A0A077ZCC2_TRITR Loading...

Dynein intermediate chain

AlphaFold DB , UniProt , Accession A0A077ZCC2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 649 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.7	Low	77	Confident	217 Å²	217	128.2 Å²	128.2	100%	1.069	63%	0.633	S	S	*	*				0	-34.8	0	-70.3	-169.3	178.9	0	0	113.3	N3 Q4	M1-N3 PolarHBondContact O-N 3.09Å; M1-Q4 PolarHBondContact O-N 3.37Å
2	H	58.3	Low	77.9	Confident	148 Å²	148	128.3 Å²	128.3	69%	0.685	63%	0.631	S	S	*	*	H	α-helix	trans	-61	-42.2	-178.6	-139.1	57.5	0	0	0	114.9	Q4 S5 D6	H2-Q4 VanDerWaalsContact C-N 3.31Å; H2-Q4 PolarHBondContact O-N 3.47Å; H2-S5 PolarHBondContact O-N 3.21Å; H2-S5 PolarHBondContact O-OG 3.28Å; H2-D6 PolarHBondContact O-N 3.25Å
3	N	72.1	Confident	78.7	Confident	137 Å²	137	134.4 Å²	134.4	73%	0.733	64%	0.643	S	S	*	*	H	α-helix	trans	-67.1	-24.7	179.9	-76.9	4.4	0	0	0	115	M1 R7	M1-N3 PolarHBondContact O-N 3.09Å; N3-R7 PolarHBondContact O-N 2.82Å
4	Q	75	Confident	79.6	Confident	160 Å²	160	133.1 Å²	133.1	75%	0.748	63%	0.633	S	S	*	*	H	α-helix	trans	-78.8	-34.8	177.1	-84.2	-176.5	-12.5	0	0	111.7	M1 H2 D6 K8	M1-Q4 PolarHBondContact O-N 3.37Å; H2-Q4 VanDerWaalsContact C-N 3.31Å; H2-Q4 PolarHBondContact O-N 3.47Å; Q4-D6 VanDerWaalsContact C-N 3.34Å; Q4-K8 WeakPolarHBondContact O-CB 3.36Å; Q4-K8 PolarHBondContact O-N 2.88Å
5	S	81.3	Confident	80.3	Confident	61 Å²	61	135.1 Å²	135.1	43%	0.427	64%	0.638	S	S	.	*	H	α-helix	trans	-66	-39.6	173.8	55.5	0	0	0	0	111.3	H2 K8 A9	H2-S5 PolarHBondContact O-N 3.21Å; H2-S5 PolarHBondContact O-OG 3.28Å; S5-K8 PolarHBondContact O-N 3.36Å; S5-A9 WeakPolarHBondContact O-CB 3.32Å; S5-A9 PolarHBondContact O-N 3.04Å
6	D	83.2	Confident	80.8	Confident	84 Å²	84	130.6 Å²	130.6	45%	0.449	63%	0.63	S	S	.	*	H	α-helix	trans	-68.1	-43.1	-179.6	-65	-14.5	0	0	0	111.7	H2 Q4 K8 A9 E10	H2-D6 PolarHBondContact O-N 3.25Å; Q4-D6 VanDerWaalsContact C-N 3.34Å; D6-K8 VanDerWaalsContact C-N 3.34Å; D6-K8 PolarHBondContact O-N 3.24Å; D6-A9 PolarHBondContact O-N 2.88Å; D6-E10 WeakPolarHBondContact O-CB 3.49Å; D6-E10 PolarHBondContact O-N 3.3Å
7	R	80.6	Confident	81.3	Confident	184 Å²	184	131.8 Å²	131.8	69%	0.694	63%	0.632	S	S	*	*	H	α-helix	trans	-65.6	-36.6	175.7	-165	173.6	-175.9	179.2	0.5	112.2	N3 E10 L11	N3-R7 PolarHBondContact O-N 2.82Å; R7-E10 PolarHBondContact O-N 3.48Å; R7-L11 WeakPolarHBondContact O-CB 3.4Å; R7-L11 WeakPolarHBondContact O-CG 3.37Å; R7-L11 PolarHBondContact O-N 2.96Å
8	K	86.5	Confident	81.5	Confident	150 Å²	150	130.5 Å²	130.5	65%	0.652	63%	0.628	S	S	*	*	H	α-helix	trans	-66.3	-43.6	174.4	-172.3	178.2	177.9	-177.8	0	111.2	Q4 S5 D6 E10 L11 E12	Q4-K8 WeakPolarHBondContact O-CB 3.36Å; Q4-K8 PolarHBondContact O-N 2.88Å; S5-K8 PolarHBondContact O-N 3.36Å; D6-K8 VanDerWaalsContact C-N 3.34Å; D6-K8 PolarHBondContact O-N 3.24Å; K8-E10 VanDerWaalsContact C-N 3.34Å; K8-E10 PolarHBondContact O-N 3.48Å; K8-L11 PolarHBondContact O-N 3.37Å; K8-E12 WeakPolarHBondContact O-CB 3.5Å; K8-E12 PolarHBondContact O-N 3.46Å
9	A	87.4	Confident	81.9	Confident	53 Å²	53	126.5 Å²	126.5	44%	0.438	62%	0.619	S	S	.	*	H	α-helix	trans	-65.2	-35.9	176.5	0	0	0	0	0	112.4	S5 D6 E12 R13	S5-A9 WeakPolarHBondContact O-CB 3.32Å; S5-A9 PolarHBondContact O-N 3.04Å; D6-A9 PolarHBondContact O-N 2.88Å; A9-E12 PolarHBondContact O-N 3.35Å; A9-R13 PolarHBondContact O-N 3.03Å
10	E	85.6	Confident	82.3	Confident	105 Å²	105	123 Å²	123	49%	0.491	61%	0.611	S	S	.	*	H	α-helix	trans	-68	-42.3	175.1	-161.1	-166.8	150.5	0	0	112	D6 R7 K8 E12 R13 K14	D6-E10 WeakPolarHBondContact O-CB 3.49Å; D6-E10 PolarHBondContact O-N 3.3Å; R7-E10 PolarHBondContact O-N 3.48Å; K8-E10 VanDerWaalsContact C-N 3.34Å; K8-E10 PolarHBondContact O-N 3.48Å; E10-E12 VanDerWaalsContact C-N 3.34Å; E10-R13 PolarHBondContact O-N 2.98Å; E10-K14 PolarHBondContact O-N 3.49Å; E10-K14 WeakPolarHBondContact OE1-CE 3.36Å; E10-K14 IonicContact OE1-NZ 2.78Å; E10-K14 PolarHBondContact OE1-NZ 2.93Å
11	L	83.8	Confident	82.5	Confident	111 Å²	111	121.4 Å²	121.4	58%	0.581	60%	0.604	S	S	*	*	H	α-helix	trans	-63.3	-40.1	174.5	-76.7	171.6	0	0	0	111.8	R7 K8 K14 K15	R7-L11 WeakPolarHBondContact O-CB 3.4Å; R7-L11 WeakPolarHBondContact O-CG 3.37Å; R7-L11 PolarHBondContact O-N 2.96Å; K8-L11 PolarHBondContact O-N 3.37Å; L11-K14 PolarHBondContact O-N 3.38Å; L11-K15 WeakPolarHBondContact O-CB 3.47Å; L11-K15 PolarHBondContact O-N 3.41Å
12	E	87.9	Confident	84.1	Confident	130 Å²	130	120.7 Å²	120.7	61%	0.607	59%	0.59	S	S	*	*	H	α-helix	trans	-67.2	-38.9	177.6	-162.8	168.6	-169.2	0	0	111.6	K8 A9 E10 K15 A16	K8-E12 WeakPolarHBondContact O-CB 3.5Å; K8-E12 PolarHBondContact O-N 3.46Å; A9-E12 PolarHBondContact O-N 3.35Å; E10-E12 VanDerWaalsContact C-N 3.34Å; E12-K15 PolarHBondContact O-N 2.89Å; E12-A16 WeakPolarHBondContact O-CB 3.45Å; E12-A16 PolarHBondContact O-N 3.31Å
13	R	88.2	Confident	85.6	Confident	207 Å²	207	120.8 Å²	120.8	78%	0.781	59%	0.59	S	S	*	*	H	α-helix	trans	-62.4	-42.9	170.4	-87.2	-176	172.2	173.5	-0.8	112.9	A9 E10 A16 K17	A9-R13 PolarHBondContact O-N 3.03Å; E10-R13 PolarHBondContact O-N 2.98Å; R13-A16 PolarHBondContact O-N 2.97Å; R13-K17 WeakPolarHBondContact O-CB 3.34Å; R13-K17 PolarHBondContact O-N 3.46Å
14	K	90.6	Very high	86.5	Confident	117 Å²	117	119.8 Å²	119.8	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-65.6	-41	176.8	-76.6	178.3	-178	161.8	0	111.5	E10 L11 K17 L18	E10-K14 PolarHBondContact O-N 3.49Å; E10-K14 WeakPolarHBondContact OE1-CE 3.36Å; E10-K14 IonicContact OE1-NZ 2.78Å; E10-K14 PolarHBondContact OE1-NZ 2.93Å; L11-K14 PolarHBondContact O-N 3.38Å; K14-K17 PolarHBondContact O-N 3Å; K14-L18 WeakPolarHBondContact O-CG 3.45Å; K14-L18 PolarHBondContact O-N 3.11Å
15	K	90.8	Very high	87.2	Confident	163 Å²	163	119.7 Å²	119.7	71%	0.709	58%	0.578	S	S	*	*	H	α-helix	trans	-63.8	-42.7	175.7	-168	176.6	-179.3	-179.8	0	111.9	L11 E12 L18 A19	L11-K15 WeakPolarHBondContact O-CB 3.47Å; L11-K15 PolarHBondContact O-N 3.41Å; E12-K15 PolarHBondContact O-N 2.89Å; K15-L18 PolarHBondContact O-N 2.89Å; K15-A19 WeakPolarHBondContact O-CB 3.4Å; K15-A19 PolarHBondContact O-N 2.98Å
16	A	88.1	Confident	87.6	Confident	62 Å²	62	123.1 Å²	123.1	51%	0.512	59%	0.586	S	S	.	*	H	α-helix	trans	-63.9	-40.3	175.1	0	0	0	0	0	112.2	E12 R13 A19 A20	E12-A16 WeakPolarHBondContact O-CB 3.45Å; E12-A16 PolarHBondContact O-N 3.31Å; R13-A16 PolarHBondContact O-N 2.97Å; A16-A19 PolarHBondContact O-N 3.42Å; A16-A20 PolarHBondContact O-N 2.92Å
17	K	89.1	Confident	87.8	Confident	151 Å²	151	126.9 Å²	126.9	66%	0.657	59%	0.593	S	S	*	*	H	α-helix	trans	-65.8	-41.3	176.5	-167.2	175.4	-178.6	-178.9	0	112.3	R13 K14 A20 I21	R13-K17 WeakPolarHBondContact O-CB 3.34Å; R13-K17 PolarHBondContact O-N 3.46Å; K14-K17 PolarHBondContact O-N 3Å; K17-A20 PolarHBondContact O-N 3.47Å; K17-I21 HydrophobicContact CG-CD1 4.41Å; K17-I21 WeakPolarHBondContact O-CG1 3.47Å; K17-I21 PolarHBondContact O-N 3.38Å; K17-I21 VanDerWaalsContact O-N 3.11Å
18	L	83.9	Confident	88.1	Confident	109 Å²	109	124.5 Å²	124.5	57%	0.571	59%	0.588	S	S	*	*	H	α-helix	trans	-66.1	-38.2	175	-76.1	167.9	0	0	0	112.3	K14 K15 I21 R22	K14-L18 WeakPolarHBondContact O-CG 3.45Å; K14-L18 PolarHBondContact O-N 3.11Å; K15-L18 PolarHBondContact O-N 2.89Å; L18-I21 PolarHBondContact O-N 3.38Å; L18-R22 WeakPolarHBondContact O-CG 3.39Å; L18-R22 PolarHBondContact O-N 2.9Å
19	A	89.8	Confident	88.1	Confident	55 Å²	55	122.7 Å²	122.7	46%	0.455	58%	0.582	S	S	.	*	H	α-helix	trans	-63.1	-43.5	174.7	0	0	0	0	0	111.8	K15 A16 I21 R22 E23	K15-A19 WeakPolarHBondContact O-CB 3.4Å; K15-A19 PolarHBondContact O-N 2.98Å; A16-A19 PolarHBondContact O-N 3.42Å; A19-I21 PolarHBondContact O-N 3.49Å; A19-R22 PolarHBondContact O-N 3.34Å; A19-E23 PolarHBondContact O-N 2.92Å
20	A	89.4	Confident	88.1	Confident	55 Å²	55	124.7 Å²	124.7	46%	0.455	58%	0.582	S	S	.	*	H	α-helix	trans	-62.5	-40.6	176.6	0	0	0	0	0	112.6	A16 K17 E23 E24	A16-A20 PolarHBondContact O-N 2.92Å; K17-A20 PolarHBondContact O-N 3.47Å; A20-E23 PolarHBondContact O-N 3.41Å; A20-E24 WeakPolarHBondContact O-CB 3.38Å; A20-E24 PolarHBondContact O-N 3.32Å
21	I	88	Confident	88.1	Confident	91 Å²	91	123.7 Å²	123.7	47%	0.467	58%	0.577	S	S	.	*	H	α-helix	trans	-65.5	-39.8	176.3	-66.7	166.7	0	0	0	111.1	K17 L18 A19 K25	K17-I21 HydrophobicContact CG-CD1 4.41Å; K17-I21 WeakPolarHBondContact O-CG1 3.47Å; K17-I21 PolarHBondContact O-N 3.38Å; K17-I21 VanDerWaalsContact O-N 3.11Å; L18-I21 PolarHBondContact O-N 3.38Å; A19-I21 PolarHBondContact O-N 3.49Å; I21-K25 WeakPolarHBondContact O-CB 3.41Å; I21-K25 PolarHBondContact O-N 2.77Å
