 HydrophobicContact CE1-CE1 4.06Å; I323-Y358 HydrophobicContact CD1-CE1 4.01Å; I323-Y358 HydrophobicContact CD1-CE2 4.06Å; A324-Y358 HydrophobicContact CB-CE2 4.21Å; L344-Y358 PolarHBondContact O-N 2.86Å; Y358-P360 HydrophobicContact CD1-CB 4.33Å; Y358-P360 HydrophobicContact CE1-CB 3.81Å; Y358-P360 WeakPolarHBondContact O-CD 3.3Å; Y358-D363 WeakPolarHBondContact CE2-OD1 3.04Å; Y358-D363 PolarHBondContact OH-OD1 3.38Å; Y358-W365 HydrophobicContact CD2-CD2 4.19Å; Y358-W365 AromaticContact CD2-CE2 3.9Å; Y358-W365 HydrophobicContact CD2-CZ2 4.12Å; Y358-W365 HydrophobicContact CG-CH2 4.47Å; Y358-W365 HydrophobicContact CG-CZ2 4.36Å
359	D	93.4	Very high	89.8	Confident	32 Å²	32	67.2 Å²	67.2	17%	0.171	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	103.6	171	-175.4	-19.9	0	0	0	109.5	K361 R362 D363 E364 Q366	D359-K361 PolarHBondContact O-N 2.82Å; D359-K361 WeakPolarHBondContact OD1-CB 3.46Å; D359-K361 PolarHBondContact OD1-N 2.8Å; D359-R362 HydrophobicContact CB-CB 4.31Å; D359-R362 PolarHBondContact O-N 2.9Å; D359-R362 PolarHBondContact OD1-N 3.22Å; D359-R362 VanDerWaalsContact OD2-CD 3.29Å; D359-R362 WeakPolarHBondContact OD2-CD 3.43Å; D359-R362 WeakPolarHBondContact OD2-CG 3.12Å; D359-D363 WeakPolarHBondContact O-CA 3.46Å; D359-D363 PolarHBondContact O-N 3.1Å; D359-E364 PolarHBondContact N-O 2.91Å; D359-E364 PolarHBondContact O-N 2.64Å; D359-Q366 PolarHBondContact OD2-NE2 2.86Å
360	P	92.2	Very high	89.7	Confident	65 Å²	65	75.9 Å²	75.9	42%	0.422	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.7	-177.8	28.4	-35.3	0	0	0	113.8	M295 Y358	M295-P360 HydrophobicContact CE-CB 4.25Å; M295-P360 HydrophobicContact CE-CG 4.27Å; Y358-P360 HydrophobicContact CD1-CB 4.33Å; Y358-P360 HydrophobicContact CE1-CB 3.81Å; Y358-P360 WeakPolarHBondContact O-CD 3.3Å
361	K	91.6	Very high	89.9	Confident	201 Å²	201	73.1 Å²	73.1	87%	0.874	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-37.5	178.4	-64.3	-178.5	-179.9	177.5	0	111.4	D359	D359-K361 PolarHBondContact O-N 2.82Å; D359-K361 WeakPolarHBondContact OD1-CB 3.46Å; D359-K361 PolarHBondContact OD1-N 2.8Å
362	R	94.3	Very high	90.2	Very high	151 Å²	151	72.7 Å²	72.7	57%	0.57	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-16	179.9	-65.5	-178.7	61.4	170.7	-5	113.3	D359 E364	D359-R362 HydrophobicContact CB-CB 4.31Å; D359-R362 PolarHBondContact O-N 2.9Å; D359-R362 PolarHBondContact OD1-N 3.22Å; D359-R362 VanDerWaalsContact OD2-CD 3.29Å; D359-R362 WeakPolarHBondContact OD2-CD 3.43Å; D359-R362 WeakPolarHBondContact OD2-CG 3.12Å; R362-E364 HydrophobicContact CB-CB 4.21Å; R362-E364 HydrophobicContact CB-CG 4.2Å; R362-E364 IonicContact CZ-OE2 2.63Å; R362-E364 IonicContact NE-OE1 2.68Å; R362-E364 IonicContact NE-OE2 2.76Å; R362-E364 PolarHBondContact NE-OE2 3.12Å; R362-E364 VanDerWaalsContact NE-OE2 3.11Å; R362-E364 IonicContact NH2-OE1 3.64Å; R362-E364 PolarHBondContact NH2-OE1 3.13Å; R362-E364 IonicContact NH2-OE2 3.04Å; R362-E364 PolarHBondContact NH2-OE2 2.91Å
363	D	95.8	Very high	90.3	Very high	71 Å²	71	67.9 Å²	67.9	38%	0.38	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	57.7	-168.8	-168.1	24.9	0	0	0	110.2	A324 Y358 D359	A324-D363 WeakPolarHBondContact CB-O 3.43Å; A324-D363 WeakPolarHBondContact CB-OD1 3.48Å; A324-D363 PolarHBondContact N-OD1 3.17Å; A324-D363 PolarHBondContact N-OD2 2.95Å; Y358-D363 WeakPolarHBondContact CE2-OD1 3.04Å; Y358-D363 PolarHBondContact OH-OD1 3.38Å; D359-D363 WeakPolarHBondContact O-CA 3.46Å; D359-D363 PolarHBondContact O-N 3.1Å
364	E	95.7	Very high	90	Very high	83 Å²	83	74.1 Å²	74.1	39%	0.388	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	153	-176.3	-74.1	177.7	-174.3	0	0	111.6	D359 R362	D359-E364 PolarHBondContact N-O 2.91Å; D359-E364 PolarHBondContact O-N 2.64Å; R362-E364 HydrophobicContact CB-CB 4.21Å; R362-E364 HydrophobicContact CB-CG 4.2Å; R362-E364 IonicContact CZ-OE2 2.63Å; R362-E364 IonicContact NE-OE1 2.68Å; R362-E364 IonicContact NE-OE2 2.76Å; R362-E364 PolarHBondContact NE-OE2 3.12Å; R362-E364 VanDerWaalsContact NE-OE2 3.11Å; R362-E364 IonicContact NH2-OE1 3.64Å; R362-E364 PolarHBondContact NH2-OE1 3.13Å; R362-E364 IonicContact NH2-OE2 3.04Å; R362-E364 PolarHBondContact NH2-OE2 2.91Å
365	W	95.4	Very high	89.6	Confident	31 Å²	31	74.2 Å²	74.2	12%	0.117	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.6	173.4	-67.6	92	0	0	0	111.1	V310 A324 P325 L326 P327 L344 V346 L356 Y358	V310-W365 HydrophobicContact CG1-CZ2 4.47Å; V310-W365 HydrophobicContact CG2-CZ2 4.02Å; A324-W365 PolarHBondContact O-NE1 3.34Å; P325-W365 PolarHBondContact O-NE1 3.12Å; L326-W365 HydrophobicContact CD2-CD2 4.16Å; L326-W365 HydrophobicContact CD2-CE3 4.38Å; L326-W365 HydrophobicContact CD2-CH2 4.02Å; L326-W365 HydrophobicContact CD2-CZ2 3.83Å; L326-W365 HydrophobicContact CD2-CZ3 4.3Å; P327-W365 HydrophobicContact CG-CB 4.25Å; L344-W365 HydrophobicContact CD2-CH2 3.41Å; L344-W365 VanDerWaalsContact CD2-CH2 3.41Å; L344-W365 HydrophobicContact CD2-CZ3 3.72Å; V346-W365 HydrophobicContact CB-CH2 4.45Å; V346-W365 HydrophobicContact CB-CZ3 4.13Å; V346-W365 HydrophobicContact CG2-CH2 3.47Å; V346-W365 VanDerWaalsContact CG2-CH2 3.47Å; V346-W365 HydrophobicContact CG2-CZ3 3.52Å; L356-W365 HydrophobicContact CB-CE3 3.73Å; L356-W365 HydrophobicContact CB-CZ3 4.24Å; L356-W365 HydrophobicContact CD1-CE3 4.4Å; Y358-W365 HydrophobicContact CD2-CD2 4.19Å; Y358-W365 AromaticContact CD2-CE2 3.9Å; Y358-W365 HydrophobicContact CD2-CZ2 4.12Å; Y358-W365 HydrophobicContact CG-CH2 4.47Å; Y358-W365 HydrophobicContact CG-CZ2 4.36Å
366	Q	94.4	Very high	89.1	Confident	72 Å²	72	79 Å²	79	34%	0.336	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.1	178.2	-62.8	176.1	21.5	0	0	110.1	L356 K357 D359	L356-Q366 CarbonylContact C-O 3.55Å; L356-Q366 WeakPolarHBondContact CA-O 3.23Å; K357-Q366 PolarHBondContact N-O 3.37Å; K357-Q366 PolarHBondContact O-N 2.88Å; D359-Q366 PolarHBondContact OD2-NE2 2.86Å
367	E	92.9	Very high	88.6	Confident	110 Å²	110	79.1 Å²	79.1	51%	0.514	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.5	175.8	-170	162.1	175.7	0	0	110.5	R354 L356	R354-E367 VanDerWaalsContact CD-OE1 3.27Å; R354-E367 WeakPolarHBondContact CD-OE1 3.38Å; R354-E367 WeakPolarHBondContact CG-OE1 3.47Å; R354-E367 IonicContact CZ-OE1 3.78Å; R354-E367 IonicContact CZ-OE2 3.55Å; R354-E367 IonicContact NE-OE1 2.64Å; R354-E367 IonicContact NH1-OE1 2.95Å; R354-E367 IonicContact NH1-OE2 3.61Å; R354-E367 PolarHBondContact NH1-OE2 3Å; L356-E367 HydrophobicContact CD2-CB 4.11Å; L356-E367 HydrophobicContact CD2-CG 4.34Å
368	C	93.2	Very high	88.2	Confident	13 Å²	13	78.6 Å²	78.6	9%	0.088	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-88.1	162.1	173	-69.1	0	0	0	0	110.6	L355	L355-C368 HydrophobicContact CB-CB 4.03Å; L355-C368 HydrophobicContact CD2-CB 3.9Å; L355-C368 HydrophobicContact CG-CB 3.96Å; L355-C368 WeakPolarHBondContact O-CB 3.43Å; L355-C368 PolarHBondContact O-N 2.82Å
369	P	90.4	Very high	88	Confident	60 Å²	60	78.6 Å²	78.6	39%	0.39	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-52.7	145.3	175.8	-32.1	42	0	0	0	113	K408 W410	P369-K408 HydrophobicContact CG-CB 4.48Å; P369-K408 WeakPolarHBondContact CG-O 3.35Å; P369-W410 PolarHBondContact O-NE1 2.86Å
370	Y	82.3	Confident	88.1	Confident	182 Å²	182	77.2 Å²	77.2	71%	0.714	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-73.3	147	-175.6	59.9	-92.1	0	0	0	111.6
371	N	79	Confident	88.3	Confident	14 Å²	14	74.7 Å²	74.7	8%	0.075	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-88.3	144.6	166.4	-173.6	-66.5	0	0	0	108.7	S373 F401 W410	N371-S373 PolarHBondContact O-N 2.82Å; N371-S373 WeakPolarHBondContact OD1-CA 3.44Å; N371-S373 WeakPolarHBondContact OD1-CB 3.41Å; N371-S373 PolarHBondContact OD1-N 2.94Å; N371-F401 WeakPolarHBondContact ND2-CB 3.28Å; N371-F401 WeakPolarHBondContact ND2-CG 3.15Å; N371-W410 HydrophobicContact CB-CD2 3.91Å; N371-W410 HydrophobicContact CB-CE3 4.38Å; N371-W410 HydrophobicContact CB-CG 4.19Å; N371-W410 HydrophobicContact CB-CZ2 4.15Å; N371-W410 WeakPolarHBondContact ND2-CZ3 3.36Å
372	N	76.8	Confident	88.6	Confident	134 Å²	134	66.2 Å²	66.2	72%	0.717	31%	0.307	S	S	*	.	S	Bend	trans	-66.2	-25.1	178.2	-72.1	-23.8	0	0	0	113.1	R374	N372-R374 PolarHBondContact O-N 2.72Å
373	S	76.8	Confident	88.7	Confident	19 Å²	19	59.7 Å²	59.7	13%	0.133	28%	0.284	C	S	.	.			trans	-70.5	118.4	174.2	-176.6	0	0	0	0	111.4	N371 K375 R389 D391	N371-S373 PolarHBondContact O-N 2.82Å; N371-S373 WeakPolarHBondContact OD1-CA 3.44Å; N371-S373 WeakPolarHBondContact OD1-CB 3.41Å; N371-S373 PolarHBondContact OD1-N 2.94Å; S373-K375 VanDerWaalsContact C-N 3.26Å; S373-K375 PolarHBondContact O-N 3.4Å; S373-K375 PolarHBondContact OG-N 3.18Å; S373-R389 PolarHBondContact OG-NH2 3.29Å; S373-D391 VanDerWaalsContact CB-OD2 3.31Å; S373-D391 WeakPolarHBondContact CB-OD2 3.22Å; S373-D391 PolarHBondContact OG-OD2 2.96Å
374	R	76.3	Confident	88.6	Confident	194 Å²	194	62.1 Å²	62.1	73%	0.732	29%	0.291	S	S	*	.			trans	-89.1	18.6	173.3	-57.8	-172	-179.2	-143	0.8	113	Y353 N372	Y353-R374 VanDerWaalsContact CD2-C 3.5Å; Y353-R374 VanDerWaalsContact CD2-O 3.28Å; Y353-R374 WeakPolarHBondContact CD2-O 3.18Å; Y353-R374 WeakPolarHBondContact CE2-O 3.44Å; N372-R374 PolarHBondContact O-N 2.72Å