22	R	86.5	Confident	88.1	Confident	202 Å²	202	125.6 Å²	125.6	76%	0.762	58%	0.577	S	S	*	*	H	α-helix	trans	-65.5	-41.2	175.9	-76.4	-178.5	177.8	-179.6	-2.1	111.9	L18 A19 K25 K26	L18-R22 WeakPolarHBondContact O-CG 3.39Å; L18-R22 PolarHBondContact O-N 2.9Å; A19-R22 PolarHBondContact O-N 3.34Å; R22-K25 PolarHBondContact O-N 3.42Å; R22-K26 WeakPolarHBondContact O-CB 3.37Å; R22-K26 PolarHBondContact O-N 2.93Å
23	E	90.6	Very high	87.8	Confident	149 Å²	149	128.4 Å²	128.4	70%	0.696	58%	0.582	S	S	*	*	H	α-helix	trans	-67.6	-40.7	177.6	-167	173.2	-173.2	0	0	111.8	A19 A20 K26 R27	A19-E23 PolarHBondContact O-N 2.92Å; A20-E23 PolarHBondContact O-N 3.41Å; E23-K26 PolarHBondContact O-N 2.87Å; E23-R27 WeakPolarHBondContact O-CB 3.49Å; E23-R27 PolarHBondContact O-N 2.96Å
24	E	89.3	Confident	87.5	Confident	117 Å²	117	124.8 Å²	124.8	55%	0.547	57%	0.572	S	S	.	*	H	α-helix	trans	-64.5	-42.3	174.6	-168.3	-176.8	162	0	0	112	A20 R27 K28	A20-E24 WeakPolarHBondContact O-CB 3.38Å; A20-E24 PolarHBondContact O-N 3.32Å; E24-R27 PolarHBondContact O-N 2.96Å; E24-K28 PolarHBondContact O-N 3.05Å; E24-K28 IonicContact OE1-NZ 3.55Å
25	K	90	Very high	86.9	Confident	158 Å²	158	125.2 Å²	125.2	69%	0.687	58%	0.576	S	S	*	*	H	α-helix	trans	-63.3	-42.8	176.2	-165.3	179.4	180	-175.8	0	111.1	I21 R22 K28 E29	I21-K25 WeakPolarHBondContact O-CB 3.41Å; I21-K25 PolarHBondContact O-N 2.77Å; R22-K25 PolarHBondContact O-N 3.42Å; K25-K28 PolarHBondContact O-N 3.29Å; K25-E29 WeakPolarHBondContact O-CB 3.45Å; K25-E29 PolarHBondContact O-N 3.41Å
26	K	89.6	Confident	86.1	Confident	133 Å²	133	122.3 Å²	122.3	58%	0.578	57%	0.568	S	S	*	*	H	α-helix	trans	-63.1	-42.4	175.5	-171	179.7	176.3	-174.9	0	111.9	R22 E23 E29 E30	R22-K26 WeakPolarHBondContact O-CB 3.37Å; R22-K26 PolarHBondContact O-N 2.93Å; E23-K26 PolarHBondContact O-N 2.87Å; K26-E29 PolarHBondContact O-N 3.25Å; K26-E30 VanDerWaalsContact CE-OE1 3.27Å; K26-E30 WeakPolarHBondContact CE-OE1 3.37Å; K26-E30 PolarHBondContact O-N 2.96Å
27	R	87.3	Confident	85.4	Confident	163 Å²	163	122.9 Å²	122.9	62%	0.615	57%	0.565	S	S	*	*	H	α-helix	trans	-64.3	-43	177.7	-156.9	-171.1	101.2	-171.5	3.1	112.1	E23 E24 E29 E30 E31	E23-R27 WeakPolarHBondContact O-CB 3.49Å; E23-R27 PolarHBondContact O-N 2.96Å; E24-R27 PolarHBondContact O-N 2.96Å; R27-E29 VanDerWaalsContact C-N 3.33Å; R27-E29 PolarHBondContact O-N 2.95Å; R27-E30 PolarHBondContact O-N 3.47Å; R27-E31 IonicContact CZ-OE1 3.44Å; R27-E31 IonicContact NE-OE1 3.88Å; R27-E31 PolarHBondContact NE-OE1 3Å; R27-E31 IonicContact NH2-OE1 3.09Å; R27-E31 PolarHBondContact NH2-OE1 2.93Å; R27-E31 VanDerWaalsContact NH2-OE1 3.09Å; R27-E31 WeakPolarHBondContact O-CB 3.39Å; R27-E31 WeakPolarHBondContact O-CG 3.38Å; R27-E31 PolarHBondContact O-N 3.43Å
28	K	88.3	Confident	84.6	Confident	133 Å²	133	121.5 Å²	121.5	58%	0.578	56%	0.561	S	S	*	*	H	α-helix	trans	-62.8	-38.6	174.4	-91.8	-179.9	173.4	164.8	0	112.5	E24 K25 R32	E24-K28 PolarHBondContact O-N 3.05Å; E24-K28 IonicContact OE1-NZ 3.55Å; K25-K28 PolarHBondContact O-N 3.29Å; K28-R32 WeakPolarHBondContact O-CB 3.48Å; K28-R32 PolarHBondContact O-N 2.93Å
29	E	85.4	Confident	83.9	Confident	112 Å²	112	118.7 Å²	118.7	52%	0.523	55%	0.553	S	S	.	*	H	α-helix	trans	-70	-39.1	177.7	-173.4	162.4	-159.4	0	0	112.4	K25 K26 R27 R32 R33	K25-E29 WeakPolarHBondContact O-CB 3.45Å; K25-E29 PolarHBondContact O-N 3.41Å; K26-E29 PolarHBondContact O-N 3.25Å; R27-E29 VanDerWaalsContact C-N 3.33Å; R27-E29 PolarHBondContact O-N 2.95Å; E29-R32 PolarHBondContact O-N 2.85Å; E29-R33 WeakPolarHBondContact O-CB 3.44Å; E29-R33 PolarHBondContact O-N 3.4Å
30	E	87.4	Confident	82.5	Confident	96 Å²	96	119.3 Å²	119.3	45%	0.449	56%	0.555	S	S	.	*	H	α-helix	trans	-65.4	-41.2	172.3	-75.8	178.9	-170	0	0	112.3	K26 R27 R33 K34	K26-E30 VanDerWaalsContact CE-OE1 3.27Å; K26-E30 WeakPolarHBondContact CE-OE1 3.37Å; K26-E30 PolarHBondContact O-N 2.96Å; R27-E30 PolarHBondContact O-N 3.47Å; E30-R33 PolarHBondContact O-N 2.91Å; E30-K34 WeakPolarHBondContact O-CB 3.33Å; E30-K34 WeakPolarHBondContact O-CG 3.41Å; E30-K34 PolarHBondContact O-N 3.38Å
31	E	85.4	Confident	80.7	Confident	83 Å²	83	124.2 Å²	124.2	39%	0.388	57%	0.566	S	S	.	*	H	α-helix	trans	-61.5	-44.2	173.1	-77.1	173.2	-165.7	0	0	111.2	R27 K34 Q35	R27-E31 IonicContact CZ-OE1 3.44Å; R27-E31 IonicContact NE-OE1 3.88Å; R27-E31 PolarHBondContact NE-OE1 3Å; R27-E31 IonicContact NH2-OE1 3.09Å; R27-E31 PolarHBondContact NH2-OE1 2.93Å; R27-E31 VanDerWaalsContact NH2-OE1 3.09Å; R27-E31 WeakPolarHBondContact O-CB 3.39Å; R27-E31 WeakPolarHBondContact O-CG 3.38Å; R27-E31 PolarHBondContact O-N 3.43Å; E31-K34 PolarHBondContact O-N 3.36Å; E31-Q35 WeakPolarHBondContact O-CG 3.29Å; E31-Q35 PolarHBondContact O-N 2.94Å
32	R	83.3	Confident	78.9	Confident	152 Å²	152	125.9 Å²	125.9	57%	0.574	58%	0.576	S	S	*	*	H	α-helix	trans	-64.5	-40.3	175.8	-169.4	-177.9	71.1	156.2	-0.5	112	K28 E29 Q35 N36	K28-R32 WeakPolarHBondContact O-CB 3.48Å; K28-R32 PolarHBondContact O-N 2.93Å; E29-R32 PolarHBondContact O-N 2.85Å; R32-Q35 PolarHBondContact O-N 3.42Å; R32-N36 WeakPolarHBondContact O-CB 3.47Å; R32-N36 PolarHBondContact O-N 3.44Å
33	R	81.9	Confident	77.1	Confident	188 Å²	188	122 Å²	122	71%	0.709	57%	0.57	S	S	*	*	H	α-helix	trans	-65.4	-40.8	177.2	-174.3	177	162.2	-176.2	-4.4	111.1	E29 E30 N36 T37	E29-R33 WeakPolarHBondContact O-CB 3.44Å; E29-R33 PolarHBondContact O-N 3.4Å; E30-R33 PolarHBondContact O-N 2.91Å; R33-N36 PolarHBondContact O-N 3.36Å; R33-T37 PolarHBondContact O-N 3.02Å; R33-T37 PolarHBondContact O-OG1 2.95Å
34	K	82.5	Confident	74.8	Confident	131 Å²	131	120.8 Å²	120.8	57%	0.57	57%	0.569	S	S	*	*	H	α-helix	trans	-63	-46.4	174.2	-76.5	-179.5	-179.1	-179.7	0	112.1	E30 E31 N36 T37 E38	E30-K34 WeakPolarHBondContact O-CB 3.33Å; E30-K34 WeakPolarHBondContact O-CG 3.41Å; E30-K34 PolarHBondContact O-N 3.38Å; E31-K34 PolarHBondContact O-N 3.36Å; K34-N36 VanDerWaalsContact C-N 3.32Å; K34-N36 PolarHBondContact O-N 2.95Å; K34-T37 VanDerWaalsContact CA-OG1 3.29Å; K34-T37 WeakPolarHBondContact CA-OG1 3.27Å; K34-T37 PolarHBondContact O-N 2.81Å; K34-T37 PolarHBondContact O-OG1 2.86Å; K34-E38 WeakPolarHBondContact O-CB 3.48Å; K34-E38 WeakPolarHBondContact O-CG 3.47Å; K34-E38 PolarHBondContact O-N 3.47Å
35	Q	78.6	Confident	72.6	Confident	127 Å²	127	121 Å²	121	59%	0.593	58%	0.577	S	S	*	*	H	α-helix	trans	-60.2	-40.9	175.4	-75	177.2	0.9	0	0	112.1	E31 R32 E38 A39	E31-Q35 WeakPolarHBondContact O-CG 3.29Å; E31-Q35 PolarHBondContact O-N 2.94Å; R32-Q35 PolarHBondContact O-N 3.42Å; Q35-E38 PolarHBondContact O-N 3.45Å; Q35-A39 VanDerWaalsContact O-CB 3.23Å; Q35-A39 WeakPolarHBondContact O-CB 3.49Å; Q35-A39 PolarHBondContact O-N 3.2Å
36	N	74.5	Confident	70.1	Confident	101 Å²	101	122.2 Å²	122.2	54%	0.54	59%	0.586	S	S	.	*	H	α-helix	trans	-66.7	-39.8	175.7	-77	2	0	0	0	112.2	R32 R33 K34 A39 S40	R32-N36 WeakPolarHBondContact O-CB 3.47Å; R32-N36 PolarHBondContact O-N 3.44Å; R33-N36 PolarHBondContact O-N 3.36Å; K34-N36 VanDerWaalsContact C-N 3.32Å; K34-N36 PolarHBondContact O-N 2.95Å; N36-A39 PolarHBondContact O-N 3.43Å; N36-S40 PolarHBondContact O-N 2.99Å; N36-S40 PolarHBondContact O-OG 3.41Å
37	T	73.2	Confident	67.6	Low	75 Å²	75	120 Å²	120	46%	0.46	59%	0.587	S	S	.	*	H	α-helix	trans	-68.3	-37.2	175.3	42.7	0	0	0	0	112.8	R33 K34 S40 F41	R33-T37 PolarHBondContact O-N 3.02Å; R33-T37 PolarHBondContact O-OG1 2.95Å; K34-T37 VanDerWaalsContact CA-OG1 3.29Å; K34-T37 WeakPolarHBondContact CA-OG1 3.27Å; K34-T37 PolarHBondContact O-N 2.81Å; K34-T37 PolarHBondContact O-OG1 2.86Å; T37-S40 PolarHBondContact O-N 3.21Å; T37-F41 WeakPolarHBondContact O-CB 3.47Å; T37-F41 PolarHBondContact O-N 3.4Å
38	E	71.3	Confident	65.1	Low	122 Å²	122	116.4 Å²	116.4	57%	0.57	60%	0.6	S	S	*	*	H	α-helix	trans	-70	-36.4	175.6	-73.1	173.7	-173	0	0	111.6	K34 Q35 F41 N42	K34-E38 WeakPolarHBondContact O-CB 3.48Å; K34-E38 WeakPolarHBondContact O-CG 3.47Å; K34-E38 PolarHBondContact O-N 3.47Å; Q35-E38 PolarHBondContact O-N 3.45Å; E38-F41 PolarHBondContact O-N 3.36Å; E38-N42 WeakPolarHBondContact O-CB 3.23Å; E38-N42 PolarHBondContact O-N 2.85Å
39	A	69.1	Low	62.8	Low	49 Å²	49	110.9 Å²	110.9	41%	0.405	58%	0.581	S	S	.	*	H	α-helix	trans	-67.5	-37.9	173.2	0	0	0	0	0	112.2	Q35 N36 N43	Q35-A39 VanDerWaalsContact O-CB 3.23Å; Q35-A39 WeakPolarHBondContact O-CB 3.49Å; Q35-A39 PolarHBondContact O-N 3.2Å; N36-A39 PolarHBondContact O-N 3.43Å; A39-N43 WeakPolarHBondContact O-CB 3.45Å; A39-N43 PolarHBondContact O-N 3.45Å; A39-N43 PolarHBondContact O-ND2 2.92Å
40	S	60.1	Low	60.8	Low	69 Å²	69	110.8 Å²	110.8	48%	0.483	59%	0.593	S	S	.	*	H	α-helix	trans	-66.5	-43.7	171.7	-75	0	0	0	0	111.9	N36 T37 N42 N43 D44	N36-S40 PolarHBondContact O-N 2.99Å; N36-S40 PolarHBondContact O-OG 3.41Å; T37-S40 PolarHBondContact O-N 3.21Å; S40-N42 PolarHBondContact O-N 2.94Å; S40-N43 PolarHBondContact O-N 3.13Å; S40-D44 PolarHBondContact O-N 3.22Å; S40-D44 VanDerWaalsContact O-N 3.13Å
41	F	52.2	Low	58.9	Low	157 Å²	157	115.8 Å²	115.8	69%	0.689	61%	0.607	S	S	*	*	H	α-helix	trans	-66.5	-33.2	179.4	-113.8	-89.1	0	0	0	113.8	T37 E38	T37-F41 WeakPolarHBondContact O-CB 3.47Å; T37-F41 PolarHBondContact O-N 3.4Å; E38-F41 PolarHBondContact O-N 3.36Å
42	N	50.3	Low	57.5	Low	126 Å²	126	116.5 Å²	116.5	67%	0.674	61%	0.614	S	S	*	*	H	α-helix	trans	-78.1	-21.9	175.9	-78.2	-22.5	0	0	0	113.2	E38 S40	E38-N42 WeakPolarHBondContact O-CB 3.23Å; E38-N42 PolarHBondContact O-N 2.85Å; S40-N42 PolarHBondContact O-N 2.94Å
43	N	47.8	Very low	56.5	Low	120 Å²	120	115.4 Å²	115.4	64%	0.642	62%	0.619	S	S	*	*	H	α-helix	trans	-83.1	-19.1	173.2	-76.1	-15.3	0	0	0	112.9	A39 S40	A39-N43 WeakPolarHBondContact O-CB 3.45Å; A39-N43 PolarHBondContact O-N 3.45Å; A39-N43 PolarHBondContact O-ND2 2.92Å; S40-N43 PolarHBondContact O-N 3.13Å
44	D	43.4	Very low	55.8	Low	125 Å²	125	114.7 Å²	114.7	67%	0.668	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-2	179.6	-73.6	-31.2	0	0	0	114.2	S40	S40-D44 PolarHBondContact O-N 3.22Å; S40-D44 VanDerWaalsContact O-N 3.13Å
45	V	43.4	Very low	55	Low	120 Å²	120	114 Å²	114	73%	0.727	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-4	176.1	-177.1	0	0	0	0	112.8
46	E	37	Very low	54.7	Low	185 Å²	185	113.8 Å²	113.8	86%	0.864	61%	0.614	S	S	*	*	S	Bend	trans	-126.3	60.9	171.7	-71.9	-171.6	162.1	0	0	111.2
47	S	36.5	Very low	54.5	Low	87 Å²	87	111.2 Å²	111.2	61%	0.608	61%	0.607	S	S	*	*			trans	-134.7	85.3	176.3	-175.2	0	0	0	0	113.3	G49	S47-G49 PolarHBondContact O-N 3.45Å; S47-G49 PolarHBondContact OG-N 2.82Å
48	G	34.7	Very low	54.4	Low	86 Å²	86	110 Å²	110	89%	0.887	60%	0.598	S	S	*	*			trans	-82.8	39.3	145.4	0	0	0	0	0	111.5
49	G	39.9	Very low	54.6	Low	17 Å²	17	111 Å²	111	18%	0.175	60%	0.6	C	S	.	*			trans	-100	1.5	-156.7	0	0	0	0	0	118	S47 R51 N52	S47-G49 PolarHBondContact O-N 3.45Å; S47-G49 PolarHBondContact OG-N 2.82Å; G49-R51 PolarHBondContact O-N 3.32Å; G49-R51 VanDerWaalsContact O-N 3.09Å; G49-N52 PolarHBondContact O-N 3.09Å; G49-N52 VanDerWaalsContact O-N 3.12Å
50	S	44.3	Very low	55.1	Low	111 Å²	111	113.4 Å²	113.4	78%	0.776	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-12.2	-175.9	70.4	0	0	0	0	114.7
51	R	47.7	Very low	55.5	Low	200 Å²	200	113.4 Å²	113.4	76%	0.755	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-24.3	173.6	-76.6	-178.6	171.4	162.1	-2.3	113.9	G49 E55	G49-R51 PolarHBondContact O-N 3.32Å; G49-R51 VanDerWaalsContact O-N 3.09Å; R51-E55 PolarHBondContact O-N 3.18Å
52	N	55.8	Low	56.6	Low	98 Å²	98	110.4 Å²	110.4	52%	0.524	59%	0.594	S	S	.	*	H	α-helix	trans	-81.7	-33.6	-172.2	-65.9	-11.3	0	0	0	113	G49 R54 E55 E56	G49-N52 PolarHBondContact O-N 3.09Å; G49-N52 VanDerWaalsContact O-N 3.12Å; N52-R54 VanDerWaalsContact C-N 3.3Å; N52-R54 PolarHBondContact O-N 3.12Å; N52-E55 PolarHBondContact O-N 3Å; N52-E56 PolarHBondContact O-N 3.18Å
53	L	63.1	Low	57.9	Low	129 Å²	129	112.8 Å²	112.8	68%	0.675	60%	0.601	S	S	*	*	H	α-helix	trans	-65.9	-32.3	176.9	-77.9	152.1	0	0	0	112.6	A57	L53-A57 WeakPolarHBondContact O-CB 3.29Å; L53-A57 PolarHBondContact O-N 2.95Å
54	R	65.5	Low	59	Low	173 Å²	173	113 Å²	113	65%	0.653	60%	0.601	S	S	*	*	H	α-helix	trans	-74.4	-39.7	176.5	-168.8	167.1	179.5	160.6	-1.9	111.5	N52 A57 D58	N52-R54 VanDerWaalsContact C-N 3.3Å; N52-R54 PolarHBondContact O-N 3.12Å; R54-A57 PolarHBondContact O-N 3.37Å; R54-D58 WeakPolarHBondContact O-CB 3.44Å; R54-D58 VanDerWaalsContact O-CG 3.24Å; R54-D58 PolarHBondContact O-N 3.18Å
55	E	67.8	Low	60.1	Low	116 Å²	116	110.4 Å²	110.4	54%	0.542	60%	0.604	S	S	.	*	H	α-helix	trans	-68.7	-33.1	175	-72.8	-178.5	-176.8	0	0	113.2	R51 N52 K59	R51-E55 PolarHBondContact O-N 3.18Å; N52-E55 PolarHBondContact O-N 3Å; E55-K59 WeakPolarHBondContact O-CB 3.5Å; E55-K59 WeakPolarHBondContact O-CG 3.12Å; E55-K59 PolarHBondContact O-N 3.46Å
56	E	72.2	Confident	60.8	Low	124 Å²	124	109.6 Å²	109.6	58%	0.579	60%	0.595	S	S	*	*	H	α-helix	trans	-69.7	-42.5	171.2	-83.7	-172.1	151.3	0	0	112.1	N52 K59 I60	N52-E56 PolarHBondContact O-N 3.18Å; E56-K59 PolarHBondContact O-N 3.37Å; E56-I60 VanDerWaalsContact O-CG1 3.29Å; E56-I60 WeakPolarHBondContact O-CG1 3.41Å; E56-I60 PolarHBondContact O-N 3.44Å
57	A	68.4	Low	61.9	Low	46 Å²	46	104.8 Å²	104.8	38%	0.38	59%	0.587	S	S	.	*	H	α-helix	trans	-62.8	-41.8	174.5	0	0	0	0	0	112	L53 R54 I60 L61	L53-A57 WeakPolarHBondContact O-CB 3.29Å; L53-A57 PolarHBondContact O-N 2.95Å; R54-A57 PolarHBondContact O-N 3.37Å; A57-I60 PolarHBondContact O-N 2.91Å; A57-L61 WeakPolarHBondContact O-CB 3.39Å; A57-L61 VanDerWaalsContact O-CG 3.29Å; A57-L61 WeakPolarHBondContact O-CG 3.26Å; A57-L61 PolarHBondContact O-N 3.45Å
58	D	71.3	Confident	62.3	Low	51 Å²	51	104 Å²	104	27%	0.273	58%	0.579	S	S	.	*	H	α-helix	trans	-68.7	-33.1	177.4	-73.3	-24.5	0	0	0	111.9	R54 T62	R54-D58 WeakPolarHBondContact O-CB 3.44Å; R54-D58 VanDerWaalsContact O-CG 3.24Å; R54-D58 PolarHBondContact O-N 3.18Å; D58-T62 WeakPolarHBondContact O-CB 3.44Å; D58-T62 PolarHBondContact O-N 3.39Å; D58-T62 PolarHBondContact O-OG1 3.45Å
59	K	77.3	Confident	62.8	Low	143 Å²	143	107 Å²	107	62%	0.622	58%	0.58	S	S	*	*	H	α-helix	trans	-67	-42.4	172.1	-85	175.2	179.4	172.8	0	112.8	E55 E56 L61 T62 E63	E55-K59 WeakPolarHBondContact O-CB 3.5Å; E55-K59 WeakPolarHBondContact O-CG 3.12Å; E55-K59 PolarHBondContact O-N 3.46Å; E56-K59 PolarHBondContact O-N 3.37Å; K59-L61 VanDerWaalsContact C-N 3.35Å; K59-T62 PolarHBondContact O-N 3.11Å; K59-E63 PolarHBondContact O-N 3.27Å
60	I	78	Confident	62.9	Low	99 Å²	99	110.6 Å²	110.6	51%	0.508	60%	0.603	S	S	.	*	H	α-helix	trans	-65.1	-40.6	177.4	-67	164.6	0	0	0	110.6	E56 A57 T62 E63 L64	E56-I60 VanDerWaalsContact O-CG1 3.29Å; E56-I60 WeakPolarHBondContact O-CG1 3.41Å; E56-I60 PolarHBondContact O-N 3.44Å; A57-I60 PolarHBondContact O-N 2.91Å; I60-T62 VanDerWaalsContact C-N 3.33Å; I60-T62 PolarHBondContact O-N 2.9Å; I60-E63 PolarHBondContact O-N 2.98Å; I60-L64 HydrophobicContact CG2-CD1 4Å; I60-L64 WeakPolarHBondContact O-CD1 3.35Å; I60-L64 PolarHBondContact O-N 3.47Å; I60-L64 VanDerWaalsContact O-N 3.13Å
61	L	69.5	Low	62.6	Low	68 Å²	68	113.2 Å²	113.2	36%	0.356	61%	0.608	S	S	.	*	H	α-helix	trans	-67.9	-33	175.7	-70.4	169	0	0	0	112.4	A57 K59 L64 G65 I66	A57-L61 WeakPolarHBondContact O-CB 3.39Å; A57-L61 VanDerWaalsContact O-CG 3.29Å; A57-L61 WeakPolarHBondContact O-CG 3.26Å; A57-L61 PolarHBondContact O-N 3.45Å; K59-L61 VanDerWaalsContact C-N 3.35Å; L61-L64 CarbonylContact O-C 3.57Å; L61-L64 PolarHBondContact O-N 3.21Å; L61-G65 PolarHBondContact O-N 2.9Å; L61-I66 CarbonylContact C-O 3.54Å; L61-I66 PolarHBondContact O-N 2.95Å
62	T	75.5	Confident	62	Low	95 Å²	95	107.5 Å²	107.5	58%	0.583	61%	0.612	S	S	*	*	H	α-helix	trans	-69.8	-38.4	174.4	-54.4	0	0	0	0	112.1	D58 K59 I60 L64 G65	D58-T62 WeakPolarHBondContact O-CB 3.44Å; D58-T62 PolarHBondContact O-N 3.39Å; D58-T62 PolarHBondContact O-OG1 3.45Å; K59-T62 PolarHBondContact O-N 3.11Å; I60-T62 VanDerWaalsContact C-N 3.33Å; I60-T62 PolarHBondContact O-N 2.9Å; T62-L64 PolarHBondContact O-N 2.93Å; T62-G65 PolarHBondContact O-N 3.26Å
63	E	77.5	Confident	61.1	Low	176 Å²	176	110.9 Å²	110.9	82%	0.822	63%	0.629	S	S	*	*	H	α-helix	trans	-65.1	-28.5	171.8	-81.1	-174.8	160.3	0	0	112.8	K59 I60	K59-E63 PolarHBondContact O-N 3.27Å; I60-E63 PolarHBondContact O-N 2.98Å
64	L	71	Confident	59.7	Low	123 Å²	123	109.7 Å²	109.7	64%	0.644	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	4.8	176.2	-74.6	159.2	0	0	0	113.9	I60 L61 T62	I60-L64 HydrophobicContact CG2-CD1 4Å; I60-L64 WeakPolarHBondContact O-CD1 3.35Å; I60-L64 PolarHBondContact O-N 3.47Å; I60-L64 VanDerWaalsContact O-N 3.13Å; L61-L64 CarbonylContact O-C 3.57Å; L61-L64 PolarHBondContact O-N 3.21Å; T62-L64 PolarHBondContact O-N 2.93Å
65	G	65.8	Low	58	Low	71 Å²	71	109.1 Å²	109.1	73%	0.732	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.8	19.7	174.5	0	0	0	0	0	115.2	L61 T62	L61-G65 PolarHBondContact O-N 2.9Å; T62-G65 PolarHBondContact O-N 3.26Å
66	I	59.1	Low	56.4	Low	104 Å²	104	109.2 Å²	109.2	53%	0.533	65%	0.651	S	S	.	*			trans	-113.3	105.2	-177.9	-55.6	172.2	0	0	0	108.3	L61	L61-I66 CarbonylContact C-O 3.54Å; L61-I66 PolarHBondContact O-N 2.95Å
67	A	58.7	Low	54.4	Low	84 Å²	84	108.5 Å²	108.5	69%	0.694	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-75.9	131.2	179	0	0	0	0	0	111.5
68	P	46.2	Very low	52.9	Low	70 Å²	70	112 Å²	112	46%	0.455	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-79.3	125	177.5	29.7	-30.2	0	0	0	110.9
69	V	44.7	Very low	50.9	Low	148 Å²	148	113.6 Å²	113.6	90%	0.897	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-89.8	119.7	178.4	178.2	0	0	0	0	109