375	K	79.8	Confident	88.5	Confident	78 Å²	78	59.5 Å²	59.5	34%	0.339	28%	0.282	S	S	.	.	S	Bend	trans	-98.8	160.5	-178.4	-61.6	-175.4	-176.6	178.1	0	111.6	Y353 S373 R389 N393	Y353-K375 VanDerWaalsContact CD2-C 3.42Å; Y353-K375 WeakPolarHBondContact CD2-O 2.94Å; S373-K375 VanDerWaalsContact C-N 3.26Å; S373-K375 PolarHBondContact O-N 3.4Å; S373-K375 PolarHBondContact OG-N 3.18Å; K375-R389 PolarHBondContact O-NH2 2.55Å; K375-N393 PolarHBondContact NZ-ND2 3Å
376	K	82.1	Confident	88.5	Confident	106 Å²	106	60.2 Å²	60.2	46%	0.461	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-72.3	130.9	165.8	-171.9	178.2	174.3	-176.4	0	108.1	Y353	Y353-K376 HydrophobicContact CD1-CB 4.45Å; Y353-K376 VanDerWaalsContact CE1-CA 3.46Å; Y353-K376 HydrophobicContact CE1-CB 3.55Å; Y353-K376 HydrophobicContact CE1-CG 3.96Å; Y353-K376 VanDerWaalsContact CZ-N 3.3Å
377	S	84.7	Confident	88.7	Confident	7 Å²	7	56.8 Å²	56.8	5%	0.049	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-68.9	144.7	173.1	52.3	0	0	0	0	110.9	D391	S377-D391 WeakPolarHBondContact CA-OD1 3.43Å
378	S	87.6	Confident	88.8	Confident	19 Å²	19	51.8 Å²	51.8	13%	0.133	25%	0.246	C	C	.	.	S	Bend	trans	-70	-44	168.5	-172.1	0	0	0	0	110.7	F390 F424	S378-F390 WeakPolarHBondContact CB-O 3.2Å; S378-F390 PolarHBondContact N-O 3.41Å; S378-F424 PolarHBondContact OG-N 3.17Å; S378-F424 PolarHBondContact OG-O 3.32Å
379	D	93.5	Very high	88.9	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.043	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	166.3	171.2	-149.5	-7.3	0	0	0	112	F390 R425 C426	D379-F390 PolarHBondContact O-N 3.48Å; D379-R425 IonicContact OD1-CZ 2.71Å; D379-R425 IonicContact OD1-NE 3.67Å; D379-R425 IonicContact OD1-NH2 3.04Å; D379-R425 PolarHBondContact OD1-NH2 2.86Å; D379-R425 WeakPolarHBondContact OD2-CA 3.49Å; D379-R425 WeakPolarHBondContact OD2-CB 3.37Å; D379-R425 IonicContact OD2-CZ 2.86Å; D379-R425 IonicContact OD2-NE 3.23Å; D379-R425 PolarHBondContact OD2-NE 3.16Å; D379-R425 VanDerWaalsContact OD2-NE 3.12Å; D379-R425 IonicContact OD2-NH2 3.26Å; D379-C426 HydrophobicContact CB-CB 4.42Å; D379-C426 PolarHBondContact OD2-N 3.43Å
380	M	95.3	Very high	89.1	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.02	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	123.2	177.9	-175.6	177.1	67.2	0	0	110.8	E336 T338 L355 I387 Y388	E336-M380 HydrophobicContact CB-CB 3.81Å; E336-M380 HydrophobicContact CB-CE 4.12Å; E336-M380 HydrophobicContact CG-CB 4.29Å; T338-M380 HydrophobicContact CG2-CE 3.99Å; T338-M380 HydrophobicContact CG2-CG 4.25Å; L355-M380 HydrophobicContact CD1-CE 4.34Å; L355-M380 HydrophobicContact CD1-SD 3.96Å; M380-I387 HydrophobicContact CG-CG2 3.3Å; M380-I387 HydrophobicContact SD-CG2 3.59Å; M380-I387 VanDerWaalsContact SD-CG2 3.59Å; M380-Y388 CarbonylContact C-O 3.59Å; M380-Y388 VanDerWaalsContact CA-O 3.3Å; M380-Y388 WeakPolarHBondContact CA-O 3.41Å
381	V	97.1	Very high	89.5	Confident	12 Å²	12	40.4 Å²	40.4	7%	0.073	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.8	-178.3	-70.3	0	0	0	0	112.3	Y388 F390 C426 V428 I433	V381-Y388 PolarHBondContact N-O 3.27Å; V381-Y388 PolarHBondContact O-N 3.35Å; V381-F390 HydrophobicContact CG2-CE2 3.98Å; V381-C426 HydrophobicContact CB-CB 4.36Å; V381-C426 HydrophobicContact CG1-CB 3.46Å; V381-C426 VanDerWaalsContact CG1-CB 3.46Å; V381-C426 HydrophobicContact CG2-CB 3.96Å; V381-V428 HydrophobicContact CB-CG2 4.07Å; V381-V428 HydrophobicContact CG2-CG2 4.21Å; V381-I433 HydrophobicContact CG2-CD1 3.96Å; V381-I433 HydrophobicContact CG2-CG2 3.76Å
382	A	97.2	Very high	90	Very high	22 Å²	22	41.3 Å²	41.3	18%	0.182	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.3	175.4	0	0	0	0	0	111.7	T338 T339 C340 F386	T338-A382 HydrophobicContact CG2-CB 4.24Å; T338-A382 PolarHBondContact OG1-N 3.12Å; T339-A382 WeakPolarHBondContact O-CB 3.4Å; C340-A382 HydrophobicContact CB-CB 3.67Å; A382-F386 WeakPolarHBondContact CA-O 3.13Å
383	L	96.7	Very high	90.3	Very high	15 Å²	15	37 Å²	37	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	126.5	168.9	172.6	59.2	0	0	0	108.8	S385 F386 Y388 V428 G430 I433 V446	L383-S385 PolarHBondContact O-N 3.49Å; L383-F386 PolarHBondContact N-O 2.76Å; L383-F386 PolarHBondContact O-N 2.7Å; L383-F386 VanDerWaalsContact O-N 3.09Å; L383-Y388 HydrophobicContact CB-CD2 4.15Å; L383-Y388 HydrophobicContact CB-CE2 3.93Å; L383-V428 HydrophobicContact CB-CG1 4.23Å; L383-V428 HydrophobicContact CD1-CG1 3.7Å; L383-V428 HydrophobicContact CD2-CG1 4.4Å; L383-V428 HydrophobicContact CG-CG1 4.31Å; L383-G430 WeakPolarHBondContact CD1-O 3.5Å; L383-I433 HydrophobicContact CB-CD1 4.44Å; L383-I433 HydrophobicContact CD2-CD1 4.21Å; L383-I433 HydrophobicContact CD2-CG1 4Å; L383-V446 HydrophobicContact CD2-CB 3.67Å; L383-V446 HydrophobicContact CD2-CG1 4.15Å; L383-V446 HydrophobicContact CD2-CG2 3.71Å
384	K	92.8	Very high	90.3	Very high	121 Å²	121	45.7 Å²	45.7	53%	0.526	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	-127.8	-170.7	-56.5	175	-178.9	174.4	0	110.1	C340	C340-K384 PolarHBondContact SG-O 2.68Å
385	S	93.9	Very high	90.3	Very high	28 Å²	28	44.1 Å²	44.1	20%	0.196	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	19.7	176.7	53.7	0	0	0	0	113.5	L383 T405	L383-S385 PolarHBondContact O-N 3.49Å; S385-T405 PolarHBondContact O-N 3.43Å; S385-T405 PolarHBondContact O-OG1 2.8Å
386	F	96.5	Very high	90.3	Very high	46 Å²	46	45.6 Å²	45.6	20%	0.202	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.1	-178	-65	-92.7	0	0	0	111.7	A382 L383 Y388 K402 Y403 N404	A382-F386 WeakPolarHBondContact CA-O 3.13Å; L383-F386 PolarHBondContact N-O 2.76Å; L383-F386 PolarHBondContact O-N 2.7Å; L383-F386 VanDerWaalsContact O-N 3.09Å; F386-Y388 HydrophobicContact CB-CD2 4.24Å; F386-Y388 HydrophobicContact CB-CE2 3.6Å; F386-K402 HydrophobicContact CD1-CB 4.25Å; F386-K402 HydrophobicContact CD1-CD 4.09Å; F386-K402 HydrophobicContact CD1-CG 4.25Å; F386-K402 HydrophobicContact CE1-CD 4.23Å; F386-Y403 CarbonylContact C-O 3.6Å; F386-Y403 VanDerWaalsContact CA-O 3.25Å; F386-Y403 WeakPolarHBondContact CA-O 3.5Å; F386-N404 HydrophobicContact CD1-CB 3.82Å; F386-N404 HydrophobicContact CE1-CB 3.52Å; F386-N404 WeakPolarHBondContact CE1-ND2 3.47Å; F386-N404 HydrophobicContact CZ-CB 4.33Å; F386-N404 WeakPolarHBondContact CZ-ND2 3.31Å
387	I	97.1	Very high	90.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.1	166.8	-60.8	173.3	0	0	0	107.6	T338 C340 Y345 M380 K402 Y403 T405	T338-I387 HydrophobicContact CG2-CD1 4.21Å; T338-I387 HydrophobicContact CG2-CG1 4.16Å; T338-I387 HydrophobicContact CG2-CG2 4.04Å; C340-I387 HydrophobicContact CB-CD1 4.25Å; C340-I387 HydrophobicContact CB-CG1 3.87Å; Y345-I387 HydrophobicContact CD1-CD1 3.67Å; Y345-I387 HydrophobicContact CD2-CD1 3.5Å; Y345-I387 VanDerWaalsContact CD2-CD1 3.5Å; Y345-I387 HydrophobicContact CE1-CD1 4.09Å; Y345-I387 HydrophobicContact CE2-CD1 3.93Å; Y345-I387 HydrophobicContact CG-CD1 3.35Å; M380-I387 HydrophobicContact CG-CG2 3.3Å; M380-I387 HydrophobicContact SD-CG2 3.59Å; M380-I387 VanDerWaalsContact SD-CG2 3.59Å; I387-K402 CarbonylContact O-C 3.53Å; I387-K402 WeakPolarHBondContact O-CA 3.5Å; I387-Y403 HydrophobicContact CD1-CD1 4.16Å; I387-Y403 PolarHBondContact N-O 3.07Å; I387-Y403 PolarHBondContact O-N 2.96Å; I387-T405 HydrophobicContact CD1-CG2 4.01Å; I387-T405 HydrophobicContact CG1-CG2 4.03Å
388	Y	96.8	Very high	90.9	Very high	5 Å²	5	40.2 Å²	40.2	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.7	175.6	-68.4	-97.5	0	0	0	109.3	M380 V381 L383 F386 V400 F401 K402 I433 F444 V446	M380-Y388 CarbonylContact C-O 3.59Å; M380-Y388 VanDerWaalsContact CA-O 3.3Å; M380-Y388 WeakPolarHBondContact CA-O 3.41Å; V381-Y388 PolarHBondContact N-O 3.27Å; V381-Y388 PolarHBondContact O-N 3.35Å; L383-Y388 HydrophobicContact CB-CD2 4.15Å; L383-Y388 HydrophobicContact CB-CE2 3.93Å; F386-Y388 HydrophobicContact CB-CD2 4.24Å; F386-Y388 HydrophobicContact CB-CE2 3.6Å; Y388-V400 HydrophobicContact CD1-CG1 4.03Å; Y388-F401 WeakPolarHBondContact CA-O 3.47Å; Y388-K402 HydrophobicContact CD1-CB 4.14Å; Y388-K402 HydrophobicContact CE1-CB 4Å; Y388-K402 HydrophobicContact CE1-CD 4.41Å; Y388-I433 HydrophobicContact CD1-CD1 4.26Å; Y388-I433 HydrophobicContact CD2-CD1 3.84Å; Y388-I433 HydrophobicContact CE2-CD1 4.43Å; Y388-I433 HydrophobicContact CG-CD1 3.75Å; Y388-F444 AromaticContact CD1-CE1 3.88Å; Y388-F444 HydrophobicContact CD1-CE1 3.88Å; Y388-F444 AromaticContact CE1-CE1 3.91Å; Y388-F444 HydrophobicContact CE1-CE1 3.91Å; Y388-V446 HydrophobicContact CE1-CG2 3.98Å; Y388-V446 HydrophobicContact CE2-CG2 4.48Å; Y388-V446 WeakPolarHBondContact OH-CG1 3.15Å
389	R	95	Very high	91.1	Very high	11 Å²	11	41.6 Å²	41.6	4%	0.042	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.1	177.5	172.5	-178	162	160.7	-4	108.5	S373 K375 D391 V400 F401 W410	S373-R389 PolarHBondContact OG-NH2 3.29Å; K375-R389 PolarHBondContact O-NH2 2.55Å; R389-D391 IonicContact CZ-OD1 3.97Å; R389-D391 IonicContact CZ-OD2 2.88Å; R389-D391 IonicContact NE-OD1 3.08Å; R389-D391 PolarHBondContact NE-OD1 3.34Å; R389-D391 IonicContact NE-OD2 3.48Å; R389-D391 IonicContact NH2-OD1 2.64Å; R389-D391 PolarHBondContact NH2-OD1 2.86Å; R389-D391 IonicContact NH2-OD2 3.14Å; R389-D391 PolarHBondContact NH2-OD2 3.23Å; R389-V400 WeakPolarHBondContact O-CA 3.45Å; R389-F401 HydrophobicContact CB-CB 4.44Å; R389-F401 PolarHBondContact N-O 3.48Å; R389-F401 PolarHBondContact O-N 2.81Å; R389-W410 HydrophobicContact CB-CH2 4.17Å; R389-W410 HydrophobicContact CB-CZ3 3.96Å
390	F	94	Very high	91.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.8	179.8	-65.3	-94.5	0	0	0	110.3	S378 D379 V381 I398 V400 F424 I433 F444 F453	S378-F390 WeakPolarHBondContact CB-O 3.2Å; S378-F390 PolarHBondContact N-O 3.41Å; D379-F390 PolarHBondContact O-N 3.48Å; V381-F390 HydrophobicContact CG2-CE2 3.98Å; F390-I398 HydrophobicContact CD1-CG2 4.32Å; F390-V400 HydrophobicContact CD1-CB 4.43Å; F390-V400 HydrophobicContact CD1-CG1 4.14Å; F390-V400 HydrophobicContact CD1-CG2 3.64Å; F390-V400 HydrophobicContact CE1-CB 4.33Å; F390-V400 HydrophobicContact CE1-CG1 3.78Å; F390-V400 HydrophobicContact CE1-CG2 3.58Å; F390-V400 HydrophobicContact CZ-CG1 4.02Å; F390-F424 HydrophobicContact CB-CE2 3.77Å; F390-F424 HydrophobicContact CB-CZ 3.91Å; F390-F424 AromaticContact CD1-CE2 3.98Å; F390-F424 HydrophobicContact CD1-CE2 3.98Å; F390-F424 AromaticContact CD1-CZ 3.89Å; F390-F424 HydrophobicContact CD1-CZ 3.89Å; F390-F424 AromaticContact CG-CE2 3.86Å; F390-F424 HydrophobicContact CG-CE2 3.86Å; F390-F424 HydrophobicContact CG-CZ 4.12Å; F390-I433 HydrophobicContact CE2-CD1 4.37Å; F390-I433 HydrophobicContact CE2-CG2 4.13Å; F390-I433 HydrophobicContact CZ-CD1 4.18Å; F390-I433 HydrophobicContact CZ-CG2 4.04Å; F390-F444 HydrophobicContact CE1-CB 4.47Å; F390-F444 HydrophobicContact CE1-CD1 4.26Å; F390-F444 HydrophobicContact CE1-CG 4.18Å; F390-F444 AromaticContact CZ-CD1 3.95Å; F390-F444 HydrophobicContact CZ-CD1 3.95Å; F390-F444 HydrophobicContact CZ-CE1 4.41Å; F390-F444 HydrophobicContact CZ-CG 4.26Å; F390-F453 HydrophobicContact CD1-CZ 4.27Å; F390-F453 HydrophobicContact CE1-CE1 4.42Å; F390-F453 AromaticContact CE1-CZ 3.99Å; F390-F453 HydrophobicContact CE1-CZ 3.99Å
391	D	91.4	Very high	91.2	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.032	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	107.8	175.9	-74.2	11	0	0	0	108.6	S373 S377 R389 N399 F401	S373-D391 VanDerWaalsContact CB-OD2 3.31Å; S373-D391 WeakPolarHBondContact CB-OD2 3.22Å; S373-D391 PolarHBondContact OG-OD2 2.96Å; S377-D391 WeakPolarHBondContact CA-OD1 3.43Å; R389-D391 IonicContact CZ-OD1 3.97Å; R389-D391 IonicContact CZ-OD2 2.88Å; R389-D391 IonicContact NE-OD1 3.08Å; R389-D391 PolarHBondContact NE-OD1 3.34Å; R389-D391 IonicContact NE-OD2 3.48Å; R389-D391 IonicContact NH2-OD1 2.64Å; R389-D391 PolarHBondContact NH2-OD1 2.86Å; R389-D391 IonicContact NH2-OD2 3.14Å; R389-D391 PolarHBondContact NH2-OD2 3.23Å; D391-N399 HydrophobicContact CB-CB 4.5Å; D391-N399 PolarHBondContact N-O 2.92Å; D391-N399 PolarHBondContact O-N 3.2Å; D391-F401 HydrophobicContact CB-CE2 4.24Å
392	V	89.1	Confident	91	Very high	33 Å²	33	44.4 Å²	44.4	20%	0.2	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.7	-179.1	-176.5	0	0	0	0	109.7	I398 H421 F424	V392-I398 HydrophobicContact CG1-CG1 4.46Å; V392-I398 HydrophobicContact CG2-CG1 4.32Å; V392-H421 HydrophobicContact CG1-CB 3.91Å; V392-F424 HydrophobicContact CG2-CD1 3.85Å; V392-F424 HydrophobicContact CG2-CE1 3.32Å; V392-F424 HydrophobicContact CG2-CE2 4.41Å; V392-F424 HydrophobicContact CG2-CZ 3.65Å
393	N	82.8	Confident	91	Very high	43 Å²	43	43.4 Å²	43.4	23%	0.23	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.4	178.9	-173.8	-70.8	0	0	0	110.5	K375 E395 Q396 G397	K375-N393 PolarHBondContact NZ-ND2 3Å; N393-E395 VanDerWaalsContact C-N 3.31Å; N393-E395 PolarHBondContact O-N 2.78Å; N393-E395 PolarHBondContact OD1-N 2.87Å; N393-Q396 HydrophobicContact CB-CB 4.1Å; N393-Q396 PolarHBondContact OD1-N 3.18Å; N393-G397 PolarHBondContact N-O 2.67Å; N393-G397 CarbonylContact O-C 3.58Å; N393-G397 WeakPolarHBondContact O-CA 3.18Å; N393-G397 PolarHBondContact O-N 2.91Å
394	R	75.9	Confident	90.9	Very high	201 Å²	201	43.7 Å²	43.7	76%	0.758	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-35.7	-178.2	-68.4	-174.8	178.7	-174.3	-0.3	113.4
395	E	77.4	Confident	91	Very high	162 Å²	162	38.3 Å²	38.3	76%	0.757	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-33.2	-176.2	-63	178.9	-179.7	0	0	112.6	N393 P418	N393-E395 VanDerWaalsContact C-N 3.31Å; N393-E395 PolarHBondContact O-N 2.78Å; N393-E395 PolarHBondContact OD1-N 2.87Å; E395-P418 VanDerWaalsContact O-CB 3.3Å; E395-P418 WeakPolarHBondContact O-CB 3.27Å; E395-P418 WeakPolarHBondContact O-CG 3.45Å
396	Q	78.4	Confident	91	Very high	109 Å²	109	42.9 Å²	42.9	51%	0.509	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-3	-173.6	-63.9	-179.9	-18.9	0	0	113.8	N393	N393-Q396 HydrophobicContact CB-CB 4.1Å; N393-Q396 PolarHBondContact OD1-N 3.18Å
397	G	88.2	Confident	90.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.5	-145	-176.6	0	0	0	0	0	112.8	N393	N393-G397 PolarHBondContact N-O 2.67Å; N393-G397 CarbonylContact O-C 3.58Å; N393-G397 WeakPolarHBondContact O-CA 3.18Å; N393-G397 PolarHBondContact O-N 2.91Å
398	I	92.1	Very high	90.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.9	-176.7	-58.9	161.9	0	0	0	108.3	F390 V392 V400 S415 Q416 H421 F424 L442 F453	F390-I398 HydrophobicContact CD1-CG2 4.32Å; V392-I398 HydrophobicContact CG1-CG1 4.46Å; V392-I398 HydrophobicContact CG2-CG1 4.32Å; I398-V400 HydrophobicContact CG2-CG2 4.34Å; I398-S415 CarbonylContact O-C 3.56Å; I398-S415 WeakPolarHBondContact O-CA 3.41Å; I398-Q416 HydrophobicContact CB-CB 4.17Å; I398-Q416 HydrophobicContact CD1-CB 4.49Å; I398-Q416 PolarHBondContact N-O 3.1Å; I398-Q416 PolarHBondContact O-N 2.86Å; I398-H421 HydrophobicContact CD1-CB 4.36Å; I398-H421 HydrophobicContact CG1-CB 4.37Å; I398-F424 HydrophobicContact CD1-CE1 3.72Å; I398-F424 HydrophobicContact CD1-CZ 4.42Å; I398-F424 HydrophobicContact CG1-CE1 4.12Å; I398-F424 HydrophobicContact CG2-CE1 4.34Å; I398-F424 HydrophobicContact CG2-CZ 4.06Å; I398-L442 HydrophobicContact CD1-CD1 3.79Å; I398-F453 HydrophobicContact CB-CZ 4.49Å; I398-F453 HydrophobicContact CG2-CE2 4.23Å; I398-F453 HydrophobicContact CG2-CZ 3.78Å
399	N	92.9	Very high	90.7	Very high	48 Å²	48	54.1 Å²	54.1	26%	0.257	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.9	171.4	-65.3	-67.3	0	0	0	109.9	D391 F401	D391-N399 HydrophobicContact CB-CB 4.5Å; D391-N399 PolarHBondContact N-O 2.92Å; D391-N399 PolarHBondContact O-N 3.2Å; N399-F401 HydrophobicContact CB-CE2 3.94Å; N399-F401 HydrophobicContact CB-CZ 4.16Å
400	V	94.6	Very high	90.6	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.3	-179.9	-168	0	0	0	0	108.8	Y388 R389 F390 I398 C413 A414 F444 F453	Y388-V400 HydrophobicContact CD1-CG1 4.03Å; R389-V400 WeakPolarHBondContact O-CA 3.45Å; F390-V400 HydrophobicContact CD1-CB 4.43Å; F390-V400 HydrophobicContact CD1-CG1 4.14Å; F390-V400 HydrophobicContact CD1-CG2 3.64Å; F390-V400 HydrophobicContact CE1-CB 4.33Å; F390-V400 HydrophobicContact CE1-CG1 3.78Å; F390-V400 HydrophobicContact CE1-CG2 3.58Å; F390-V400 HydrophobicContact CZ-CG1 4.02Å; I398-V400 HydrophobicContact CG2-CG2 4.34Å; V400-C413 HydrophobicContact CB-CB 4.17Å; V400-C413 HydrophobicContact CG1-CB 4.04Å; V400-C413 WeakPolarHBondContact O-CA 3.41Å; V400-C413 WeakPolarHBondContact O-CB 3.25Å; V400-C413 PolarHBondContact O-N 3.3Å; V400-A414 HydrophobicContact CB-CB 4.3Å; V400-A414 HydrophobicContact CG2-CB 4.33Å; V400-A414 PolarHBondContact N-O 3Å; V400-A414 PolarHBondContact O-N 3.29Å; V400-F444 HydrophobicContact CB-CZ 4.35Å; V400-F444 HydrophobicContact CG1-CE1 4.14Å; V400-F444 HydrophobicContact CG1-CZ 3.91Å; V400-F444 HydrophobicContact CG2-CE2 4.14Å; V400-F444 HydrophobicContact CG2-CZ 4.34Å; V400-F453 HydrophobicContact CG2-CE2 3.69Å; V400-F453 HydrophobicContact CG2-CZ 3.74Å
401	F	94.4	Very high	90.6	Very high	25 Å²	25	59.5 Å²	59.5	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.1	172.7	-53.1	-88.7	0	0	0	109.1	N371 Y388 R389 D391 N399 W410 H411 D412	N371-F401 WeakPolarHBondContact ND2-CB 3.28Å; N371-F401 WeakPolarHBondContact ND2-CG 3.15Å; Y388-F401 WeakPolarHBondContact CA-O 3.47Å; R389-F401 HydrophobicContact CB-CB 4.44Å; R389-F401 PolarHBondContact N-O 3.48Å; R389-F401 PolarHBondContact O-N 2.81Å; D391-F401 HydrophobicContact CB-CE2 4.24Å; N399-F401 HydrophobicContact CB-CE2 3.94Å; N399-F401 HydrophobicContact CB-CZ 4.16Å; F401-W410 HydrophobicContact CB-CE3 3.99Å; F401-W410 HydrophobicContact CB-CZ3 4.08Å; F401-H411 WeakPolarHBondContact CA-O 3.06Å; F401-D412 VanDerWaalsContact CD1-OD1 3.23Å; F401-D412 WeakPolarHBondContact CD1-OD1 3.26Å; F401-D412 WeakPolarHBondContact CE1-OD1 3.3Å
402	K	94.6	Very high	90.6	Very high	55 Å²	55	65.3 Å²	65.3	24%	0.239	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.6	174.4	65.5	-177.9	175.5	-173.9	0	111.2	F386 I387 Y388 W410 H411 C413	F386-K402 HydrophobicContact CD1-CB 4.25Å; F386-K402 HydrophobicContact CD1-CD 4.09Å; F386-K402 HydrophobicContact CD1-CG 4.25Å; F386-K402 HydrophobicContact CE1-CD 4.23Å; I387-K402 CarbonylContact O-C 3.53Å; I387-K402 WeakPolarHBondContact O-CA 3.5Å; Y388-K402 HydrophobicContact CD1-CB 4.14Å; Y388-K402 HydrophobicContact CE1-CB 4Å; Y388-K402 HydrophobicContact CE1-CD 4.41Å; K402-W410 CarbonylContact O-C 3.57Å; K402-W410 WeakPolarHBondContact O-CA 3.28Å; K402-H411 HydrophobicContact CG-CB 4.08Å; K402-H411 PolarHBondContact N-O 2.87Å; K402-H411 PolarHBondContact O-N 3.29Å; K402-C413 HydrophobicContact CB-CB 4.31Å; K402-C413 HydrophobicContact CD-CB 4.21Å; K402-C413 HydrophobicContact CG-CB 4.1Å