70	S	42.9	Very low	48.7	Very low	93 Å²	93	114 Å²	114	65%	0.65	71%	0.708	S	S	*	*			trans	-118.3	118	171.2	55.6	0	0	0	0	112.2
71	D	36.5	Very low	46.6	Very low	166 Å²	166	118.2 Å²	118.2	89%	0.888	73%	0.726	S	S	*	*			trans	64.3	119.1	146.9	-60.6	-25	0	0	0	122.5
72	G	36.2	Very low	44.7	Very low	81 Å²	81	119.5 Å²	119.5	84%	0.835	74%	0.74	S	S	*	*			trans	156.1	84.6	159.1	0	0	0	0	0	116.5
73	L	36.3	Very low	42.5	Very low	169 Å²	169	122 Å²	122	89%	0.885	75%	0.749	S	S	*	*			trans	-34.5	175.2	166	-69.5	158.7	0	0	0	117.6
74	P	33.7	Very low	40.3	Very low	104 Å²	104	117.8 Å²	117.8	68%	0.675	74%	0.738	S	S	*	*			cis	-138.8	-179.1	-36.2	37	-18.1	0	0	0	114.1
75	L	29.3	Very low	38.3	Very low	160 Å²	160	120.6 Å²	120.6	84%	0.838	75%	0.745	S	S	*	*			trans	78.6	102.8	144.1	-143.1	79.5	0	0	0	119.6
76	S	34.1	Very low	36.8	Very low	118 Å²	118	124.5 Å²	124.5	83%	0.825	75%	0.749	S	S	*	*				157.3	117.4	120.1	51.7	0	0	0	0	112.6
77	S	31.7	Very low	35.5	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	76%	0.757	S	S	*	*			trans	-74.4	155.7	157.9	54.6	0	0	0	0	109.7
78	P	35.6	Very low	34.4	Very low	121 Å²	121	126.6 Å²	126.6	79%	0.786	76%	0.762	S	S	*	*				-144.3	147.3	76	22.9	1.8	0	0	0	113.6
79	A	29.5	Very low	33.9	Very low	84 Å²	84	131 Å²	131	69%	0.694	78%	0.781	S	S	*	*				66.6	125.6	91.5	0	0	0	0	0	116
80	D	30.4	Very low	33.5	Very low	152 Å²	152	127 Å²	127	81%	0.813	77%	0.77	S	S	*	*			trans	57.9	118.8	151.6	-59.5	-29.8	0	0	0	120.4
81	E	34.1	Very low	33	Very low	187 Å²	187	127.8 Å²	127.8	87%	0.874	78%	0.775	S	S	*	*				-177.6	139.9	99.2	-98	-174.9	166.9	0	0	112.8
82	S	29.1	Very low	32.9	Very low	94 Å²	94	127.6 Å²	127.6	66%	0.657	77%	0.769	S	S	*	*			trans	-51	156.2	167	51	0	0	0	0	115.5
83	I	30.8	Very low	32.8	Very low	148 Å²	148	129.2 Å²	129.2	76%	0.759	76%	0.763	S	S	*	*				155.1	106.2	125.4	-78.6	158.8	0	0	0	112.1
84	S	30.3	Very low	32.9	Very low	87 Å²	87	128.2 Å²	128.2	61%	0.608	76%	0.764	S	S	*	*				60.3	135.2	124.2	100.8	0	0	0	0	123.9
85	K	28.8	Very low	32.9	Very low	182 Å²	182	127.5 Å²	127.5	79%	0.791	77%	0.767	S	S	*	*			trans	80.4	119.4	137.4	-72.5	171.8	-179.2	179.4	0	119.6
86	N	34.3	Very low	33.2	Very low	153 Å²	153	132.2 Å²	132.2	82%	0.818	77%	0.773	S	S	*	*				174.8	116	113.6	-77.5	-26.5	0	0	0	107
87	A	32.4	Very low	33.1	Very low	85 Å²	85	133.6 Å²	133.6	70%	0.702	77%	0.771	S	S	*	*				66.1	112.3	68.3	0	0	0	0	0	113.8
88	D	36	Very low	33.5	Very low	148 Å²	148	135 Å²	135	79%	0.791	78%	0.776	S	S	*	*			trans	153.5	146.2	145.9	-87.3	1	0	0	0	110.4
89	L	34.6	Very low	33.5	Very low	162 Å²	162	134.8 Å²	134.8	85%	0.848	78%	0.777	S	S	*	*			cis	176.9	148.2	-20.2	-118.9	164.7	0	0	0	105.7
90	G	36.2	Very low	33.6	Very low	65 Å²	65	139.1 Å²	139.1	67%	0.67	79%	0.788	S	S	*	*			trans	118.3	101.9	159.8	0	0	0	0	0	115.7
91	S	33.3	Very low	34	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	79%	0.791	S	S	*	*				63.6	125.8	72.6	-177.5	0	0	0	0	111.8
92	E	35.4	Very low	33.9	Very low	163 Å²	163	134 Å²	134	76%	0.762	78%	0.784	S	S	*	*			cis	-170.6	143.6	35.5	-134	166.3	-166.3	0	0	111.1
93	T	33.5	Very low	34.2	Very low	115 Å²	115	135.4 Å²	135.4	71%	0.706	79%	0.79	S	S	*	*			trans	36.4	132.2	141.4	55.7	0	0	0	0	124.1
94	T	37.2	Very low	34.7	Very low	148 Å²	148	134.4 Å²	134.4	91%	0.908	79%	0.791	S	S	*	*				-174.5	141	106.3	26.7	0	0	0	0	112.6
95	A	34	Very low	34.8	Very low	89 Å²	89	138.1 Å²	138.1	74%	0.736	80%	0.804	S	S	*	*			trans	-88.1	159.6	-169.4	0	0	0	0	0	114.5
96	R	35.9	Very low	35.6	Very low	258 Å²	258	136.3 Å²	136.3	97%	0.974	80%	0.802	S	S	*	*			trans	-159.5	126.2	138	-107.9	169.2	-169.5	-169.4	3.2	112.5
97	N	32.9	Very low	35.7	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	80%	0.8	S	S	*	*			trans	-65.6	154.8	-179.2	-63.9	-35.4	0	0	0	114.1
98	T	38.4	Very low	35.9	Very low	139 Å²	139	140.4 Å²	140.4	85%	0.853	81%	0.808	S	S	*	*				-166.2	133.3	120.8	22.4	0	0	0	0	114.5
99	S	37.3	Very low	36.3	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	81%	0.812	S	S	*	*			trans	67.4	108.3	153.4	68.2	0	0	0	0	122.2
100	L	31.6	Very low	36.4	Very low	175 Å²	175	142.5 Å²	142.5	92%	0.916	81%	0.81	S	S	*	*			trans	-66.2	138.6	166.4	-66.9	116.6	0	0	0	113.6
101	V	37.8	Very low	37	Very low	145 Å²	145	145.5 Å²	145.5	88%	0.879	82%	0.815	S	S	*	*			trans	-134.4	126.4	148.3	178.9	0	0	0	0	107.4
102	A	32.3	Very low	37.4	Very low	87 Å²	87	149.4 Å²	149.4	72%	0.719	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-70.3	147.1	-169.4	0	0	0	0	0	113.8
103	P	36.1	Very low	37.7	Very low	122 Å²	122	149.4 Å²	149.4	79%	0.792	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.9	124.9	165.3	32.7	-26.2	0	0	0	109.4	D105	P103-D105 PolarHBondContact O-N 3.48Å
104	T	39.8	Very low	38.5	Very low	127 Å²	127	152.2 Å²	152.2	78%	0.779	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.6	120.4	169.9	45	0	0	0	0	110.3	I106	T104-I106 PolarHBondContact O-N 3.33Å
105	D	33.3	Very low	38.9	Very low	165 Å²	165	150.1 Å²	150.1	88%	0.882	83%	0.829	S	S	*	*			trans	-61.4	111.3	170.6	-79.7	-44.8	0	0	0	111.2	P103	P103-D105 PolarHBondContact O-N 3.48Å
106	I	45.5	Very low	39.4	Very low	145 Å²	145	151.6 Å²	151.6	74%	0.744	83%	0.828	S	S	*	*			trans	-92.7	124.4	165.4	-58.9	170.8	0	0	0	106.9	T104 K108	T104-I106 PolarHBondContact O-N 3.33Å; I106-K108 PolarHBondContact O-N 3.46Å
107	P	36.9	Very low	40.2	Very low	119 Å²	119	147.9 Å²	147.9	77%	0.773	82%	0.822	S	S	*	*			trans	-70.3	118.8	-175.7	29.1	-32	0	0	0	109.3	R109	P107-R109 PolarHBondContact O-N 3.41Å; P107-R109 VanDerWaalsContact O-N 3.12Å
108	K	36.9	Very low	41.1	Very low	204 Å²	204	146.1 Å²	146.1	89%	0.887	82%	0.819	S	S	*	*			trans	-60.7	112.8	169.3	-72.7	-179.5	178.1	178.3	0	108.4	I106	I106-K108 PolarHBondContact O-N 3.46Å
109	R	43.7	Very low	41.7	Very low	231 Å²	231	145.7 Å²	145.7	87%	0.872	82%	0.816	S	S	*	*			trans	-55.7	137.4	167.1	-105.2	-179.6	175.3	176.9	-2.1	109	P107 V111	P107-R109 PolarHBondContact O-N 3.41Å; P107-R109 VanDerWaalsContact O-N 3.12Å; R109-V111 PolarHBondContact O-N 2.73Å
110	P	37.1	Very low	42.4	Very low	123 Å²	123	146.1 Å²	146.1	80%	0.799	81%	0.813	S	S	*	*			trans	-65.4	129.5	175.9	28.3	-31.5	0	0	0	108.8	E112	P110-E112 PolarHBondContact O-N 2.92Å
111	V	49.1	Very low	43.6	Very low	128 Å²	128	144.1 Å²	144.1	78%	0.776	80%	0.802	S	S	*	*			trans	-70.5	112.7	173.2	176.5	0	0	0	0	107.3	R109 L113	R109-V111 PolarHBondContact O-N 2.73Å; V111-L113 PolarHBondContact O-N 3.32Å
112	E	41.5	Very low	44.1	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	80%	0.795	S	S	*	*			trans	-80.3	104.8	174.2	-154.5	170.7	-159.1	0	0	107.9	P110 Q114	P110-E112 PolarHBondContact O-N 2.92Å; E112-Q114 PolarHBondContact O-N 3.49Å
113	L	40.7	Very low	45.4	Very low	163 Å²	163	145.1 Å²	145.1	85%	0.853	80%	0.797	S	S	*	*			trans	-73.2	106.8	176.7	-71.6	167.6	0	0	0	108.8	V111	V111-L113 PolarHBondContact O-N 3.32Å
114	Q	49.9	Very low	46.3	Very low	175 Å²	175	143.6 Å²	143.6	82%	0.818	79%	0.789	S	S	*	*			trans	-93.8	117.7	171.2	-164	173.9	6.6	0	0	109.2	E112 T116	E112-Q114 PolarHBondContact O-N 3.49Å; Q114-T116 PolarHBondContact O-N 3.26Å
115	A	47.2	Very low	46.9	Very low	104 Å²	104	143.5 Å²	143.5	86%	0.86	79%	0.791	S	S	*	*			trans	-72.7	106.3	172.2	0	0	0	0	0	109.2
116	T	44	Very low	47.9	Very low	119 Å²	119	147.2 Å²	147.2	73%	0.73	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.7	127.7	168.6	45.9	0	0	0	0	109.4	Q114	Q114-T116 PolarHBondContact O-N 3.26Å
117	E	51.7	Low	48.1	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-58.7	136.4	177.2	-67.8	-174.7	161.5	0	0	111	V119	E117-V119 PolarHBondContact O-N 2.94Å
118	P	51.6	Low	48.8	Very low	111 Å²	111	151.8 Å²	151.8	72%	0.721	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.7	118.8	178.3	28	-31.7	0	0	0	109.2	V120	P118-V120 VanDerWaalsContact C-N 3.32Å; P118-V120 PolarHBondContact O-N 2.94Å
119	V	51.7	Low	49.5	Very low	129 Å²	129	149 Å²	149	78%	0.782	79%	0.794	S	S	*	*			trans	-70.4	95.8	165.5	-177.5	0	0	0	0	107.1	E117 I121	E117-V119 PolarHBondContact O-N 2.94Å; V119-I121 HydrophobicContact CG1-CD1 4.42Å; V119-I121 HydrophobicContact CG1-CG1 3.85Å; V119-I121 PolarHBondContact O-N 3.48Å; V119-I121 VanDerWaalsContact O-N 3.1Å
120	V	52.5	Low	49.9	Very low	127 Å²	127	143.4 Å²	143.4	77%	0.77	79%	0.785	S	S	*	*			trans	-75	97.3	173.6	-179.2	0	0	0	0	108	P118 S122	P118-V120 VanDerWaalsContact C-N 3.32Å; P118-V120 PolarHBondContact O-N 2.94Å; V120-S122 PolarHBondContact O-N 2.93Å
121	I	56.3	Low	50.6	Low	132 Å²	132	146.1 Å²	146.1	68%	0.677	78%	0.781	S	S	*	*			trans	-85.2	100.9	170	-54.6	176	0	0	0	107.2	V119 I123	V119-I121 HydrophobicContact CG1-CD1 4.42Å; V119-I121 HydrophobicContact CG1-CG1 3.85Å; V119-I121 PolarHBondContact O-N 3.48Å; V119-I121 VanDerWaalsContact O-N 3.1Å; I121-I123 HydrophobicContact CG2-CG1 4.13Å; I121-I123 PolarHBondContact O-N 3.15Å; I121-I123 VanDerWaalsContact O-N 3.14Å