403	Y	96	Very high	90.8	Very high	1 Å²	1	65.1 Å²	65.1	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121	171.8	177.5	-106.6	0	0	0	109.4	Y345 L355 F386 I387 T405 K408 M409 W410	Y345-Y403 HydrophobicContact CE1-CE1 4.02Å; L355-Y403 HydrophobicContact CD2-CD1 3.9Å; L355-Y403 HydrophobicContact CD2-CE1 4.04Å; L355-Y403 HydrophobicContact CD2-CG 4.14Å; F386-Y403 CarbonylContact C-O 3.6Å; F386-Y403 VanDerWaalsContact CA-O 3.25Å; F386-Y403 WeakPolarHBondContact CA-O 3.5Å; I387-Y403 HydrophobicContact CD1-CD1 4.16Å; I387-Y403 PolarHBondContact N-O 3.07Å; I387-Y403 PolarHBondContact O-N 2.96Å; Y403-T405 HydrophobicContact CD1-CG2 4.1Å; Y403-T405 HydrophobicContact CE1-CG2 4.2Å; Y403-K408 VanDerWaalsContact CE2-C 3.45Å; Y403-K408 HydrophobicContact CE2-CB 4.44Å; Y403-K408 WeakPolarHBondContact OH-CA 3.4Å; Y403-K408 WeakPolarHBondContact OH-CB 3.37Å; Y403-M409 WeakPolarHBondContact CA-O 3.48Å; Y403-W410 AromaticContact CD2-CD1 3.76Å; Y403-W410 AromaticContact CD2-CD2 3.9Å; Y403-W410 HydrophobicContact CD2-CD2 3.9Å; Y403-W410 AromaticContact CD2-CE2 3.7Å; Y403-W410 AromaticContact CD2-CG 3.96Å; Y403-W410 HydrophobicContact CD2-CG 3.96Å; Y403-W410 HydrophobicContact CD2-CZ2 4.32Å; Y403-W410 AromaticContact CD2-NE1 3.58Å; Y403-W410 HydrophobicContact CG-CD2 4.25Å; Y403-W410 HydrophobicContact CG-CZ2 4.24Å
404	N	95.3	Very high	91.3	Very high	22 Å²	22	64.2 Å²	64.2	12%	0.118	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	118.8	173.8	-173.9	-46.8	0	0	0	109.3	F386 I406 V407 K408 M409	F386-N404 HydrophobicContact CD1-CB 3.82Å; F386-N404 HydrophobicContact CE1-CB 3.52Å; F386-N404 WeakPolarHBondContact CE1-ND2 3.47Å; F386-N404 HydrophobicContact CZ-CB 4.33Å; F386-N404 WeakPolarHBondContact CZ-ND2 3.31Å; N404-I406 VanDerWaalsContact C-N 3.29Å; N404-I406 PolarHBondContact O-N 2.85Å; N404-I406 WeakPolarHBondContact OD1-CA 3.41Å; N404-I406 WeakPolarHBondContact OD1-CB 3.48Å; N404-I406 PolarHBondContact OD1-N 2.84Å; N404-V407 HydrophobicContact CB-CG2 3.62Å; N404-V407 PolarHBondContact OD1-N 3.23Å; N404-V407 VanDerWaalsContact OD1-N 3.07Å; N404-K408 WeakPolarHBondContact O-CA 3.49Å; N404-K408 PolarHBondContact O-N 2.81Å; N404-M409 PolarHBondContact N-O 2.85Å; N404-M409 PolarHBondContact O-N 2.79Å
405	T	95	Very high	92	Very high	8 Å²	8	58.8 Å²	58.8	5%	0.049	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.2	-176.1	58.4	0	0	0	0	113.5	C340 Y345 S385 I387 Y403	C340-T405 HydrophobicContact CB-CG2 4Å; C340-T405 VanDerWaalsContact SG-CG2 3.58Å; Y345-T405 HydrophobicContact CE2-CG2 3.98Å; S385-T405 PolarHBondContact O-N 3.43Å; S385-T405 PolarHBondContact O-OG1 2.8Å; I387-T405 HydrophobicContact CD1-CG2 4.01Å; I387-T405 HydrophobicContact CG1-CG2 4.03Å; Y403-T405 HydrophobicContact CD1-CG2 4.1Å; Y403-T405 HydrophobicContact CE1-CG2 4.2Å
406	I	93.8	Very high	92.5	Very high	124 Å²	124	53.3 Å²	53.3	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-57	179.5	-57.1	173.3	0	0	0	110.1	N404 K408	N404-I406 VanDerWaalsContact C-N 3.29Å; N404-I406 PolarHBondContact O-N 2.85Å; N404-I406 WeakPolarHBondContact OD1-CA 3.41Å; N404-I406 WeakPolarHBondContact OD1-CB 3.48Å; N404-I406 PolarHBondContact OD1-N 2.84Å; I406-K408 VanDerWaalsContact C-N 3.31Å
407	V	94.4	Very high	92.6	Very high	79 Å²	79	58.5 Å²	58.5	48%	0.479	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.2	-179.2	-54.7	0	0	0	0	113.2	N404 M409	N404-V407 HydrophobicContact CB-CG2 3.62Å; N404-V407 PolarHBondContact OD1-N 3.23Å; N404-V407 VanDerWaalsContact OD1-N 3.07Å; V407-M409 HydrophobicContact CB-CE 4.33Å; V407-M409 HydrophobicContact CG2-CB 4.13Å; V407-M409 HydrophobicContact CG2-CE 3.85Å; V407-M409 HydrophobicContact CG2-CG 4.34Å
408	K	94.6	Very high	91.6	Very high	109 Å²	109	62.6 Å²	62.6	47%	0.474	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	49.3	178.7	-55.1	179.5	-176.4	178.4	0	112.8	P369 Y403 N404 I406	P369-K408 HydrophobicContact CG-CB 4.48Å; P369-K408 WeakPolarHBondContact CG-O 3.35Å; Y403-K408 VanDerWaalsContact CE2-C 3.45Å; Y403-K408 HydrophobicContact CE2-CB 4.44Å; Y403-K408 WeakPolarHBondContact OH-CA 3.4Å; Y403-K408 WeakPolarHBondContact OH-CB 3.37Å; N404-K408 WeakPolarHBondContact O-CA 3.49Å; N404-K408 PolarHBondContact O-N 2.81Å; I406-K408 VanDerWaalsContact C-N 3.31Å
409	M	94.4	Very high	90.4	Very high	99 Å²	99	64 Å²	64	49%	0.488	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	142.5	-179.2	-66.6	-165.1	-60.6	0	0	112.8	Y403 N404 V407 H411	Y403-M409 WeakPolarHBondContact CA-O 3.48Å; N404-M409 PolarHBondContact N-O 2.85Å; N404-M409 PolarHBondContact O-N 2.79Å; V407-M409 HydrophobicContact CB-CE 4.33Å; V407-M409 HydrophobicContact CG2-CB 4.13Å; V407-M409 HydrophobicContact CG2-CE 3.85Å; V407-M409 HydrophobicContact CG2-CG 4.34Å; M409-H411 PolarHBondContact O-ND1 2.71Å
410	W	94.1	Very high	89	Confident	44 Å²	44	67 Å²	67	17%	0.167	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	143.2	172.5	-72.3	100.2	0	0	0	111.5	L355 P369 N371 R389 F401 K402 Y403	L355-W410 HydrophobicContact CB-CZ2 4.39Å; L355-W410 HydrophobicContact CD2-CH2 4.44Å; L355-W410 HydrophobicContact CD2-CZ2 3.7Å; P369-W410 PolarHBondContact O-NE1 2.86Å; N371-W410 HydrophobicContact CB-CD2 3.91Å; N371-W410 HydrophobicContact CB-CE3 4.38Å; N371-W410 HydrophobicContact CB-CG 4.19Å; N371-W410 HydrophobicContact CB-CZ2 4.15Å; N371-W410 WeakPolarHBondContact ND2-CZ3 3.36Å; R389-W410 HydrophobicContact CB-CH2 4.17Å; R389-W410 HydrophobicContact CB-CZ3 3.96Å; F401-W410 HydrophobicContact CB-CE3 3.99Å; F401-W410 HydrophobicContact CB-CZ3 4.08Å; K402-W410 CarbonylContact O-C 3.57Å; K402-W410 WeakPolarHBondContact O-CA 3.28Å; Y403-W410 AromaticContact CD2-CD1 3.76Å; Y403-W410 AromaticContact CD2-CD2 3.9Å; Y403-W410 HydrophobicContact CD2-CD2 3.9Å; Y403-W410 AromaticContact CD2-CE2 3.7Å; Y403-W410 AromaticContact CD2-CG 3.96Å; Y403-W410 HydrophobicContact CD2-CG 3.96Å; Y403-W410 HydrophobicContact CD2-CZ2 4.32Å; Y403-W410 AromaticContact CD2-NE1 3.58Å; Y403-W410 HydrophobicContact CG-CD2 4.25Å; Y403-W410 HydrophobicContact CG-CZ2 4.24Å
411	H	92.8	Very high	88	Confident	80 Å²	80	68 Å²	68	37%	0.37	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.2	172.9	-57.8	80.8	0	0	0	109.7	F401 K402 M409	F401-H411 WeakPolarHBondContact CA-O 3.06Å; K402-H411 HydrophobicContact CG-CB 4.08Å; K402-H411 PolarHBondContact N-O 2.87Å; K402-H411 PolarHBondContact O-N 3.29Å; M409-H411 PolarHBondContact O-ND1 2.71Å
412	D	92.8	Very high	87.4	Confident	128 Å²	128	69 Å²	69	68%	0.684	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	136.3	162.3	-61.5	-56.5	0	0	0	108.9	F401	F401-D412 VanDerWaalsContact CD1-OD1 3.23Å; F401-D412 WeakPolarHBondContact CD1-OD1 3.26Å; F401-D412 WeakPolarHBondContact CE1-OD1 3.3Å
413	C	92.7	Very high	87	Confident	28 Å²	28	70.9 Å²	70.9	19%	0.189	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-57	-174.2	-169.5	0	0	0	0	112.2	V400 K402	V400-C413 HydrophobicContact CB-CB 4.17Å; V400-C413 HydrophobicContact CG1-CB 4.04Å; V400-C413 WeakPolarHBondContact O-CA 3.41Å; V400-C413 WeakPolarHBondContact O-CB 3.25Å; V400-C413 PolarHBondContact O-N 3.3Å; K402-C413 HydrophobicContact CB-CB 4.31Å; K402-C413 HydrophobicContact CD-CB 4.21Å; K402-C413 HydrophobicContact CG-CB 4.1Å
414	A	93	Very high	86.8	Confident	24 Å²	24	71 Å²	71	20%	0.198	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	161.8	-177.5	0	0	0	0	0	110.3	V400 F444	V400-A414 HydrophobicContact CB-CB 4.3Å; V400-A414 HydrophobicContact CG2-CB 4.33Å; V400-A414 PolarHBondContact N-O 3Å; V400-A414 PolarHBondContact O-N 3.29Å; A414-F444 HydrophobicContact CB-CE2 3.64Å; A414-F444 HydrophobicContact CB-CZ 4.01Å
415	S	90.9	Very high	86.7	Confident	88 Å²	88	72 Å²	72	62%	0.615	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	139.4	172.7	60.7	0	0	0	0	110.6	I398	I398-S415 CarbonylContact O-C 3.56Å; I398-S415 WeakPolarHBondContact O-CA 3.41Å
416	Q	87.3	Confident	86.8	Confident	47 Å²	47	72.1 Å²	72.1	22%	0.22	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	142	170.7	-163.1	172.9	18.3	0	0	109.7	I398 F453	I398-Q416 HydrophobicContact CB-CB 4.17Å; I398-Q416 HydrophobicContact CD1-CB 4.49Å; I398-Q416 PolarHBondContact N-O 3.1Å; I398-Q416 PolarHBondContact O-N 2.86Å; Q416-F453 HydrophobicContact CB-CD2 3.91Å; Q416-F453 HydrophobicContact CB-CE2 4.1Å; Q416-F453 HydrophobicContact CG-CD2 4.47Å
417	R	80.9	Confident	86.9	Confident	218 Å²	218	66.6 Å²	66.6	82%	0.823	36%	0.363	S	S	*	.			trans	-57.3	155.3	-176.6	-67.4	-175.2	-176.3	-175.7	2.8	112.4	G419 H421	R417-G419 PolarHBondContact O-N 3.4Å; R417-H421 PolarHBondContact O-NE2 3.44Å
418	P	66.1	Low	87.1	Confident	85 Å²	85	64.8 Å²	64.8	55%	0.552	35%	0.352	S	S	*	.			trans	-52.8	136.8	173.7	-26	35.2	0	0	0	112.5	E395	E395-P418 VanDerWaalsContact O-CB 3.3Å; E395-P418 WeakPolarHBondContact O-CB 3.27Å; E395-P418 WeakPolarHBondContact O-CG 3.45Å
419	G	67.2	Low	87.1	Confident	30 Å²	30	60.9 Å²	60.9	31%	0.309	34%	0.336	S	S	.	.			trans	-164.6	171.8	178.7	0	0	0	0	0	109	R417 H421	R417-G419 PolarHBondContact O-N 3.4Å; G419-H421 PolarHBondContact O-CD2 3.29Å; G419-H421 PolarHBondContact O-N 2.85Å
420	S	64.1	Low	87.1	Confident	112 Å²	112	59 Å²	59	78%	0.783	34%	0.342	S	S	*	.			trans	-73.2	58.7	175.4	-179.3	0	0	0	0	111.4	L422	S420-L422 PolarHBondContact O-N 3.42Å
421	H	72.9	Confident	87.2	Confident	21 Å²	21	60.7 Å²	60.7	10%	0.097	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-77.1	116.7	-179.1	-60.5	-63.4	0	0	0	109.5	V392 I398 R417 G419	V392-H421 HydrophobicContact CG1-CB 3.91Å; I398-H421 HydrophobicContact CD1-CB 4.36Å; I398-H421 HydrophobicContact CG1-CB 4.37Å; R417-H421 PolarHBondContact O-NE2 3.44Å; G419-H421 PolarHBondContact O-CD2 3.29Å; G419-H421 PolarHBondContact O-N 2.85Å
422	L	82.5	Confident	87.4	Confident	47 Å²	47	57.2 Å²	57.2	25%	0.246	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-76.4	148.1	167.6	-64.1	177.1	0	0	0	109.7	S420 F424 N437 K438	S420-L422 PolarHBondContact O-N 3.42Å; L422-F424 PolarHBondContact O-N 2.94Å; L422-N437 HydrophobicContact CB-CB 4.4Å; L422-N437 PolarHBondContact O-ND2 3.39Å; L422-N437 VanDerWaalsContact O-ND2 3.07Å; L422-K438 HydrophobicContact CD1-CD 4.2Å; L422-K438 HydrophobicContact CD1-CG 3.62Å
423	P	86.1	Confident	87.6	Confident	95 Å²	95	51.1 Å²	51.1	62%	0.617	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-50.8	137.8	168.4	-24.4	34	0	0	0	110.3	N437	P423-N437 VanDerWaalsContact O-CB 3.31Å; P423-N437 WeakPolarHBondContact O-CB 3.38Å
424	F	90.9	Very high	87.8	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	30%	0.301	C	S	.	.			trans	-127.4	165.3	-179.9	54.6	-107.8	0	0	0	110	S378 F390 V392 I398 L422 C426 C435 V436 N437	S378-F424 PolarHBondContact OG-N 3.17Å; S378-F424 PolarHBondContact OG-O 3.32Å; F390-F424 HydrophobicContact CB-CE2 3.77Å; F390-F424 HydrophobicContact CB-CZ 3.91Å; F390-F424 AromaticContact CD1-CE2 3.98Å; F390-F424 HydrophobicContact CD1-CE2 3.98Å; F390-F424 AromaticContact CD1-CZ 3.89Å; F390-F424 HydrophobicContact CD1-CZ 3.89Å; F390-F424 AromaticContact CG-CE2 3.86Å; F390-F424 HydrophobicContact CG-CE2 3.86Å; F390-F424 HydrophobicContact CG-CZ 4.12Å; V392-F424 HydrophobicContact CG2-CD1 3.85Å; V392-F424 HydrophobicContact CG2-CE1 3.32Å; V392-F424 HydrophobicContact CG2-CE2 4.41Å; V392-F424 HydrophobicContact CG2-CZ 3.65Å; I398-F424 HydrophobicContact CD1-CE1 3.72Å; I398-F424 HydrophobicContact CD1-CZ 4.42Å; I398-F424 HydrophobicContact CG1-CE1 4.12Å; I398-F424 HydrophobicContact CG2-CE1 4.34Å; I398-F424 HydrophobicContact CG2-CZ 4.06Å; L422-F424 PolarHBondContact O-N 2.94Å; F424-C426 VanDerWaalsContact CE2-SG 3.58Å; F424-C435 HydrophobicContact CB-CB 4.47Å; F424-C435 HydrophobicContact CD1-CB 4.31Å; F424-C435 HydrophobicContact CD2-CB 3.51Å; F424-C435 HydrophobicContact CE1-CB 4.42Å; F424-C435 HydrophobicContact CE2-CB 3.65Å; F424-C435 HydrophobicContact CG-CB 3.86Å; F424-C435 HydrophobicContact CZ-CB 4.11Å; F424-V436 WeakPolarHBondContact CA-O 3.43Å; F424-V436 VanDerWaalsContact CB-O 3.28Å; F424-V436 WeakPolarHBondContact CB-O 3.48Å; F424-N437 HydrophobicContact CB-CB 3.91Å
425	R	94.1	Very high	87.8	Confident	44 Å²	44	49.7 Å²	49.7	17%	0.166	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	160.8	169.8	-59	-61.3	-65.9	-146.2	1.5	109.5	E336 D379 C435 V436 L468 P470	E336-R425 VanDerWaalsContact CD-NH1 3.34Å; E336-R425 IonicContact OE1-CZ 3.04Å; E336-R425 IonicContact OE1-NH1 3.9Å; E336-R425 PolarHBondContact OE1-NH1 2.72Å; E336-R425 IonicContact OE1-NH2 2.58Å; E336-R425 IonicContact OE2-CZ 2.7Å; E336-R425 VanDerWaalsContact OE2-CZ 3.3Å; E336-R425 IonicContact OE2-NH1 3Å; E336-R425 PolarHBondContact OE2-NH1 2.88Å; E336-R425 IonicContact OE2-NH2 3.45Å; E336-R425 PolarHBondContact OE2-NH2 3.5Å; D379-R425 IonicContact OD1-CZ 2.71Å; D379-R425 IonicContact OD1-NE 3.67Å; D379-R425 IonicContact OD1-NH2 3.04Å; D379-R425 PolarHBondContact OD1-NH2 2.86Å; D379-R425 WeakPolarHBondContact OD2-CA 3.49Å; D379-R425 WeakPolarHBondContact OD2-CB 3.37Å; D379-R425 IonicContact OD2-CZ 2.86Å; D379-R425 IonicContact OD2-NE 3.23Å; D379-R425 PolarHBondContact OD2-NE 3.16Å; D379-R425 VanDerWaalsContact OD2-NE 3.12Å; D379-R425 IonicContact OD2-NH2 3.26Å; R425-C435 CarbonylContact O-C 3.51Å; R425-C435 WeakPolarHBondContact O-CA 3.22Å; R425-V436 PolarHBondContact N-O 2.89Å; R425-V436 VanDerWaalsContact N-O 3.07Å; R425-V436 PolarHBondContact O-N 3.13Å; R425-L468 WeakPolarHBondContact CB-O 3.36Å; R425-L468 WeakPolarHBondContact CG-O 3.44Å; R425-P470 VanDerWaalsContact C-CG 3.47Å; R425-P470 HydrophobicContact CB-CG 3.91Å; R425-P470 WeakPolarHBondContact O-CG 3.15Å
426	C	96.4	Very high	87.9	Confident	10 Å²	10	45.6 Å²	45.6	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.1	-167	-62.9	0	0	0	0	112.5	D379 V381 F424 I433 Y434	D379-C426 HydrophobicContact CB-CB 4.42Å; D379-C426 PolarHBondContact OD2-N 3.43Å; V381-C426 HydrophobicContact CB-CB 4.36Å; V381-C426 HydrophobicContact CG1-CB 3.46Å; V381-C426 VanDerWaalsContact CG1-CB 3.46Å; V381-C426 HydrophobicContact CG2-CB 3.96Å; F424-C426 VanDerWaalsContact CE2-SG 3.58Å; C426-I433 HydrophobicContact CB-CG2 3.88Å; C426-Y434 CarbonylContact C-O 3.52Å; C426-Y434 WeakPolarHBondContact CA-O 3.47Å
427	A	97.2	Very high	88	Confident	7 Å²	7	43.6 Å²	43.6	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.2	168.5	0	0	0	0	0	110.2	L175 Y434 P470 V472	L175-A427 HydrophobicContact CD1-CB 3.84Å; A427-Y434 PolarHBondContact N-O 3.39Å; A427-Y434 PolarHBondContact O-N 3.43Å; A427-P470 HydrophobicContact CB-CB 3.79Å; A427-P470 HydrophobicContact CB-CG 4.15Å; A427-V472 HydrophobicContact CB-CG2 4.1Å
428	V	97.4	Very high	88.3	Confident	42 Å²	42	39.1 Å²	39.1	26%	0.255	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.1	-170.2	-175.6	0	0	0	0	110.8	V381 L383 I433	V381-V428 HydrophobicContact CB-CG2 4.07Å; V381-V428 HydrophobicContact CG2-CG2 4.21Å; L383-V428 HydrophobicContact CB-CG1 4.23Å; L383-V428 HydrophobicContact CD1-CG1 3.7Å; L383-V428 HydrophobicContact CD2-CG1 4.4Å; L383-V428 HydrophobicContact CG-CG1 4.31Å; V428-I433 HydrophobicContact CG2-CG1 4.16Å
429	I	95.6	Very high	89.3	Confident	27 Å²	27	38.1 Å²	38.1	14%	0.138	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120.8	173	-57.7	177.4	0	0	0	108.6	K173 L175 N431 C432 Y434 V472	K173-I429 HydrophobicContact CB-CG2 4.4Å; L175-I429 HydrophobicContact CB-CD1 3.72Å; L175-I429 HydrophobicContact CD1-CD1 4.46Å; I429-N431 PolarHBondContact O-N 2.63Å; I429-C432 PolarHBondContact N-O 3.35Å; I429-C432 PolarHBondContact O-N 3.21Å; I429-Y434 HydrophobicContact CB-CD2 4.4Å; I429-Y434 HydrophobicContact CB-CE2 3.93Å; I429-Y434 HydrophobicContact CD1-CE2 4.28Å; I429-Y434 HydrophobicContact CG1-CD2 4.44Å; I429-Y434 HydrophobicContact CG1-CE2 4.32Å; I429-V472 HydrophobicContact CD1-CG1 4.24Å; I429-V472 HydrophobicContact CD1-CG2 3.98Å; I429-V472 HydrophobicContact CG1-CB 4.44Å; I429-V472 HydrophobicContact CG1-CG1 4Å; I429-V472 HydrophobicContact CG1-CG2 3.52Å
430	G	94.3	Very high	90.3	Very high	59 Å²	59	38.9 Å²	38.9	61%	0.608	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	-120.8	-177.3	0	0	0	0	0	111.1	L383	L383-G430 WeakPolarHBondContact CD1-O 3.5Å
431	N	95.8	Very high	91.6	Very high	79 Å²	79	33.6 Å²	33.6	42%	0.422	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	9.5	176.5	68	-25.5	0	0	0	113.4	I429 V446	I429-N431 PolarHBondContact O-N 2.63Å; N431-V446 WeakPolarHBondContact CB-O 3.18Å; N431-V446 PolarHBondContact O-N 3.45Å
432	C	96.7	Very high	92.5	Very high	8 Å²	8	32.9 Å²	32.9	5%	0.054	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.6	-176.5	-172.1	0	0	0	0	111.3	I429 Y434	I429-C432 PolarHBondContact N-O 3.35Å; I429-C432 PolarHBondContact O-N 3.21Å; C432-Y434 HydrophobicContact CB-CD2 4.4Å; C432-Y434 HydrophobicContact CB-CE2 3.8Å
433	I	97.8	Very high	93.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	111.4	171.4	-53.5	-178.7	0	0	0	107.7	V381 L383 Y388 F390 C426 V428 F444 V446	V381-I433 HydrophobicContact CG2-CD1 3.96Å; V381-I433 HydrophobicContact CG2-CG2 3.76Å; L383-I433 HydrophobicContact CB-CD1 4.44Å; L383-I433 HydrophobicContact CD2-CD1 4.21Å; L383-I433 HydrophobicContact CD2-CG1 4Å; Y388-I433 HydrophobicContact CD1-CD1 4.26Å; Y388-I433 HydrophobicContact CD2-CD1 3.84Å; Y388-I433 HydrophobicContact CE2-CD1 4.43Å; Y388-I433 HydrophobicContact CG-CD1 3.75Å; F390-I433 HydrophobicContact CE2-CD1 4.37Å; F390-I433 HydrophobicContact CE2-CG2 4.13Å; F390-I433 HydrophobicContact CZ-CD1 4.18Å; F390-I433 HydrophobicContact CZ-CG2 4.04Å; C426-I433 HydrophobicContact CB-CG2 3.88Å; V428-I433 HydrophobicContact CG2-CG1 4.16Å; I433-F444 HydrophobicContact CB-CB 4.22Å; I433-F444 HydrophobicContact CB-CD1 4.35Å; I433-F444 HydrophobicContact CD1-CD1 4.04Å; I433-F444 HydrophobicContact CG1-CD1 4.4Å; I433-F444 PolarHBondContact N-O 2.93Å; I433-F444 PolarHBondContact O-N 2.86Å; I433-V446 HydrophobicContact CD1-CG2 4.35Å
434	Y	96.1	Very high	93.6	Very high	22 Å²	22	27.9 Å²	27.9	9%	0.086	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.2	177.4	-69.5	-99.1	0	0	0	109.3	L175 C426 A427 I429 C432 T441 L442 Q443 L458	L175-Y434 HydrophobicContact CD1-CG 4.35Å; L175-Y434 HydrophobicContact CD2-CD1 3.6Å; L175-Y434 HydrophobicContact CD2-CE1 4.25Å; L175-Y434 HydrophobicContact CD2-CG 3.81Å; C426-Y434 CarbonylContact C-O 3.52Å; C426-Y434 WeakPolarHBondContact CA-O 3.47Å; A427-Y434 PolarHBondContact N-O 3.39Å; A427-Y434 PolarHBondContact O-N 3.43Å; I429-Y434 HydrophobicContact CB-CD2 4.4Å; I429-Y434 HydrophobicContact CB-CE2 3.93Å; I429-Y434 HydrophobicContact CD1-CE2 4.28Å; I429-Y434 HydrophobicContact CG1-CD2 4.44Å; I429-Y434 HydrophobicContact CG1-CE2 4.32Å; C432-Y434 HydrophobicContact CB-CD2 4.4Å; C432-Y434 HydrophobicContact CB-CE2 3.8Å; Y434-T441 HydrophobicContact CD1-CG2 4.15Å; Y434-L442 WeakPolarHBondContact CA-O 3.45Å; Y434-Q443 HydrophobicContact CD1-CG 3.99Å; Y434-Q443 HydrophobicContact CE1-CG 3.87Å; Y434-Q443 VanDerWaalsContact CE1-NE2 3.33Å; Y434-Q443 PolarHBondContact OH-NE2 3.07Å; Y434-L458 HydrophobicContact CE1-CD1 4.15Å