122	S	49.3	Very low	50.7	Low	105 Å²	105	145 Å²	145	73%	0.734	78%	0.778	S	S	*	*			trans	-73.4	98.7	168.9	177.5	0	0	0	0	108.9	V120 S124	V120-S122 PolarHBondContact O-N 2.93Å; S122-S124 PolarHBondContact O-N 3.01Å
123	I	58.1	Low	51.1	Low	148 Å²	148	143.8 Å²	143.8	76%	0.759	77%	0.769	S	S	*	*			trans	-78.5	109.6	170.6	-55.1	172.7	0	0	0	106.6	I121	I121-I123 HydrophobicContact CG2-CG1 4.13Å; I121-I123 PolarHBondContact O-N 3.15Å; I121-I123 VanDerWaalsContact O-N 3.14Å
124	S	56.4	Low	51.4	Low	91 Å²	91	141 Å²	141	64%	0.636	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-58.2	132.8	173.5	-41	0	0	0	0	109.2	S122 R126	S122-S124 PolarHBondContact O-N 3.01Å; S124-R126 PolarHBondContact O-N 3.31Å
125	P	52.2	Low	51.1	Low	124 Å²	124	138.4 Å²	138.4	81%	0.805	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-59.7	127	178.8	23.2	-30.9	0	0	0	109.1	Q127	P125-Q127 PolarHBondContact O-N 3.16Å
126	R	53.4	Low	50.8	Low	243 Å²	243	142 Å²	142	92%	0.917	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-57.8	123	172.9	-75.8	-175.6	173.3	-175.5	-1.9	108	S124 Q128	S124-R126 PolarHBondContact O-N 3.31Å; R126-Q128 PolarHBondContact O-N 3.01Å
127	Q	50.1	Low	50.8	Low	177 Å²	177	142.1 Å²	142.1	83%	0.827	76%	0.76	S	S	*	*			trans	-55.8	114.6	167.4	-87.7	178.2	-30.1	0	0	108.4	P125 I129	P125-Q127 PolarHBondContact O-N 3.16Å; Q127-I129 VanDerWaalsContact C-N 3.33Å; Q127-I129 HydrophobicContact CB-CG1 4.5Å; Q127-I129 PolarHBondContact O-N 2.72Å
128	Q	52.3	Low	50.5	Low	183 Å²	183	140.2 Å²	140.2	86%	0.855	75%	0.754	S	S	*	*			trans	-66.2	98.7	160.8	-92.9	178.6	-34.3	0	0	107	R126 T130	R126-Q128 PolarHBondContact O-N 3.01Å; Q128-T130 VanDerWaalsContact C-N 3.32Å; Q128-T130 PolarHBondContact O-N 2.85Å; Q128-T130 VanDerWaalsContact O-N 3.13Å
129	I	50.2	Low	49.6	Very low	146 Å²	146	139.4 Å²	139.4	75%	0.749	76%	0.756	S	S	*	*			trans	-78.4	92.7	166.5	-57.6	170.7	0	0	0	105.8	Q127 Y131	Q127-I129 VanDerWaalsContact C-N 3.33Å; Q127-I129 HydrophobicContact CB-CG1 4.5Å; Q127-I129 PolarHBondContact O-N 2.72Å; I129-Y131 PolarHBondContact O-N 2.93Å
130	T	52.5	Low	49	Very low	113 Å²	113	140.1 Å²	140.1	69%	0.693	76%	0.756	S	S	*	*			trans	-76	109.4	169.5	-44.3	0	0	0	0	107.6	Q128 C132	Q128-T130 VanDerWaalsContact C-N 3.32Å; Q128-T130 PolarHBondContact O-N 2.85Å; Q128-T130 VanDerWaalsContact O-N 3.13Å; T130-C132 PolarHBondContact O-N 2.71Å
131	Y	52.8	Low	48.2	Very low	181 Å²	181	142.3 Å²	142.3	71%	0.71	76%	0.757	S	S	*	*			trans	-79.3	107.3	173.2	-179.4	-105.5	0	0	0	109.2	I129 K133	I129-Y131 PolarHBondContact O-N 2.93Å; Y131-K133 HydrophobicContact CD1-CB 4.26Å; Y131-K133 HydrophobicContact CE1-CB 3.55Å; Y131-K133 HydrophobicContact CE1-CD 4.18Å; Y131-K133 HydrophobicContact CE1-CG 3.98Å
132	C	50.8	Low	47.1	Very low	105 Å²	105	143.1 Å²	143.1	71%	0.709	76%	0.763	S	S	*	*			trans	-96.2	104.8	167.6	-57.3	0	0	0	0	107.7	T130 S134	T130-C132 PolarHBondContact O-N 2.71Å; C132-S134 PolarHBondContact O-N 3.17Å; C132-S134 VanDerWaalsContact O-N 3.14Å
133	K	48.9	Very low	46.2	Very low	163 Å²	163	145.3 Å²	145.3	71%	0.709	76%	0.762	S	S	*	*			trans	-75.1	99.3	171.8	-162.7	174.8	-178.4	-178.9	0	108.7	Y131	Y131-K133 HydrophobicContact CD1-CB 4.26Å; Y131-K133 HydrophobicContact CE1-CB 3.55Å; Y131-K133 HydrophobicContact CE1-CD 4.18Å; Y131-K133 HydrophobicContact CE1-CG 3.98Å
134	S	47	Very low	45.1	Very low	105 Å²	105	146.4 Å²	146.4	73%	0.734	76%	0.761	S	S	*	*			trans	-83.8	120.1	160.7	46.7	0	0	0	0	108.3	C132 Q136	C132-S134 PolarHBondContact O-N 3.17Å; C132-S134 VanDerWaalsContact O-N 3.14Å; S134-Q136 PolarHBondContact O-N 2.74Å
135	T	44.2	Very low	43.9	Very low	120 Å²	120	150.3 Å²	150.3	74%	0.736	77%	0.769	S	S	*	*			trans	-64.6	105.1	173.6	-52.5	0	0	0	0	108.6	T137	T135-T137 HydrophobicContact CG2-CG2 4.45Å; T135-T137 PolarHBondContact O-N 2.89Å
136	Q	41.1	Very low	43.1	Very low	179 Å²	179	152.4 Å²	152.4	84%	0.836	77%	0.773	S	S	*	*			trans	-89.7	91.7	175.1	-161.3	173.5	32.3	0	0	108.2	S134 I138	S134-Q136 PolarHBondContact O-N 2.74Å; Q136-I138 PolarHBondContact O-N 3.35Å
137	T	44.5	Very low	41.9	Very low	122 Å²	122	147.6 Å²	147.6	75%	0.748	77%	0.77	S	S	*	*			trans	-76.4	114	166.5	38.8	0	0	0	0	108.8	T135 A139	T135-T137 HydrophobicContact CG2-CG2 4.45Å; T135-T137 PolarHBondContact O-N 2.89Å; T137-A139 PolarHBondContact O-N 2.97Å
138	I	43.9	Very low	41	Very low	140 Å²	140	143.5 Å²	143.5	72%	0.718	77%	0.767	S	S	*	*			trans	-65.4	117.3	169.2	-63.4	164.6	0	0	0	107	Q136 D140	Q136-I138 PolarHBondContact O-N 3.35Å; I138-D140 PolarHBondContact O-N 3.42Å
139	A	33.5	Very low	39.9	Very low	94 Å²	94	142.9 Å²	142.9	78%	0.777	77%	0.766	S	S	*	*			trans	-80	94.3	170.8	0	0	0	0	0	108.1	T137	T137-A139 PolarHBondContact O-N 2.97Å
140	D	39.1	Very low	39.1	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	76%	0.757	S	S	*	*			trans	-109.9	122.6	164.7	-94.5	-28.5	0	0	0	110.5	I138 N142	I138-D140 PolarHBondContact O-N 3.42Å; D140-N142 PolarHBondContact O-N 3.08Å
141	H	35.8	Very low	37.9	Very low	174 Å²	174	145 Å²	145	81%	0.806	77%	0.767	S	S	*	*			trans	-53.9	121	170	-76.8	-88	0	0	0	111
142	N	33.7	Very low	37.1	Very low	149 Å²	149	144.8 Å²	144.8	80%	0.797	77%	0.766	S	S	*	*				175	119.5	116.1	-88.9	-30	0	0	0	111.5	D140	D140-N142 PolarHBondContact O-N 3.08Å
143	E	30.9	Very low	36.2	Very low	150 Å²	150	149.1 Å²	149.1	70%	0.701	78%	0.776	S	S	*	*			trans	9.6	126.7	146.7	-63.4	-169.4	-178.3	0	0	120.5
144	K	33.3	Very low	35.7	Very low	171 Å²	171	152.5 Å²	152.5	74%	0.743	78%	0.784	S	S	*	*			trans	94.6	128.4	140.2	-71.9	162	-179.1	137.2	0	118.1
145	E	32.6	Very low	35.4	Very low	174 Å²	174	155.5 Å²	155.5	81%	0.813	79%	0.792	S	S	*	*			trans	78.8	91.4	159.1	-65.7	176.4	172.6	0	0	117.1
146	L	34	Very low	35	Very low	168 Å²	168	156.8 Å²	156.8	88%	0.88	80%	0.795	S	S	*	*				160.5	104	103.7	-95.2	129	0	0	0	110
147	T	28.7	Very low	35	Very low	141 Å²	141	157.3 Å²	157.3	87%	0.865	80%	0.797	S	S	*	*			trans	-87.7	139.3	170.8	-22.9	0	0	0	0	110.2
148	A	30.7	Very low	34.6	Very low	91 Å²	91	162 Å²	162	75%	0.752	81%	0.807	S	S	*	*			trans	77.5	109.1	146	0	0	0	0	0	119.5
149	M	29.3	Very low	34.2	Very low	171 Å²	171	159 Å²	159	84%	0.842	81%	0.811	S	S	*	*			trans	-169.6	137.1	137.3	-89.1	-173.1	33.7	0	0	105.8
150	H	32.8	Very low	34.2	Very low	121 Å²	121	158.7 Å²	158.7	56%	0.56	82%	0.817	S	S	*	*			cis	-166.3	130	-4.4	-118.8	-54.9	0	0	0	105.8	Y152	H150-Y152 HydrophobicContact CB-CD2 4.13Å; H150-Y152 HydrophobicContact CB-CE2 4.38Å; H150-Y152 AromaticContact CD2-CE2 3.8Å; H150-Y152 AromaticContact CE1-CD2 3.92Å; H150-Y152 AromaticContact CE1-CE2 2.96Å; H150-Y152 WeakPolarHBondContact CE1-CE2 3.38Å; H150-Y152 AromaticContact CE1-CZ 3.26Å; H150-Y152 PolarHBondContact CE1-OH 3.18Å; H150-Y152 AromaticContact CG-CD2 3.72Å; H150-Y152 AromaticContact CG-CE2 3.48Å; H150-Y152 VanDerWaalsContact CG-CE2 3.48Å; H150-Y152 AromaticContact ND1-CD2 3.38Å; H150-Y152 WeakPolarHBondContact ND1-CD2 3.32Å; H150-Y152 AromaticContact ND1-CE2 2.89Å; H150-Y152 WeakPolarHBondContact ND1-CE2 3.47Å; H150-Y152 AromaticContact ND1-CZ 3.45Å; H150-Y152 AromaticContact NE2-CE2 3.53Å
151	M	28.3	Very low	34	Very low	183 Å²	183	155.7 Å²	155.7	90%	0.901	82%	0.82	S	S	*	*			trans	-87	131.7	151.9	-81.3	-126.4	-60.1	0	0	107.2
152	Y	36.1	Very low	33.9	Very low	175 Å²	175	153.7 Å²	153.7	69%	0.686	82%	0.82	S	S	*	*			trans	-144.1	111.5	161.8	-82.6	-60.4	0	0	0	110.4	H150	H150-Y152 HydrophobicContact CB-CD2 4.13Å; H150-Y152 HydrophobicContact CB-CE2 4.38Å; H150-Y152 AromaticContact CD2-CE2 3.8Å; H150-Y152 AromaticContact CE1-CD2 3.92Å; H150-Y152 AromaticContact CE1-CE2 2.96Å; H150-Y152 WeakPolarHBondContact CE1-CE2 3.38Å; H150-Y152 AromaticContact CE1-CZ 3.26Å; H150-Y152 PolarHBondContact CE1-OH 3.18Å; H150-Y152 AromaticContact CG-CD2 3.72Å; H150-Y152 AromaticContact CG-CE2 3.48Å; H150-Y152 VanDerWaalsContact CG-CE2 3.48Å; H150-Y152 AromaticContact ND1-CD2 3.38Å; H150-Y152 WeakPolarHBondContact ND1-CD2 3.32Å; H150-Y152 AromaticContact ND1-CE2 2.89Å; H150-Y152 WeakPolarHBondContact ND1-CE2 3.47Å; H150-Y152 AromaticContact ND1-CZ 3.45Å; H150-Y152 AromaticContact NE2-CE2 3.53Å
153	E	32.4	Very low	34	Very low	196 Å²	196	154.2 Å²	154.2	92%	0.916	82%	0.818	S	S	*	*			trans	-61.3	138.1	146.6	-104.6	167.5	151.9	0	0	108.9
154	W	38.5	Very low	34.2	Very low	235 Å²	235	155 Å²	155	89%	0.89	82%	0.822	S	S	*	*			trans	-89.3	130.3	175.6	-79.1	36.4	0	0	0	109.4
155	D	39.5	Very low	34.1	Very low	167 Å²	167	150.5 Å²	150.5	89%	0.893	82%	0.823	S	S	*	*			trans	-139.9	146.8	149.7	-93.2	-31.7	0	0	0	108.3