435	C	94.6	Very high	93.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	105.3	-179.3	-56.1	0	0	0	0	108.6	F424 R425 T441 L442	F424-C435 HydrophobicContact CB-CB 4.47Å; F424-C435 HydrophobicContact CD1-CB 4.31Å; F424-C435 HydrophobicContact CD2-CB 3.51Å; F424-C435 HydrophobicContact CE1-CB 4.42Å; F424-C435 HydrophobicContact CE2-CB 3.65Å; F424-C435 HydrophobicContact CG-CB 3.86Å; F424-C435 HydrophobicContact CZ-CB 4.11Å; R425-C435 CarbonylContact O-C 3.51Å; R425-C435 WeakPolarHBondContact O-CA 3.22Å; C435-T441 CarbonylContact O-C 3.49Å; C435-T441 WeakPolarHBondContact O-CA 3.5Å; C435-L442 HydrophobicContact CB-CB 4.1Å; C435-L442 PolarHBondContact N-O 2.66Å; C435-L442 PolarHBondContact O-N 3.02Å
436	V	92.8	Very high	94	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.5	-169.4	-171.8	0	0	0	0	111	L175 V177 W224 F424 R425 T441 L468 P470	L175-V436 HydrophobicContact CD2-CG2 4.42Å; V177-V436 HydrophobicContact CG2-CB 4.44Å; V177-V436 HydrophobicContact CG2-CG1 3.86Å; V177-V436 HydrophobicContact CG2-CG2 4.43Å; W224-V436 HydrophobicContact CZ2-CG1 4.42Å; F424-V436 WeakPolarHBondContact CA-O 3.43Å; F424-V436 VanDerWaalsContact CB-O 3.28Å; F424-V436 WeakPolarHBondContact CB-O 3.48Å; R425-V436 PolarHBondContact N-O 2.89Å; R425-V436 VanDerWaalsContact N-O 3.07Å; R425-V436 PolarHBondContact O-N 3.13Å; V436-T441 HydrophobicContact CG2-CG2 3.92Å; V436-L468 HydrophobicContact CG1-CB 4.24Å; V436-L468 HydrophobicContact CG1-CD1 3.87Å; V436-P470 HydrophobicContact CB-CB 4.17Å; V436-P470 HydrophobicContact CB-CG 4.18Å; V436-P470 HydrophobicContact CG2-CB 3.82Å; V436-P470 HydrophobicContact CG2-CG 4.18Å
437	N	89.1	Confident	93.9	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.032	17%	0.173	C	C	.	.			trans	-139.3	178.7	165.7	65.8	40	0	0	0	110.4	L422 P423 F424 S439 Q440 A460	L422-N437 HydrophobicContact CB-CB 4.4Å; L422-N437 PolarHBondContact O-ND2 3.39Å; L422-N437 VanDerWaalsContact O-ND2 3.07Å; P423-N437 VanDerWaalsContact O-CB 3.31Å; P423-N437 WeakPolarHBondContact O-CB 3.38Å; F424-N437 HydrophobicContact CB-CB 3.91Å; N437-S439 PolarHBondContact O-N 3.07Å; N437-S439 VanDerWaalsContact O-N 3.15Å; N437-S439 WeakPolarHBondContact OD1-CA 3.31Å; N437-S439 PolarHBondContact OD1-N 3.15Å; N437-S439 PolarHBondContact OD1-OG 3.18Å; N437-Q440 PolarHBondContact N-O 2.86Å; N437-Q440 PolarHBondContact OD1-N 3.41Å; N437-Q440 PolarHBondContact OD1-O 3.19Å; N437-Q440 VanDerWaalsContact OD1-O 3.13Å; N437-A460 WeakPolarHBondContact O-CB 3.42Å
438	K	86.5	Confident	93.4	Very high	124 Å²	124	39 Å²	39	54%	0.539	21%	0.211	S	C	.	.	S	Bend	trans	-66.3	-11.8	-177.9	67	178.8	-180	-178.1	0	115.7	L422	L422-K438 HydrophobicContact CD1-CD 4.2Å; L422-K438 HydrophobicContact CD1-CG 3.62Å
439	S	86.3	Confident	92.8	Very high	63 Å²	63	46.1 Å²	46.1	44%	0.441	24%	0.242	S	C	.	.	S	Bend	trans	-101.4	-37.1	179.8	56.9	0	0	0	0	113	N437	N437-S439 PolarHBondContact O-N 3.07Å; N437-S439 VanDerWaalsContact O-N 3.15Å; N437-S439 WeakPolarHBondContact OD1-CA 3.31Å; N437-S439 PolarHBondContact OD1-N 3.15Å; N437-S439 PolarHBondContact OD1-OG 3.18Å
440	Q	88.3	Confident	92.5	Very high	47 Å²	47	48.2 Å²	48.2	22%	0.22	25%	0.253	C	S	.	.			trans	-160.5	162.8	-174.3	61.8	-173.5	-9.4	0	0	111.9	N437 L442 A457	N437-Q440 PolarHBondContact N-O 2.86Å; N437-Q440 PolarHBondContact OD1-N 3.41Å; N437-Q440 PolarHBondContact OD1-O 3.19Å; N437-Q440 VanDerWaalsContact OD1-O 3.13Å; Q440-L442 HydrophobicContact CG-CD2 4.21Å; Q440-L442 HydrophobicContact CG-CG 4.26Å; Q440-A457 HydrophobicContact CB-CB 4.11Å
441	T	91.7	Very high	92.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	108.7	169.4	-63.2	0	0	0	0	108.7	L175 Y434 C435 V436 L458 K459	L175-T441 HydrophobicContact CD2-CG2 4.49Å; Y434-T441 HydrophobicContact CD1-CG2 4.15Å; C435-T441 CarbonylContact O-C 3.49Å; C435-T441 WeakPolarHBondContact O-CA 3.5Å; V436-T441 HydrophobicContact CG2-CG2 3.92Å; T441-L458 HydrophobicContact CG2-CB 4.23Å; T441-L458 HydrophobicContact CG2-CD1 4.3Å; T441-L458 PolarHBondContact N-O 2.87Å; T441-L458 PolarHBondContact O-N 3.25Å; T441-K459 PolarHBondContact OG1-O 3.42Å
442	L	93.1	Very high	92.6	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	149.2	176.2	-54.9	171.6	0	0	0	110.4	I398 Y434 C435 Q440 F453 A457	I398-L442 HydrophobicContact CD1-CD1 3.79Å; Y434-L442 WeakPolarHBondContact CA-O 3.45Å; C435-L442 HydrophobicContact CB-CB 4.1Å; C435-L442 PolarHBondContact N-O 2.66Å; C435-L442 PolarHBondContact O-N 3.02Å; Q440-L442 HydrophobicContact CG-CD2 4.21Å; Q440-L442 HydrophobicContact CG-CG 4.26Å; L442-F453 HydrophobicContact CB-CD1 4.37Å; L442-A457 HydrophobicContact CD2-CB 3.82Å
443	Q	94.8	Very high	92.5	Very high	38 Å²	38	48 Å²	48	18%	0.178	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123	174.5	-65.7	179.8	-65.7	0	0	109.4	Y434 F453 V454 L458	Y434-Q443 HydrophobicContact CD1-CG 3.99Å; Y434-Q443 HydrophobicContact CE1-CG 3.87Å; Y434-Q443 VanDerWaalsContact CE1-NE2 3.33Å; Y434-Q443 PolarHBondContact OH-NE2 3.07Å; Q443-F453 WeakPolarHBondContact O-CA 3.07Å; Q443-V454 HydrophobicContact CB-CB 4.05Å; Q443-V454 HydrophobicContact CB-CG2 3.7Å; Q443-V454 PolarHBondContact O-N 3.14Å; Q443-L458 HydrophobicContact CG-CD1 4.09Å; Q443-L458 HydrophobicContact CG-CG 4.46Å
444	F	96.7	Very high	92.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	106.1	174.1	-177.4	-101.3	0	0	0	109.3	Y388 F390 V400 A414 I433 V446 A451 Y452 F453	Y388-F444 AromaticContact CD1-CE1 3.88Å; Y388-F444 HydrophobicContact CD1-CE1 3.88Å; Y388-F444 AromaticContact CE1-CE1 3.91Å; Y388-F444 HydrophobicContact CE1-CE1 3.91Å; F390-F444 HydrophobicContact CE1-CB 4.47Å; F390-F444 HydrophobicContact CE1-CD1 4.26Å; F390-F444 HydrophobicContact CE1-CG 4.18Å; F390-F444 AromaticContact CZ-CD1 3.95Å; F390-F444 HydrophobicContact CZ-CD1 3.95Å; F390-F444 HydrophobicContact CZ-CE1 4.41Å; F390-F444 HydrophobicContact CZ-CG 4.26Å; V400-F444 HydrophobicContact CB-CZ 4.35Å; V400-F444 HydrophobicContact CG1-CE1 4.14Å; V400-F444 HydrophobicContact CG1-CZ 3.91Å; V400-F444 HydrophobicContact CG2-CE2 4.14Å; V400-F444 HydrophobicContact CG2-CZ 4.34Å; A414-F444 HydrophobicContact CB-CE2 3.64Å; A414-F444 HydrophobicContact CB-CZ 4.01Å; I433-F444 HydrophobicContact CB-CB 4.22Å; I433-F444 HydrophobicContact CB-CD1 4.35Å; I433-F444 HydrophobicContact CD1-CD1 4.04Å; I433-F444 HydrophobicContact CG1-CD1 4.4Å; I433-F444 PolarHBondContact N-O 2.93Å; I433-F444 PolarHBondContact O-N 2.86Å; F444-V446 HydrophobicContact CD1-CG2 3.89Å; F444-V446 HydrophobicContact CE1-CG2 3.68Å; F444-A451 HydrophobicContact CE1-CB 3.82Å; F444-A451 HydrophobicContact CE2-CB 4.2Å; F444-A451 HydrophobicContact CZ-CB 3.43Å; F444-A451 VanDerWaalsContact CZ-CB 3.43Å; F444-Y452 CarbonylContact C-O 3.54Å; F444-Y452 WeakPolarHBondContact CA-O 3.39Å; F444-Y452 WeakPolarHBondContact CD2-O 3.4Å; F444-F453 HydrophobicContact CB-CD1 4.03Å; F444-F453 HydrophobicContact CB-CE1 3.89Å; F444-F453 HydrophobicContact CB-CZ 4.49Å; F444-F453 AromaticContact CD2-CD1 3.93Å; F444-F453 HydrophobicContact CD2-CD1 3.93Å; F444-F453 AromaticContact CD2-CD2 3.79Å; F444-F453 HydrophobicContact CD2-CD2 3.79Å; F444-F453 AromaticContact CD2-CE1 3.84Å; F444-F453 HydrophobicContact CD2-CE1 3.84Å; F444-F453 AromaticContact CD2-CE2 3.7Å; F444-F453 HydrophobicContact CD2-CE2 3.7Å; F444-F453 AromaticContact CD2-CG 3.91Å; F444-F453 HydrophobicContact CD2-CG 3.91Å; F444-F453 AromaticContact CD2-CZ 3.72Å; F444-F453 HydrophobicContact CD2-CZ 3.72Å; F444-F453 HydrophobicContact CE2-CD2 4.18Å; F444-F453 AromaticContact CE2-CE2 4Å; F444-F453 HydrophobicContact CE2-CE2 4Å; F444-F453 HydrophobicContact CE2-CZ 4.34Å; F444-F453 HydrophobicContact CG-CD1 4.48Å; F444-F453 HydrophobicContact CG-CE1 4.24Å; F444-F453 HydrophobicContact CG-CZ 4.37Å
445	V	96.9	Very high	91.8	Very high	20 Å²	20	58.6 Å²	58.6	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.7	-175.3	180	0	0	0	0	109.2	E447 A451 Y452 V454	V445-E447 HydrophobicContact CG1-CG 4.13Å; V445-A451 CarbonylContact O-C 3.58Å; V445-A451 WeakPolarHBondContact O-CA 3.4Å; V445-Y452 HydrophobicContact CB-CE1 4.36Å; V445-Y452 HydrophobicContact CB-CE2 4.38Å; V445-Y452 HydrophobicContact CG1-CE1 4.42Å; V445-Y452 PolarHBondContact N-O 2.96Å; V445-Y452 PolarHBondContact O-N 2.72Å; V445-V454 HydrophobicContact CG2-CG2 3.77Å
446	V	96.3	Very high	91.4	Very high	6 Å²	6	66 Å²	66	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	104.9	178.1	178.1	0	0	0	0	109.3	L383 Y388 N431 I433 F444 A451	L383-V446 HydrophobicContact CD2-CB 3.67Å; L383-V446 HydrophobicContact CD2-CG1 4.15Å; L383-V446 HydrophobicContact CD2-CG2 3.71Å; Y388-V446 HydrophobicContact CE1-CG2 3.98Å; Y388-V446 HydrophobicContact CE2-CG2 4.48Å; Y388-V446 WeakPolarHBondContact OH-CG1 3.15Å; N431-V446 WeakPolarHBondContact CB-O 3.18Å; N431-V446 PolarHBondContact O-N 3.45Å; I433-V446 HydrophobicContact CD1-CG2 4.35Å; F444-V446 HydrophobicContact CD1-CG2 3.89Å; F444-V446 HydrophobicContact CE1-CG2 3.68Å; V446-A451 HydrophobicContact CG2-CB 4.12Å
447	E	93.8	Very high	91.1	Very high	86 Å²	86	67.7 Å²	67.7	40%	0.402	33%	0.334	S	S	.	.			trans	-89.1	-170.9	173.3	-54.3	-169.9	146.6	0	0	110.3	V445 N450 Y452	V445-E447 HydrophobicContact CG1-CG 4.13Å; E447-N450 WeakPolarHBondContact CB-OD1 3.49Å; E447-N450 WeakPolarHBondContact CG-OD1 3.43Å; E447-N450 PolarHBondContact N-O 2.81Å; E447-N450 PolarHBondContact OE2-ND2 2.64Å; E447-N450 PolarHBondContact OE2-OD1 2.97Å; E447-N450 VanDerWaalsContact OE2-OD1 3.04Å; E447-Y452 HydrophobicContact CG-CE1 4.27Å