156	D	36.9	Very low	34	Very low	148 Å²	148	154 Å²	154	79%	0.791	83%	0.829	S	S	*	*			trans	-65.8	169.2	-158.1	-75.3	-55.7	0	0	0	118.3
157	E	41.4	Very low	33.7	Very low	189 Å²	189	151.2 Å²	151.2	88%	0.883	82%	0.823	S	S	*	*			trans	109.6	102.7	151.4	-68.1	-167.7	146.5	0	0	120
158	F	35.7	Very low	33.9	Very low	221 Å²	221	151.1 Å²	151.1	97%	0.969	82%	0.823	S	S	*	*			trans	-13.4	133.3	149.6	-87.1	-101	0	0	0	118.6
159	G	34.8	Very low	33.7	Very low	77 Å²	77	151.6 Å²	151.6	79%	0.794	82%	0.82	S	S	*	*			trans	161.1	92	153.5	0	0	0	0	0	113.7
160	G	33.6	Very low	33.7	Very low	88 Å²	88	149.5 Å²	149.5	91%	0.907	82%	0.817	S	S	*	*			trans	-63.2	160.7	-176.7	0	0	0	0	0	116
161	G	35.4	Very low	33.7	Very low	81 Å²	81	148.7 Å²	148.7	84%	0.835	83%	0.825	S	S	*	*			trans	166.8	91	172.4	0	0	0	0	0	113.5
162	T	34.2	Very low	33.9	Very low	131 Å²	131	144.9 Å²	144.9	80%	0.804	82%	0.816	S	S	*	*			trans	-57.4	151	178.2	34.5	0	0	0	0	116.8
163	Q	35.6	Very low	34	Very low	161 Å²	161	142.7 Å²	142.7	75%	0.752	82%	0.823	S	S	*	*			trans	100.6	121.1	140.6	-83	177.4	22.2	0	0	121.6
164	H	34.1	Very low	33.9	Very low	167 Å²	167	141.6 Å²	141.6	77%	0.773	82%	0.818	S	S	*	*			trans	71.3	87.4	138.5	-70.4	-42.1	0	0	0	120.1
165	G	30.6	Very low	33.7	Very low	76 Å²	76	139.4 Å²	139.4	78%	0.784	82%	0.818	S	S	*	*				56.3	105.2	100.6	0	0	0	0	0	118.4
166	R	31.6	Very low	33.2	Very low	247 Å²	247	136.7 Å²	136.7	93%	0.932	81%	0.807	S	S	*	*			trans	-163.6	123.5	132.7	-148.8	166.1	169.8	165.8	-4.7	111.2
167	S	27.3	Very low	32.9	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	81%	0.812	S	S	*	*			trans	-74	134	173.8	52.2	0	0	0	0	112.2
168	V	32.3	Very low	32.5	Very low	140 Å²	140	137 Å²	137	85%	0.848	81%	0.806	S	S	*	*			trans	-148.9	123.7	144.7	-178.5	0	0	0	0	108.5
169	S	26.6	Very low	32.6	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	80%	0.795	S	S	*	*			trans	-62.4	158.2	170.4	48.9	0	0	0	0	113.5
170	V	30.6	Very low	32.5	Very low	127 Å²	127	136.2 Å²	136.2	77%	0.77	79%	0.79	S	S	*	*				175.4	126.3	125.4	152.4	0	0	0	0	111.7
171	S	32.9	Very low	32.8	Very low	105 Å²	105	137 Å²	137	73%	0.734	78%	0.781	S	S	*	*			trans	57.9	126	148	68.7	0	0	0	0	123.2
172	S	32.1	Very low	33.1	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	78%	0.779	S	S	*	*			trans	-60.1	171.3	157.7	44.7	0	0	0	0	114.4
173	P	38.6	Very low	33.5	Very low	129 Å²	129	137.9 Å²	137.9	84%	0.838	77%	0.773	S	S	*	*				-135.9	147	116.3	22.4	-3	0	0	0	114.6
174	E	29	Very low	33.7	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	78%	0.775	S	S	*	*			trans	-72.6	146.6	169.2	-62.9	171.9	144	0	0	111.5
175	E	34.5	Very low	34.3	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	78%	0.779	S	S	*	*			trans	-135.9	131.9	146.7	-78.9	-164.7	164.6	0	0	110.1
176	V	29.2	Very low	35.1	Very low	110 Å²	110	138.6 Å²	138.6	67%	0.667	78%	0.775	S	S	*	*			trans	-99.3	135	-177.8	172.2	0	0	0	0	108.4
177	F	31.6	Very low	35.9	Very low	204 Å²	204	134.4 Å²	134.4	90%	0.895	77%	0.77	S	S	*	*			trans	-144.8	130	157.4	-94.7	-79.6	0	0	0	111.4
178	D	33	Very low	36.8	Very low	141 Å²	141	134.3 Å²	134.3	75%	0.754	78%	0.775	S	S	*	*			trans	-97.6	142.2	-171.5	-104.9	-31.9	0	0	0	113.3
179	M	36	Very low	37.4	Very low	152 Å²	152	131 Å²	131	75%	0.749	77%	0.77	S	S	*	*				78.1	126	124.4	-154.9	163.7	95.6	0	0	123.4
180	D	34.5	Very low	38.4	Very low	129 Å²	129	133.2 Å²	133.2	69%	0.69	77%	0.772	S	S	*	*			trans	68	116.3	148.1	-66.2	-13.5	0	0	0	123.2
181	S	39.8	Very low	39	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	78%	0.778	S	S	*	*				162.7	146.9	95.8	55.1	0	0	0	0	115
182	T	41.8	Very low	39.2	Very low	129 Å²	129	135.7 Å²	135.7	79%	0.791	78%	0.778	S	S	*	*			trans	92.6	153.7	154.6	78	0	0	0	0	119.8
183	P	41.1	Very low	39.3	Very low	103 Å²	103	140 Å²	140	67%	0.669	79%	0.787	S	S	*	*			cis	-141.3	102.8	-25	28.1	-5	0	0	0	113.2
184	A	40.3	Very low	39.2	Very low	97 Å²	97	140.4 Å²	140.4	80%	0.802	79%	0.787	S	S	*	*	S	Bend	trans	-107.4	6	172.5	0	0	0	0	0	114.6
185	H	47.7	Very low	39.5	Very low	183 Å²	183	141 Å²	141	85%	0.847	79%	0.789	S	S	*	*	S	Bend	trans	-102.7	8.8	-170.4	-89.5	73.5	0	0	0	115.6
186	I	47.2	Very low	39.8	Very low	138 Å²	138	140.1 Å²	140.1	71%	0.708	79%	0.79	S	S	*	*	S	Bend	trans	-102	-10.5	-172.9	-64.2	176.8	0	0	0	113.4
187	I	48.3	Very low	40.6	Very low	160 Å²	160	142.8 Å²	142.8	82%	0.821	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-93.5	-3.3	-173.6	-58.4	176.9	0	0	0	113.3	G189	I187-G189 VanDerWaalsContact C-N 3.3Å; I187-G189 PolarHBondContact O-N 2.79Å
188	A	46.6	Very low	40.8	Very low	106 Å²	106	142.1 Å²	142.1	88%	0.876	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-83	7.1	-178.2	0	0	0	0	0	115.3
189	G	45.2	Very low	41.1	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	80%	0.798	S	S	*	*	G	3₁₀ helix	trans	-112	4.7	-167.7	0	0	0	0	0	118.3	I187	I187-G189 VanDerWaalsContact C-N 3.3Å; I187-G189 PolarHBondContact O-N 2.79Å
190	I	47.5	Very low	41.2	Very low	146 Å²	146	140.6 Å²	140.6	75%	0.749	80%	0.802	S	S	*	*	S	Bend	trans	-124	5.6	-160.6	-54.5	178.9	0	0	0	115.7
191	L	42.3	Very low	41.4	Very low	171 Å²	171	143.4 Å²	143.4	90%	0.895	81%	0.811	S	S	*	*			trans	-125	138.3	179	-75.1	164.6	0	0	0	114.7
192	P	37.6	Very low	41.7	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	81%	0.814	S	S	*	*			trans	-93	156.5	-158.8	16	4	0	0	0	113.6
193	H	34.9	Very low	41.6	Very low	193 Å²	193	144.3 Å²	144.3	89%	0.894	81%	0.814	S	S	*	*			trans	-36.5	122.8	-178.4	-79	-34.7	0	0	0	117.3
194	V	36.2	Very low	41.3	Very low	137 Å²	137	149.8 Å²	149.8	83%	0.83	83%	0.827	S	S	*	*			trans	-113.1	117.8	151.9	176.9	0	0	0	0	107.4	L196	V194-L196 PolarHBondContact O-N 2.96Å
195	E	34.9	Very low	41	Very low	185 Å²	185	149 Å²	149	86%	0.864	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-65.5	117.1	-176	-72	-178.1	142.3	0	0	112
196	L	40.6	Very low	40.3	Very low	170 Å²	170	143.8 Å²	143.8	89%	0.89	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-84.1	118.2	166.7	-83.8	151.8	0	0	0	109.4	V194 K198	V194-L196 PolarHBondContact O-N 2.96Å; L196-K198 PolarHBondContact O-N 3.25Å
197	I	45.2	Very low	39.9	Very low	167 Å²	167	147 Å²	147	86%	0.856	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-58.8	129.5	175.6	-61.8	163.8	0	0	0	109.7
198	K	37.1	Very low	39.1	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-62.5	134.4	-175.3	-71	175.4	177.2	176.3	0	112.8	L196	L196-K198 PolarHBondContact O-N 3.25Å
199	P	37.8	Very low	38.7	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-73.1	133.5	164.9	-6	22.9	0	0	0	110.1
200	T	38.7	Very low	38.3	Very low	137 Å²	137	152.5 Å²	152.5	84%	0.84	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-63.6	131	178.1	-39.5	0	0	0	0	111.3
201	E	38.2	Very low	38	Very low	187 Å²	187	150.2 Å²	150.2	87%	0.874	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-71.2	131.7	178.4	-64.3	-179.1	163.1	0	0	111.8
202	V	46.5	Very low	38.3	Very low	129 Å²	129	148.2 Å²	148.2	78%	0.782	84%	0.84	S	S	*	*			trans	-110.4	128.6	167.5	-163.4	0	0	0	0	107.7
203	P	40.6	Very low	38.9	Very low	123 Å²	123	148 Å²	148	80%	0.799	84%	0.841	S	S	*	*			trans	-73.7	132.9	-167.7	28.6	-33	0	0	0	111.9
204	K	34.1	Very low	39.8	Very low	217 Å²	217	142.8 Å²	142.8	94%	0.943	83%	0.832	S	S	*	*			trans	-75.2	120.1	174.3	-68.9	179.6	177.4	177.5	0	110.2
205	G	33.9	Very low	40.7	Very low	82 Å²	82	142.1 Å²	142.1	85%	0.845	83%	0.83	S	S	*	*			trans	175.8	94.6	166.5	0	0	0	0	0	112.9
206	G	34	Very low	41.8	Very low	73 Å²	73	138 Å²	138	75%	0.753	83%	0.827	S	S	*	*	S	Bend	trans	155.2	86.5	166.7	0	0	0	0	0	115.6
207	K	38.2	Very low	42.7	Very low	204 Å²	204	134 Å²	134	89%	0.887	82%	0.82	S	S	*	*			trans	46.3	104.9	154.3	-63.3	-176.7	178.9	179.7	0	118.1	N209	K207-N209 PolarHBondContact O-N 3.43Å; K207-N209 VanDerWaalsContact O-N 3.17Å
208	A	31.4	Very low	43.5	Very low	109 Å²	109	132 Å²	132	90%	0.901	82%	0.817	S	S	*	*			trans	-56.3	110.2	164.2	0	0	0	0	0	111.1
209	N	37.7	Very low	44.8	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	82%	0.816	S	S	*	*			trans	-112.6	125.6	154.8	-88.3	-6.3	0	0	0	106.8	K207 A211	K207-N209 PolarHBondContact O-N 3.43Å; K207-N209 VanDerWaalsContact O-N 3.17Å; N209-A211 PolarHBondContact O-N 3Å
210	E	36.6	Very low	46.2	Very low	191 Å²	191	129.9 Å²	129.9	89%	0.893	81%	0.813	S	S	*	*			trans	-51.2	102.6	172.7	-68.7	167.9	145.4	0	0	110.1	V212	E210-V212 VanDerWaalsContact C-N 3.33Å; E210-V212 PolarHBondContact O-N 2.89Å; E210-V212 VanDerWaalsContact O-N 3.13Å
211	A	41	Very low	47.8	Very low	99 Å²	99	132 Å²	132	82%	0.818	81%	0.814	S	S	*	*			trans	-82.3	86.1	170.3	0	0	0	0	0	108.1	N209 S213	N209-A211 PolarHBondContact O-N 3Å; A211-S213 PolarHBondContact O-N 3.42Å
212	V	49	Very low	49.3	Very low	128 Å²	128	126.4 Å²	126.4	78%	0.776	79%	0.789	S	S	*	*			trans	-45.3	126.2	157.8	175.9	0	0	0	0	107.5	E210 A214	E210-V212 VanDerWaalsContact C-N 3.33Å; E210-V212 PolarHBondContact O-N 2.89Å; E210-V212 VanDerWaalsContact O-N 3.13Å; V212-A214 PolarHBondContact O-N 2.96Å
213	S	49.8	Very low	51.1	Low	109 Å²	109	124.2 Å²	124.2	76%	0.762	78%	0.776	S	S	*	*			trans	-50.9	105.4	176.6	57.7	0	0	0	0	109.3	A211	A211-S213 PolarHBondContact O-N 3.42Å
214	A	53.9	Low	53.1	Low	85 Å²	85	125.5 Å²	125.5	70%	0.702	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.1	131.5	177.1	0	0	0	0	0	108.3	V212 A216	V212-A214 PolarHBondContact O-N 2.96Å; A214-A216 PolarHBondContact O-N 3.37Å
215	P	55.6	Low	55.3	Low	122 Å²	122	122.9 Å²	122.9	79%	0.792	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-59.8	133.7	176.6	26	-31.6	0	0	0	108.1	A217	P215-A217 PolarHBondContact O-N 3.24Å; P215-A217 VanDerWaalsContact O-N 3.12Å
216	A	58	Low	57.7	Low	98 Å²	98	123.4 Å²	123.4	81%	0.81	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-49.2	122.4	176.9	0	0	0	0	0	109.1	A214	A214-A216 PolarHBondContact O-N 3.37Å
217	A	59.4	Low	60	Low	88 Å²	88	124.6 Å²	124.6	73%	0.727	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-53.4	128.6	-179.7	0	0	0	0	0	108.9	P215 L219	P215-A217 PolarHBondContact O-N 3.24Å; P215-A217 VanDerWaalsContact O-N 3.12Å; A217-L219 PolarHBondContact O-N 3.13Å
218	P	62.5	Low	62.1	Low	123 Å²	123	121.3 Å²	121.3	80%	0.799	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-58	128	179.1	23	-31.1	0	0	0	108.4
219	L	62.9	Low	64.6	Low	155 Å²	155	119.1 Å²	119.1	81%	0.812	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-52.9	135.4	173.2	-70.3	168.3	0	0	0	108	A217 E221	A217-L219 PolarHBondContact O-N 3.13Å; L219-E221 PolarHBondContact O-N 3.39Å; L219-E221 VanDerWaalsContact O-N 3.1Å
220	P	67.3	Low	66.6	Low	115 Å²	115	117.3 Å²	117.3	75%	0.747	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-51.4	122.8	177.8	-22.2	30.5	0	0	0	109.5	L222	P220-L222 PolarHBondContact O-N 3.43Å; P220-L222 VanDerWaalsContact O-N 3.09Å
221	E	72.3	Confident	68.8	Low	181 Å²	181	113.1 Å²	113.1	85%	0.846	66%	0.662	S	S	*	*			trans	-64.6	113.2	173.4	-68.7	-172.1	172.8	0	0	107.8	L219 T223	L219-E221 PolarHBondContact O-N 3.39Å; L219-E221 VanDerWaalsContact O-N 3.1Å; E221-T223 PolarHBondContact O-N 3.01Å
222	L	71.2	Confident	71	Confident	70 Å²	70	112.2 Å²	112.2	37%	0.366	65%	0.65	S	S	.	*			trans	-51.6	132.9	173.8	-95.4	72.8	0	0	0	109.6	P220 E226 K227 F230	P220-L222 PolarHBondContact O-N 3.43Å; P220-L222 VanDerWaalsContact O-N 3.09Å; L222-E226 HydrophobicContact CB-CB 4.24Å; L222-E226 HydrophobicContact CD2-CB 3.99Å; L222-E226 HydrophobicContact CG-CB 4.08Å; L222-K227 HydrophobicContact CB-CG 3.85Å; L222-K227 HydrophobicContact CD2-CG 4.41Å; L222-K227 WeakPolarHBondContact O-CE 2.89Å; L222-K227 PolarHBondContact O-NZ 3.46Å; L222-F230 HydrophobicContact CD2-CD2 3.27Å; L222-F230 HydrophobicContact CD2-CE2 3.43Å; L222-F230 VanDerWaalsContact CD2-CE2 3.43Å; L222-F230 HydrophobicContact CD2-CG 4.3Å; L222-F230 HydrophobicContact CG-CE2 4.4Å
223	T	84.1	Confident	72.9	Confident	83 Å²	83	108.2 Å²	108.2	51%	0.509	63%	0.627	S	S	.	*			trans	-55.8	148.7	169.1	24.7	0	0	0	0	110.1	E221 E225 E226 K227	E221-T223 PolarHBondContact O-N 3.01Å; T223-E225 PolarHBondContact O-N 2.79Å; T223-E225 VanDerWaalsContact O-N 3.16Å; T223-E226 WeakPolarHBondContact O-CB 3.12Å; T223-E226 PolarHBondContact O-N 2.85Å; T223-E226 VanDerWaalsContact OG1-CG 3.32Å; T223-E226 WeakPolarHBondContact OG1-CG 3.43Å; T223-E226 PolarHBondContact OG1-OE2 3.46Å; T223-K227 PolarHBondContact O-N 3.24Å
224	E	82.2	Confident	74.6	Confident	151 Å²	151	110.2 Å²	110.2	71%	0.706	62%	0.624	S	S	*	*	H	α-helix	trans	-57.5	-31.9	-178.9	-71.6	-171.4	160.8	0	0	112.6	K227 Q228	E224-K227 PolarHBondContact O-N 2.84Å; E224-Q228 WeakPolarHBondContact O-CG 3.36Å; E224-Q228 PolarHBondContact O-N 3.29Å
225	E	80	Confident	76.1	Confident	162 Å²	162	113.7 Å²	113.7	76%	0.757	63%	0.626	S	S	*	*	H	α-helix	trans	-65.7	-40.6	174.6	-63.2	-178.3	179.7	0	0	112.3	T223 Q228 S229	T223-E225 PolarHBondContact O-N 2.79Å; T223-E225 VanDerWaalsContact O-N 3.16Å; E225-Q228 PolarHBondContact O-N 3.39Å; E225-S229 WeakPolarHBondContact O-CB 3.29Å; E225-S229 PolarHBondContact O-N 2.95Å
226	E	84	Confident	77.6	Confident	92 Å²	92	110.6 Å²	110.6	43%	0.43	60%	0.603	S	S	.	*	H	α-helix	trans	-66.8	-43.7	173.1	-69.1	178.1	169.7	0	0	110.1	L222 T223 Q228 S229 F230	L222-E226 HydrophobicContact CB-CB 4.24Å; L222-E226 HydrophobicContact CD2-CB 3.99Å; L222-E226 HydrophobicContact CG-CB 4.08Å; T223-E226 WeakPolarHBondContact O-CB 3.12Å; T223-E226 PolarHBondContact O-N 2.85Å; T223-E226 VanDerWaalsContact OG1-CG 3.32Å; T223-E226 WeakPolarHBondContact OG1-CG 3.43Å; T223-E226 PolarHBondContact OG1-OE2 3.46Å; E226-Q228 VanDerWaalsContact C-N 3.29Å; E226-Q228 PolarHBondContact O-N 3.03Å; E226-S229 WeakPolarHBondContact CA-OG 3.43Å; E226-S229 PolarHBondContact O-N 3.46Å; E226-S229 VanDerWaalsContact O-N 3.14Å; E226-S229 PolarHBondContact O-OG 3.07Å; E226-F230 HydrophobicContact CB-CD2 4.27Å; E226-F230 HydrophobicContact CB-CE2 4.3Å; E226-F230 WeakPolarHBondContact O-CB 3.43Å; E226-F230 WeakPolarHBondContact O-CD2 3.47Å; E226-F230 PolarHBondContact O-N 3.42Å
227	K	81.9	Confident	78.9	Confident	99 Å²	99	110.8 Å²	110.8	43%	0.43	59%	0.587	S	S	.	*	H	α-helix	trans	-57.1	-43.6	175.5	-69.4	176.5	179.5	161.7	0	111.9	L222 T223 E224 F230 L231	L222-K227 HydrophobicContact CB-CG 3.85Å; L222-K227 HydrophobicContact CD2-CG 4.41Å; L222-K227 WeakPolarHBondContact O-CE 2.89Å; L222-K227 PolarHBondContact O-NZ 3.46Å; T223-K227 PolarHBondContact O-N 3.24Å; E224-K227 PolarHBondContact O-N 2.84Å; K227-F230 PolarHBondContact O-N 3.23Å; K227-L231 WeakPolarHBondContact O-CB 2.96Å; K227-L231 WeakPolarHBondContact O-CG 3Å; K227-L231 PolarHBondContact O-N 2.98Å
228	Q	82.7	Confident	80	Confident	135 Å²	135	109 Å²	109	63%	0.631	57%	0.569	S	S	*	*	H	α-helix	trans	-66.5	-40.9	176.6	-72.2	-179.7	14.2	0	0	112	E224 E225 E226 L231 S232	E224-Q228 WeakPolarHBondContact O-CG 3.36Å; E224-Q228 PolarHBondContact O-N 3.29Å; E225-Q228 PolarHBondContact O-N 3.39Å; E226-Q228 VanDerWaalsContact C-N 3.29Å; E226-Q228 PolarHBondContact O-N 3.03Å; Q228-L231 PolarHBondContact O-N 2.96Å; Q228-S232 WeakPolarHBondContact O-CB 3.38Å; Q228-S232 PolarHBondContact O-N 2.92Å; Q228-S232 PolarHBondContact O-OG 3.01Å
229	S	83.8	Confident	81.1	Confident	63 Å²	63	109 Å²	109	44%	0.441	56%	0.557	S	S	.	*	H	α-helix	trans	-65	-41.7	176.6	76.8	0	0	0	0	111.6	E225 E226 S232 S233	E225-S229 WeakPolarHBondContact O-CB 3.29Å; E225-S229 PolarHBondContact O-N 2.95Å; E226-S229 WeakPolarHBondContact CA-OG 3.43Å; E226-S229 PolarHBondContact O-N 3.46Å; E226-S229 VanDerWaalsContact O-N 3.14Å; E226-S229 PolarHBondContact O-OG 3.07Å; S229-S232 PolarHBondContact O-N 3.29Å; S229-S232 PolarHBondContact O-OG 2.9Å; S229-S233 PolarHBondContact O-N 2.98Å; S229-S233 VanDerWaalsContact O-N 3.14Å
230	F	81.1	Confident	82.2	Confident	115 Å²	115	105.5 Å²	105.5	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-64.1	-42.2	173.8	-81	-71.4	0	0	0	112.4	L222 E226 K227 S232 S233 L236	L222-F230 HydrophobicContact CD2-CD2 3.27Å; L222-F230 HydrophobicContact CD2-CE2 3.43Å; L222-F230 VanDerWaalsContact CD2-CE2 3.43Å; L222-F230 HydrophobicContact CD2-CG 4.3Å; L222-F230 HydrophobicContact CG-CE2 4.4Å; E226-F230 HydrophobicContact CB-CD2 4.27Å; E226-F230 HydrophobicContact CB-CE2 4.3Å; E226-F230 WeakPolarHBondContact O-CB 3.43Å; E226-F230 WeakPolarHBondContact O-CD2 3.47Å; E226-F230 PolarHBondContact O-N 3.42Å; K227-F230 PolarHBondContact O-N 3.23Å; F230-S232 VanDerWaalsContact C-N 3.26Å; F230-S232 PolarHBondContact O-N 3.42Å; F230-S233 WeakPolarHBondContact O-CB 3.45Å; F230-S233 PolarHBondContact O-N 3.34Å; F230-S233 VanDerWaalsContact O-N 3.08Å; F230-L236 VanDerWaalsContact O-CD2 3.25Å; F230-L236 WeakPolarHBondContact O-CD2 3.45Å
231	L	82.5	Confident	83	Confident	103 Å²	103	103.2 Å²	103.2	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-31	175	-74.5	170.4	0	0	0	112.9	K227 Q228 S233 L236 Q237	K227-L231 WeakPolarHBondContact O-CB 2.96Å; K227-L231 WeakPolarHBondContact O-CG 3Å; K227-L231 PolarHBondContact O-N 2.98Å; Q228-L231 PolarHBondContact O-N 2.96Å; L231-S233 VanDerWaalsContact C-N 3.31Å; L231-L236 HydrophobicContact CD2-CD2 4.28Å; L231-Q237 PolarHBondContact O-NE2 2.9Å
232	S	86	Confident	83.4	Confident	80 Å²	80	100.6 Å²	100.6	56%	0.559	51%	0.505	S	S	*	.	H	α-helix	trans	-78.5	-13.3	174.2	75	0	0	0	0	113.9	Q228 S229 F230 E234	Q228-S232 WeakPolarHBondContact O-CB 3.38Å; Q228-S232 PolarHBondContact O-N 2.92Å; Q228-S232 PolarHBondContact O-OG 3.01Å; S229-S232 PolarHBondContact O-N 3.29Å; S229-S232 PolarHBondContact O-OG 2.9Å; F230-S232 VanDerWaalsContact C-N 3.26Å; F230-S232 PolarHBondContact O-N 3.42Å; S232-E234 PolarHBondContact O-N 3.47Å