448	E	86.3	Confident	91	Very high	186 Å²	186	68.7 Å²	68.7	87%	0.869	34%	0.339	S	S	*	.	S	Bend	trans	-71.5	-40.7	178.6	-64.7	-171.1	164.1	0	0	111.9
449	E	85.2	Confident	91	Very high	191 Å²	191	68.8 Å²	68.8	89%	0.893	34%	0.34	S	S	*	.	S	Bend	trans	-107.6	-22.8	-173	-61.3	-172.7	169.5	0	0	113.8
450	N	90.6	Very high	90.8	Very high	70 Å²	70	66.5 Å²	66.5	37%	0.374	32%	0.324	S	S	.	.			trans	-132.5	167.9	-175	71.9	34.9	0	0	0	111.8	E447 Y452	E447-N450 WeakPolarHBondContact CB-OD1 3.49Å; E447-N450 WeakPolarHBondContact CG-OD1 3.43Å; E447-N450 PolarHBondContact N-O 2.81Å; E447-N450 PolarHBondContact OE2-ND2 2.64Å; E447-N450 PolarHBondContact OE2-OD1 2.97Å; E447-N450 VanDerWaalsContact OE2-OD1 3.04Å; N450-Y452 WeakPolarHBondContact OD1-CD1 3.49Å
451	A	95.4	Very high	90.3	Very high	18 Å²	18	64.4 Å²	64.4	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	137.1	165.9	0	0	0	0	0	109.6	F444 V445 V446	F444-A451 HydrophobicContact CE1-CB 3.82Å; F444-A451 HydrophobicContact CE2-CB 4.2Å; F444-A451 HydrophobicContact CZ-CB 3.43Å; F444-A451 VanDerWaalsContact CZ-CB 3.43Å; V445-A451 CarbonylContact O-C 3.58Å; V445-A451 WeakPolarHBondContact O-CA 3.4Å; V446-A451 HydrophobicContact CG2-CB 4.12Å
452	Y	95.1	Very high	89.1	Confident	99 Å²	99	70.1 Å²	70.1	39%	0.388	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	160.3	-171.1	61.1	-87.7	0	0	0	112.1	F444 V445 E447 N450	F444-Y452 CarbonylContact C-O 3.54Å; F444-Y452 WeakPolarHBondContact CA-O 3.39Å; F444-Y452 WeakPolarHBondContact CD2-O 3.4Å; V445-Y452 HydrophobicContact CB-CE1 4.36Å; V445-Y452 HydrophobicContact CB-CE2 4.38Å; V445-Y452 HydrophobicContact CG1-CE1 4.42Å; V445-Y452 PolarHBondContact N-O 2.96Å; V445-Y452 PolarHBondContact O-N 2.72Å; E447-Y452 HydrophobicContact CG-CE1 4.27Å; N450-Y452 WeakPolarHBondContact OD1-CD1 3.49Å
453	F	94.4	Very high	87.8	Confident	25 Å²	25	78.1 Å²	78.1	11%	0.11	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.3	170.5	-71.5	-83.2	0	0	0	109.9	F390 I398 V400 Q416 L442 Q443 F444	F390-F453 HydrophobicContact CD1-CZ 4.27Å; F390-F453 HydrophobicContact CE1-CE1 4.42Å; F390-F453 AromaticContact CE1-CZ 3.99Å; F390-F453 HydrophobicContact CE1-CZ 3.99Å; I398-F453 HydrophobicContact CB-CZ 4.49Å; I398-F453 HydrophobicContact CG2-CE2 4.23Å; I398-F453 HydrophobicContact CG2-CZ 3.78Å; V400-F453 HydrophobicContact CG2-CE2 3.69Å; V400-F453 HydrophobicContact CG2-CZ 3.74Å; Q416-F453 HydrophobicContact CB-CD2 3.91Å; Q416-F453 HydrophobicContact CB-CE2 4.1Å; Q416-F453 HydrophobicContact CG-CD2 4.47Å; L442-F453 HydrophobicContact CB-CD1 4.37Å; Q443-F453 WeakPolarHBondContact O-CA 3.07Å; F444-F453 HydrophobicContact CB-CD1 4.03Å; F444-F453 HydrophobicContact CB-CE1 3.89Å; F444-F453 HydrophobicContact CB-CZ 4.49Å; F444-F453 AromaticContact CD2-CD1 3.93Å; F444-F453 HydrophobicContact CD2-CD1 3.93Å; F444-F453 AromaticContact CD2-CD2 3.79Å; F444-F453 HydrophobicContact CD2-CD2 3.79Å; F444-F453 AromaticContact CD2-CE1 3.84Å; F444-F453 HydrophobicContact CD2-CE1 3.84Å; F444-F453 AromaticContact CD2-CE2 3.7Å; F444-F453 HydrophobicContact CD2-CE2 3.7Å; F444-F453 AromaticContact CD2-CG 3.91Å; F444-F453 HydrophobicContact CD2-CG 3.91Å; F444-F453 AromaticContact CD2-CZ 3.72Å; F444-F453 HydrophobicContact CD2-CZ 3.72Å; F444-F453 HydrophobicContact CE2-CD2 4.18Å; F444-F453 AromaticContact CE2-CE2 4Å; F444-F453 HydrophobicContact CE2-CE2 4Å; F444-F453 HydrophobicContact CE2-CZ 4.34Å; F444-F453 HydrophobicContact CG-CD1 4.48Å; F444-F453 HydrophobicContact CG-CE1 4.24Å; F444-F453 HydrophobicContact CG-CZ 4.37Å
454	V	93.8	Very high	86.5	Confident	45 Å²	45	77.1 Å²	77.1	27%	0.273	38%	0.381	S	S	.	.			trans	-65.9	138.6	168.6	-176.7	0	0	0	0	108.8	Q443 V445	Q443-V454 HydrophobicContact CB-CB 4.05Å; Q443-V454 HydrophobicContact CB-CG2 3.7Å; Q443-V454 PolarHBondContact O-N 3.14Å; V445-V454 HydrophobicContact CG2-CG2 3.77Å
455	E	86.7	Confident	85.3	Confident	199 Å²	199	83.1 Å²	83.1	93%	0.93	41%	0.407	S	S	*	.	S	Bend	trans	-66.9	-42.7	-174.3	-66.8	-171.1	165.8	0	0	113
456	E	86.4	Confident	84.3	Confident	156 Å²	156	82.6 Å²	82.6	73%	0.729	41%	0.405	S	S	*	.	S	Bend	trans	-88.3	118.8	-179.5	-166.5	172.2	-172.4	0	0	110.6
457	A	85.6	Confident	83.8	Confident	37 Å²	37	85.2 Å²	85.2	31%	0.306	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-81.1	141.8	177.3	0	0	0	0	0	111	Q440 L442	Q440-A457 HydrophobicContact CB-CB 4.11Å; L442-A457 HydrophobicContact CD2-CB 3.82Å
458	L	88.1	Confident	83.6	Confident	26 Å²	26	81.2 Å²	81.2	14%	0.136	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-78.8	157.7	172.5	-50.3	174.7	0	0	0	110.1	F217 N222 Y434 T441 Q443	F217-L458 HydrophobicContact CE1-CD1 4.2Å; F217-L458 HydrophobicContact CZ-CD1 3.84Å; N222-L458 WeakPolarHBondContact OD1-CD2 3.48Å; Y434-L458 HydrophobicContact CE1-CD1 4.15Å; T441-L458 HydrophobicContact CG2-CB 4.23Å; T441-L458 HydrophobicContact CG2-CD1 4.3Å; T441-L458 PolarHBondContact N-O 2.87Å; T441-L458 PolarHBondContact O-N 3.25Å; Q443-L458 HydrophobicContact CG-CD1 4.09Å; Q443-L458 HydrophobicContact CG-CG 4.46Å
459	K	86.4	Confident	84	Confident	127 Å²	127	74.5 Å²	74.5	55%	0.552	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-62.1	146.7	178.1	-67.5	179.9	-179.4	174	0	111.3	W224 T441	W224-K459 PolarHBondContact NE1-O 2.87Å; T441-K459 PolarHBondContact OG1-O 3.42Å
460	A	81.8	Confident	84.5	Confident	14 Å²	14	65.7 Å²	65.7	12%	0.116	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-79.4	157	164.5	0	0	0	0	0	110.3	W224 N437 L462	W224-A460 VanDerWaalsContact CD1-C 3.5Å; N437-A460 WeakPolarHBondContact O-CB 3.42Å; A460-L462 PolarHBondContact O-N 2.88Å
461	P	77.7	Confident	84.9	Confident	4 Å²	4	62.8 Å²	62.8	3%	0.026	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-55.4	125.7	169.8	-16.9	25.8	0	0	0	110.5	V177 Y215 W224 L468	V177-P461 HydrophobicContact CG1-CG 4.44Å; Y215-P461 HydrophobicContact CD2-CB 4.27Å; Y215-P461 HydrophobicContact CG-CB 4.2Å; W224-P461 HydrophobicContact CB-CB 4.06Å; W224-P461 HydrophobicContact CB-CG 4.42Å; W224-P461 VanDerWaalsContact CD1-N 3.32Å; W224-P461 HydrophobicContact CD2-CB 4.19Å; W224-P461 HydrophobicContact CD2-CG 3.57Å; W224-P461 HydrophobicContact CE3-CG 3.98Å; W224-P461 HydrophobicContact CG-CB 3.88Å; W224-P461 HydrophobicContact CG-CG 3.76Å; W224-P461 HydrophobicContact CZ2-CG 4.26Å; W224-P461 HydrophobicContact CZ3-CG 4.48Å; P461-L468 HydrophobicContact CG-CD1 3.81Å
462	L	66.7	Low	84.9	Confident	119 Å²	119	63.3 Å²	63.3	62%	0.623	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	141.6	176.6	-75.7	145.4	0	0	0	110.1	A460 A464	A460-L462 PolarHBondContact O-N 2.88Å; L462-A464 VanDerWaalsContact C-N 3.33Å; L462-A464 PolarHBondContact O-N 3.19Å
463	E	66	Low	85	Confident	174 Å²	174	58.7 Å²	58.7	81%	0.813	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	2.9	171.6	-53.5	176.5	173.3	0	0	118.1	K465	E463-K465 PolarHBondContact O-N 2.88Å
464	A	67.3	Low	85.1	Confident	18 Å²	18	57.8 Å²	57.8	15%	0.149	29%	0.294	C	S	.	.			trans	-62.4	120.3	176.1	0	0	0	0	0	112.2	L462 L468	L462-A464 VanDerWaalsContact C-N 3.33Å; L462-A464 PolarHBondContact O-N 3.19Å; A464-L468 HydrophobicContact CB-CD1 4.45Å; A464-L468 HydrophobicContact CB-CD2 3.63Å; A464-L468 HydrophobicContact CB-CG 4.4Å
465	K	69.9	Low	85	Confident	126 Å²	126	56.9 Å²	56.9	55%	0.548	29%	0.287	S	S	.	.			trans	-92.6	-29.1	177.4	-63.5	179.1	-174.4	172.9	0	111.4	E179 E209 E463	E179-K465 PolarHBondContact OE1-N 2.74Å; E209-K465 IonicContact OE2-NZ 2.76Å; E209-K465 PolarHBondContact OE2-NZ 3.05Å; E463-K465 PolarHBondContact O-N 2.88Å
466	G	76.1	Confident	84.9	Confident	9 Å²	9	50.8 Å²	50.8	9%	0.093	27%	0.265	C	S	.	.	S	Bend	trans	-90.4	-168	-177.6	0	0	0	0	0	116.4	E179 V180	E179-G466 PolarHBondContact OE1-N 3.04Å; V180-G466 CarbonylContact O-C 3.56Å; V180-G466 WeakPolarHBondContact O-CA 3.45Å
467	V	85.6	Confident	84.3	Confident	60 Å²	60	50.4 Å²	50.4	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	139.1	167.1	177	0	0	0	0	109.1	V180 D182	V180-V467 HydrophobicContact CG2-CB 4.17Å; V180-V467 HydrophobicContact CG2-CG1 4.37Å; V180-V467 VanDerWaalsContact CG2-O 3.26Å; V180-V467 WeakPolarHBondContact CG2-O 3.37Å; V180-V467 PolarHBondContact N-O 2.86Å; V180-V467 WeakPolarHBondContact O-CA 3.39Å; V180-V467 PolarHBondContact O-N 3.38Å; D182-V467 HydrophobicContact CB-CG2 3.99Å
468	L	91.3	Very high	83	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.2	179.5	-63.2	-171.9	0	0	0	110.2	V177 E179 R425 V436 P461 A464 P470	V177-L468 HydrophobicContact CG1-CB 3.57Å; V177-L468 HydrophobicContact CG1-CD1 4.12Å; V177-L468 HydrophobicContact CG1-CD2 3.57Å; V177-L468 HydrophobicContact CG1-CG 3.92Å; E179-L468 HydrophobicContact CB-CD2 4.49Å; E179-L468 HydrophobicContact CG-CD2 4.45Å; R425-L468 WeakPolarHBondContact CB-O 3.36Å; R425-L468 WeakPolarHBondContact CG-O 3.44Å; V436-L468 HydrophobicContact CG1-CB 4.24Å; V436-L468 HydrophobicContact CG1-CD1 3.87Å; P461-L468 HydrophobicContact CG-CD1 3.81Å; A464-L468 HydrophobicContact CB-CD1 4.45Å; A464-L468 HydrophobicContact CB-CD2 3.63Å; A464-L468 HydrophobicContact CB-CG 4.4Å; L468-P470 WeakPolarHBondContact O-CD 3.31Å
469	F	94.1	Very high	80.9	Confident	45 Å²	45	62 Å²	62	20%	0.197	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	100.4	172.9	-167.3	-79.6	0	0	0	109.6	V177 A178 V180 I241 F471	V177-F469 WeakPolarHBondContact CA-O 3.34Å; A178-F469 PolarHBondContact N-O 3.29Å; A178-F469 PolarHBondContact O-N 3.37Å; V180-F469 HydrophobicContact CG2-CB 4.08Å; I241-F469 HydrophobicContact CB-CD1 3.76Å; I241-F469 HydrophobicContact CB-CD2 4.41Å; I241-F469 HydrophobicContact CB-CE1 3.62Å; I241-F469 HydrophobicContact CB-CE2 4.28Å; I241-F469 HydrophobicContact CB-CG 4.17Å; I241-F469 HydrophobicContact CB-CZ 3.89Å; I241-F469 HydrophobicContact CD1-CB 4.23Å; I241-F469 HydrophobicContact CD1-CD1 4.3Å; I241-F469 HydrophobicContact CD1-CG 4.17Å; I241-F469 HydrophobicContact CG2-CD1 3.62Å; I241-F469 HydrophobicContact CG2-CE1 3.56Å; I241-F469 HydrophobicContact CG2-CG 4.43Å; I241-F469 HydrophobicContact CG2-CZ 4.31Å; I241-F469 VanDerWaalsContact O-CZ 3.31Å; I241-F469 WeakPolarHBondContact O-CZ 3.15Å; F469-F471 HydrophobicContact CD1-CD1 4.4Å; F469-F471 WeakPolarHBondContact O-CD1 3.46Å
470	P	96.3	Very high	78.6	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.032	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	146.1	178.3	33.6	-34.5	0	0	0	111.2	L175 M176 V177 R425 A427 V436 L468	L175-P470 HydrophobicContact CD1-CB 4.28Å; M176-P470 CarbonylContact O-C 3.53Å; M176-P470 WeakPolarHBondContact O-CA 3.3Å; V177-P470 HydrophobicContact CG2-CB 4.04Å; R425-P470 VanDerWaalsContact C-CG 3.47Å; R425-P470 HydrophobicContact CB-CG 3.91Å; R425-P470 WeakPolarHBondContact O-CG 3.15Å; A427-P470 HydrophobicContact CB-CB 3.79Å; A427-P470 HydrophobicContact CB-CG 4.15Å; V436-P470 HydrophobicContact CB-CB 4.17Å; V436-P470 HydrophobicContact CB-CG 4.18Å; V436-P470 HydrophobicContact CG2-CB 3.82Å; V436-P470 HydrophobicContact CG2-CG 4.18Å; L468-P470 WeakPolarHBondContact O-CD 3.31Å
471	F	97.4	Very high	76.5	Confident	10 Å²	10	73.6 Å²	73.6	4%	0.044	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	175.6	175.4	61.2	-89.2	0	0	0	109.9	M176 A178 I214 T243 L248 F469 L473	M176-F471 HydrophobicContact CB-CD1 4.46Å; M176-F471 HydrophobicContact CB-CD2 3.94Å; M176-F471 HydrophobicContact CB-CE1 4.04Å; M176-F471 HydrophobicContact CB-CE2 3.47Å; M176-F471 VanDerWaalsContact CB-CE2 3.47Å; M176-F471 HydrophobicContact CB-CG 4.41Å; M176-F471 HydrophobicContact CB-CZ 3.52Å; M176-F471 HydrophobicContact CG-CE2 4.12Å; M176-F471 HydrophobicContact CG-CZ 4.46Å; M176-F471 PolarHBondContact N-O 3.47Å; M176-F471 PolarHBondContact O-N 2.75Å; M176-F471 VanDerWaalsContact O-O 3.14Å; M176-F471 HydrophobicContact SD-CD2 4.43Å; M176-F471 HydrophobicContact SD-CE2 3.58Å; M176-F471 VanDerWaalsContact SD-CE2 3.58Å; M176-F471 HydrophobicContact SD-CZ 4.13Å; A178-F471 HydrophobicContact CB-CE1 3.88Å; I214-F471 HydrophobicContact CD1-CZ 4.34Å; I214-F471 HydrophobicContact CG2-CE1 4.29Å; I214-F471 HydrophobicContact CG2-CZ 3.72Å; T243-F471 HydrophobicContact CG2-CB 3.94Å; T243-F471 HydrophobicContact CG2-CD2 3.91Å; T243-F471 HydrophobicContact CG2-CG 4.26Å; L248-F471 HydrophobicContact CD1-CD1 3.95Å; L248-F471 HydrophobicContact CD1-CD2 3.79Å; L248-F471 HydrophobicContact CD1-CE1 4.05Å; L248-F471 HydrophobicContact CD1-CE2 3.88Å; L248-F471 HydrophobicContact CD1-CG 3.83Å; L248-F471 HydrophobicContact CD1-CZ 4.01Å; L248-F471 HydrophobicContact CD2-CE1 4.03Å; L248-F471 HydrophobicContact CD2-CE2 4.03Å; L248-F471 HydrophobicContact CD2-CZ 3.63Å; L248-F471 HydrophobicContact CG-CE2 4.38Å; L248-F471 HydrophobicContact CG-CZ 4.38Å; F469-F471 HydrophobicContact CD1-CD1 4.4Å; F469-F471 WeakPolarHBondContact O-CD1 3.46Å; F471-L473 HydrophobicContact CD2-CD1 4.33Å; F471-L473 HydrophobicContact CD2-CG 3.96Å; F471-L473 HydrophobicContact CE2-CD1 3.72Å; F471-L473 HydrophobicContact CE2-CG 3.85Å
472	V	97.3	Very high	74.3	Confident	29 Å²	29	82.6 Å²	82.6	18%	0.176	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.3	-177.4	-174.6	0	0	0	0	110	K173 A427 I429	K173-V472 HydrophobicContact CB-CG1 3.92Å; K173-V472 HydrophobicContact CG-CG1 4.39Å; A427-V472 HydrophobicContact CB-CG2 4.1Å; I429-V472 HydrophobicContact CD1-CG1 4.24Å; I429-V472 HydrophobicContact CD1-CG2 3.98Å; I429-V472 HydrophobicContact CG1-CB 4.44Å; I429-V472 HydrophobicContact CG1-CG1 4Å; I429-V472 HydrophobicContact CG1-CG2 3.52Å
473	L	97.2	Very high	72.8	Confident	2 Å²	2	81.4 Å²	81.4	1%	0.01	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153	168.5	-63.8	177.6	0	0	0	109.5	T174 M176 T243 N246 L248 Y270 P272 F471	T174-L473 PolarHBondContact N-O 3.33Å; T174-L473 PolarHBondContact O-N 2.92Å; M176-L473 HydrophobicContact CE-CB 3.79Å; M176-L473 HydrophobicContact CE-CD1 4.41Å; M176-L473 HydrophobicContact SD-CB 3.91Å; M176-L473 HydrophobicContact SD-CD1 3.78Å; M176-L473 HydrophobicContact SD-CG 4.03Å; T243-L473 HydrophobicContact CG2-CD2 3.79Å; N246-L473 WeakPolarHBondContact OD1-CA 3.31Å; N246-L473 WeakPolarHBondContact OD1-CB 3.36Å; L248-L473 HydrophobicContact CB-CD1 4.28Å; Y270-L473 HydrophobicContact CD1-CD1 4.23Å; Y270-L473 HydrophobicContact CE1-CD1 4.37Å; P272-L473 HydrophobicContact CB-CD1 3.98Å; P272-L473 HydrophobicContact CG-CB 4.37Å; P272-L473 HydrophobicContact CG-CD1 3.95Å; F471-L473 HydrophobicContact CD2-CD1 4.33Å; F471-L473 HydrophobicContact CD2-CG 3.96Å; F471-L473 HydrophobicContact CE2-CD1 3.72Å; F471-L473 HydrophobicContact CE2-CG 3.85Å
474	S	95.4	Very high	71.1	Confident	5 Å²	5	80.7 Å²	80.7	4%	0.035	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	119.5	168.8	-58.8	0	0	0	0	108.8	M169 E170 R172 N246	M169-S474 PolarHBondContact O-OG 3.44Å; M169-S474 VanDerWaalsContact O-OG 3.09Å; E170-S474 WeakPolarHBondContact O-CB 3.46Å; R172-S474 WeakPolarHBondContact O-CA 3.3Å; N246-S474 PolarHBondContact ND2-O 2.89Å; N246-S474 PolarHBondContact OD1-N 3.14Å; N246-S474 PolarHBondContact OD1-O 2.73Å
475	L	91.3	Very high	69.6	Low	27 Å²	27	84.1 Å²	84.1	14%	0.141	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	142.8	173.3	-68.2	-178.2	0	0	0	110.3	G171 R172 T174 M176 P272 E477	G171-L475 WeakPolarHBondContact CA-O 3.31Å; R172-L475 PolarHBondContact N-O 3.07Å; R172-L475 PolarHBondContact O-N 2.83Å; T174-L475 HydrophobicContact CG2-CD1 4.23Å; M176-L475 HydrophobicContact CE-CD1 3.63Å; M176-L475 HydrophobicContact CE-CD2 3.58Å; M176-L475 HydrophobicContact CE-CG 3.49Å; M176-L475 VanDerWaalsContact CE-CG 3.49Å; P272-L475 HydrophobicContact CB-CD2 3.93Å; L475-E477 PolarHBondContact O-N 2.76Å
476	P	84.9	Confident	67.8	Low	71 Å²	71	81.6 Å²	81.6	46%	0.461	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60.6	139.9	170.8	24.6	-30.7	0	0	0	109.7	K478	P476-K478 PolarHBondContact O-N 2.81Å
477	E	73.8	Confident	66	Low	147 Å²	147	89 Å²	89	69%	0.687	49%	0.49	S	S	*	.			trans	-64.4	110.9	172.9	-68.3	-179.6	174.7	0	0	108.1	L475	L475-E477 PolarHBondContact O-N 2.76Å
478	K	59.3	Low	63.6	Low	186 Å²	186	97.4 Å²	97.4	81%	0.809	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-64.8	128.1	167.5	-74.4	-175.8	179	177.1	0	106.4	P476 E480	P476-K478 PolarHBondContact O-N 2.81Å; K478-E480 PolarHBondContact O-N 3.09Å
479	P	43.3	Very low	62.2	Low	120 Å²	120	102.2 Å²	102.2	78%	0.779	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-56.7	121	169.9	22.5	-30	0	0	0	106.7	K481	P479-K481 PolarHBondContact O-N 3.04Å
480	E	38.3	Very low	60.5	Low	184 Å²	184	105.2 Å²	105.2	86%	0.86	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-51.2	119.3	173.6	-70.1	-177.5	164.7	0	0	106.8	K478 K482	K478-E480 PolarHBondContact O-N 3.09Å; E480-K482 VanDerWaalsContact C-N 3.29Å; E480-K482 PolarHBondContact O-N 2.78Å
481	K	37.5	Very low	58.5	Low	202 Å²	202	110.7 Å²	110.7	88%	0.878	61%	0.607	S	S	*	*			trans	-57.1	106.7	164.7	-79.9	-176.2	176.7	-178.4	0	104.3	P479 A483	P479-K481 PolarHBondContact O-N 3.04Å; K481-A483 VanDerWaalsContact C-N 3.3Å; K481-A483 PolarHBondContact O-N 2.97Å
482	K	31.7	Very low	56.3	Low	193 Å²	193	116.6 Å²	116.6	84%	0.839	64%	0.64	S	S	*	*			trans	-49.7	106.6	163.8	-76.4	-174.9	177.2	-178.1	0	105	E480 N484	E480-K482 VanDerWaalsContact C-N 3.29Å; E480-K482 PolarHBondContact O-N 2.78Å; K482-N484 VanDerWaalsContact C-N 3.34Å; K482-N484 PolarHBondContact O-N 3.24Å
483	A	33.9	Very low	53.7	Low	94 Å²	94	122.1 Å²	122.1	78%	0.777	67%	0.669	S	S	*	*			trans	-58.3	108.9	169.2	0	0	0	0	0	104.5	K481 A485	K481-A483 VanDerWaalsContact C-N 3.3Å; K481-A483 PolarHBondContact O-N 2.97Å; A483-A485 PolarHBondContact O-N 3Å
484	N	32.3	Very low	50.8	Low	158 Å²	158	130.1 Å²	130.1	85%	0.845	71%	0.713	S	S	*	*			trans	-59.3	97.9	164.3	-83.5	-16	0	0	0	105.3	K482 G486	K482-N484 VanDerWaalsContact C-N 3.34Å; K482-N484 PolarHBondContact O-N 3.24Å; N484-G486 PolarHBondContact O-N 3.19Å
485	A	34.6	Very low	47.6	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	76%	0.761	S	S	*	*			trans	-60.2	97.9	156.7	0	0	0	0	0	105.2	A483 I487	A483-A485 PolarHBondContact O-N 3Å; A485-I487 PolarHBondContact O-N 3.1Å; A485-I487 VanDerWaalsContact O-N 3.13Å
486	G	31.4	Very low	44.2	Very low	72 Å²	72	147.7 Å²	147.7	74%	0.742	81%	0.809	S	S	*	*			trans	-58.7	114.8	169.4	0	0	0	0	0	107.6	N484 L488	N484-G486 PolarHBondContact O-N 3.19Å; G486-L488 PolarHBondContact O-N 3.16Å
487	I	38.2	Very low	40.9	Very low	164 Å²	164	154.1 Å²	154.1	84%	0.841	84%	0.838	S	S	*	*			trans	-70.7	110.9	157.8	-60.5	171.5	0	0	0	105	A485	A485-I487 PolarHBondContact O-N 3.1Å; A485-I487 VanDerWaalsContact O-N 3.13Å
488	L	36	Very low	37.9	Very low	238 Å²	238	154.7 Å²	154.7	100%	1.246	85%	0.852	S	S	*	*			trans	-112.7	0	147.1	-93.5	168.8	0	0	0	107	G486	G486-L488 PolarHBondContact O-N 3.16Å

Retrieved 488 of 488 residues in 277.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).