233	S	89.1	Confident	84.2	Confident	43 Å²	43	98.9 Å²	98.9	30%	0.301	50%	0.5	S	S	.	.			trans	-63	128.1	-179.6	-177.4	0	0	0	0	111.4	S229 F230 L231 E235 L236 Q237	S229-S233 PolarHBondContact O-N 2.98Å; S229-S233 VanDerWaalsContact O-N 3.14Å; F230-S233 WeakPolarHBondContact O-CB 3.45Å; F230-S233 PolarHBondContact O-N 3.34Å; F230-S233 VanDerWaalsContact O-N 3.08Å; L231-S233 VanDerWaalsContact C-N 3.31Å; S233-E235 PolarHBondContact O-N 2.86Å; S233-L236 PolarHBondContact O-N 3.29Å; S233-Q237 WeakPolarHBondContact O-CG 3.42Å; S233-Q237 PolarHBondContact O-N 3.15Å
234	E	86	Confident	84.2	Confident	151 Å²	151	97.3 Å²	97.3	71%	0.706	49%	0.493	S	S	*	.	H	α-helix	trans	-59.3	-36.4	179	-173.2	-179.4	172.5	0	0	111.7	S232 Q237 S238	S232-E234 PolarHBondContact O-N 3.47Å; E234-Q237 PolarHBondContact O-N 3.38Å; E234-S238 WeakPolarHBondContact O-CB 3.5Å; E234-S238 PolarHBondContact O-N 3.25Å
235	E	85.4	Confident	84.1	Confident	158 Å²	158	93 Å²	93	74%	0.738	47%	0.47	S	S	*	.	H	α-helix	trans	-63.6	-46.4	178.1	-65.7	-178.6	179.4	0	0	111.1	S233 S238 F239	S233-E235 PolarHBondContact O-N 2.86Å; E235-S238 PolarHBondContact O-N 3.49Å; E235-S238 PolarHBondContact O-OG 3.41Å; E235-F239 WeakPolarHBondContact O-CB 3.49Å; E235-F239 PolarHBondContact O-N 3.17Å
236	L	87.8	Confident	84.2	Confident	58 Å²	58	89.7 Å²	89.7	30%	0.304	46%	0.461	S	S	.	.	H	α-helix	trans	-67.3	-40.6	178.2	-175.7	64.6	0	0	0	111.1	F230 L231 S233 S238 F239 L240	F230-L236 VanDerWaalsContact O-CD2 3.25Å; F230-L236 WeakPolarHBondContact O-CD2 3.45Å; L231-L236 HydrophobicContact CD2-CD2 4.28Å; S233-L236 PolarHBondContact O-N 3.29Å; L236-S238 VanDerWaalsContact C-N 3.34Å; L236-S238 PolarHBondContact O-N 2.72Å; L236-F239 HydrophobicContact CD1-CD1 4.4Å; L236-F239 CarbonylContact O-C 3.59Å; L236-F239 PolarHBondContact O-N 3.18Å; L236-L240 HydrophobicContact CD1-CD1 4.49Å; L236-L240 HydrophobicContact CD1-CG 4.25Å; L236-L240 HydrophobicContact CD2-CD1 4.37Å; L236-L240 HydrophobicContact CG-CD1 3.95Å; L236-L240 HydrophobicContact CG-CG 4.16Å; L236-L240 WeakPolarHBondContact O-CB 3.43Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 3.43Å; L236-L240 PolarHBondContact O-N 3.33Å
237	Q	84.8	Confident	84.2	Confident	101 Å²	101	89.2 Å²	89.2	47%	0.472	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-43.1	175	-70.7	-179.3	8.8	0	0	111.5	L231 S233 E234 F239 L240 V241	L231-Q237 PolarHBondContact O-NE2 2.9Å; S233-Q237 WeakPolarHBondContact O-CG 3.42Å; S233-Q237 PolarHBondContact O-N 3.15Å; E234-Q237 PolarHBondContact O-N 3.38Å; Q237-F239 VanDerWaalsContact C-N 3.28Å; Q237-F239 PolarHBondContact O-N 3.11Å; Q237-L240 PolarHBondContact O-N 3.06Å; Q237-V241 WeakPolarHBondContact O-CB 3.44Å; Q237-V241 WeakPolarHBondContact O-CG2 3.43Å; Q237-V241 PolarHBondContact O-N 3.03Å
238	S	81.4	Confident	84.1	Confident	50 Å²	50	87.6 Å²	87.6	35%	0.35	46%	0.458	S	S	.	.	H	α-helix	trans	-61.8	-38.5	175.8	81.6	0	0	0	0	111.8	E234 E235 L236 R242	E234-S238 WeakPolarHBondContact O-CB 3.5Å; E234-S238 PolarHBondContact O-N 3.25Å; E235-S238 PolarHBondContact O-N 3.49Å; E235-S238 PolarHBondContact O-OG 3.41Å; L236-S238 VanDerWaalsContact C-N 3.34Å; L236-S238 PolarHBondContact O-N 2.72Å; S238-R242 WeakPolarHBondContact O-CB 3.29Å; S238-R242 PolarHBondContact O-N 3.13Å
239	F	86.1	Confident	83.8	Confident	123 Å²	123	83.7 Å²	83.7	54%	0.539	44%	0.437	S	S	.	.	H	α-helix	trans	-69	-47.1	176	178.2	-96.5	0	0	0	111.7	E235 L236 Q237 V241 R242 A243	E235-F239 WeakPolarHBondContact O-CB 3.49Å; E235-F239 PolarHBondContact O-N 3.17Å; L236-F239 HydrophobicContact CD1-CD1 4.4Å; L236-F239 CarbonylContact O-C 3.59Å; L236-F239 PolarHBondContact O-N 3.18Å; Q237-F239 VanDerWaalsContact C-N 3.28Å; Q237-F239 PolarHBondContact O-N 3.11Å; F239-V241 VanDerWaalsContact C-N 3.32Å; F239-V241 PolarHBondContact O-N 2.87Å; F239-R242 PolarHBondContact O-N 3.21Å; F239-R242 VanDerWaalsContact O-N 3.14Å; F239-A243 HydrophobicContact CE1-CB 4.33Å; F239-A243 WeakPolarHBondContact O-CB 3.17Å; F239-A243 PolarHBondContact O-N 2.93Å
240	L	87.3	Confident	83.6	Confident	82 Å²	82	83.7 Å²	83.7	43%	0.429	44%	0.442	S	S	.	.	H	α-helix	trans	-61.9	-39.7	177.6	-75.2	173.5	0	0	0	111.4	L236 Q237 A243 S244	L236-L240 HydrophobicContact CD1-CD1 4.49Å; L236-L240 HydrophobicContact CD1-CG 4.25Å; L236-L240 HydrophobicContact CD2-CD1 4.37Å; L236-L240 HydrophobicContact CG-CD1 3.95Å; L236-L240 HydrophobicContact CG-CG 4.16Å; L236-L240 WeakPolarHBondContact O-CB 3.43Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 3.43Å; L236-L240 PolarHBondContact O-N 3.33Å; Q237-L240 PolarHBondContact O-N 3.06Å; L240-A243 PolarHBondContact O-N 2.91Å; L240-S244 WeakPolarHBondContact O-CB 3.45Å; L240-S244 PolarHBondContact O-N 3.44Å; L240-S244 PolarHBondContact O-OG 3.25Å
241	V	82.9	Confident	83.6	Confident	68 Å²	68	84.1 Å²	84.1	41%	0.412	45%	0.448	S	S	.	.	H	α-helix	trans	-64.2	-42.4	173.9	170.6	0	0	0	0	110.7	Q237 F239 S244 R245	Q237-V241 WeakPolarHBondContact O-CB 3.44Å; Q237-V241 WeakPolarHBondContact O-CG2 3.43Å; Q237-V241 PolarHBondContact O-N 3.03Å; F239-V241 VanDerWaalsContact C-N 3.32Å; F239-V241 PolarHBondContact O-N 2.87Å; V241-S244 WeakPolarHBondContact CA-OG 3.15Å; V241-S244 PolarHBondContact O-OG 3.46Å; V241-R245 VanDerWaalsContact CG1-NE 3.34Å; V241-R245 VanDerWaalsContact O-CD 3.26Å; V241-R245 WeakPolarHBondContact O-CD 3.43Å; V241-R245 WeakPolarHBondContact O-CG 3.19Å; V241-R245 PolarHBondContact O-N 3.19Å
242	R	81.9	Confident	83.1	Confident	126 Å²	126	79.7 Å²	79.7	48%	0.475	43%	0.426	S	S	.	.	H	α-helix	trans	-65.6	-45.2	175.8	-173.1	179.7	-68.8	130.2	-2.2	112.1	S238 F239 R245 V246	S238-R242 WeakPolarHBondContact O-CB 3.29Å; S238-R242 PolarHBondContact O-N 3.13Å; F239-R242 PolarHBondContact O-N 3.21Å; F239-R242 VanDerWaalsContact O-N 3.14Å; R242-R245 PolarHBondContact O-N 3.06Å; R242-V246 PolarHBondContact O-N 3.07Å
243	A	86.7	Confident	82.4	Confident	33 Å²	33	80.6 Å²	80.6	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-67.8	-45.3	-178.9	0	0	0	0	0	111.7	F239 L240 R245 V246 V247	F239-A243 HydrophobicContact CE1-CB 4.33Å; F239-A243 WeakPolarHBondContact O-CB 3.17Å; F239-A243 PolarHBondContact O-N 2.93Å; L240-A243 PolarHBondContact O-N 2.91Å; A243-R245 VanDerWaalsContact C-N 3.28Å; A243-R245 PolarHBondContact O-N 3.39Å; A243-V246 PolarHBondContact O-N 3.03Å; A243-V246 VanDerWaalsContact O-N 3.14Å; A243-V247 WeakPolarHBondContact O-CG2 3.33Å; A243-V247 PolarHBondContact O-N 3.21Å
244	S	85.6	Confident	81.2	Confident	50 Å²	50	86.1 Å²	86.1	35%	0.35	44%	0.44	S	S	.	.	H	α-helix	trans	-59.2	-38.6	176.1	55.2	0	0	0	0	111.8	L240 V241 V246 V247 E248	L240-S244 WeakPolarHBondContact O-CB 3.45Å; L240-S244 PolarHBondContact O-N 3.44Å; L240-S244 PolarHBondContact O-OG 3.25Å; V241-S244 WeakPolarHBondContact CA-OG 3.15Å; V241-S244 PolarHBondContact O-OG 3.46Å; S244-V246 PolarHBondContact O-N 2.98Å; S244-V247 PolarHBondContact O-N 3.26Å; S244-E248 VanDerWaalsContact O-CB 3.32Å; S244-E248 WeakPolarHBondContact O-CB 3.39Å; S244-E248 VanDerWaalsContact O-CG 3.27Å; S244-E248 WeakPolarHBondContact O-CG 3.45Å; S244-E248 PolarHBondContact O-N 3.38Å
245	R	78.7	Confident	80.1	Confident	60 Å²	60	84.9 Å²	84.9	23%	0.226	44%	0.438	C	S	.	.	H	α-helix	trans	-61.3	-44.6	174.1	-71.7	164.6	-173.3	-158.9	-7.1	112.6	V241 R242 A243 V247 E248 R249 F331 E337 Y338	V241-R245 VanDerWaalsContact CG1-NE 3.34Å; V241-R245 VanDerWaalsContact O-CD 3.26Å; V241-R245 WeakPolarHBondContact O-CD 3.43Å; V241-R245 WeakPolarHBondContact O-CG 3.19Å; V241-R245 PolarHBondContact O-N 3.19Å; R242-R245 PolarHBondContact O-N 3.06Å; A243-R245 VanDerWaalsContact C-N 3.28Å; A243-R245 PolarHBondContact O-N 3.39Å; R245-V247 VanDerWaalsContact C-N 3.34Å; R245-E248 PolarHBondContact O-N 2.96Å; R245-R249 VanDerWaalsContact O-CG 3.29Å; R245-R249 WeakPolarHBondContact O-CG 3.35Å; R245-R249 PolarHBondContact O-N 3.26Å; R245-F331 HydrophobicContact CB-CZ 4.23Å; R245-F331 WeakPolarHBondContact O-CZ 3.48Å; R245-E337 HydrophobicContact CG-CG 4.49Å; R245-E337 PolarHBondContact NH1-O 2.96Å; R245-E337 PolarHBondContact NH2-O 2.79Å; R245-Y338 PolarHBondContact NH1-OH 2.98Å
246	V	81.9	Confident	79.2	Confident	93 Å²	93	82.3 Å²	82.3	56%	0.564	43%	0.43	S	S	*	.	H	α-helix	trans	-63.1	-43.8	177.2	176.3	0	0	0	0	110.7	R242 A243 S244 R249 A250	R242-V246 PolarHBondContact O-N 3.07Å; A243-V246 PolarHBondContact O-N 3.03Å; A243-V246 VanDerWaalsContact O-N 3.14Å; S244-V246 PolarHBondContact O-N 2.98Å; V246-R249 WeakPolarHBondContact O-CB 3.29Å; V246-R249 PolarHBondContact O-N 2.99Å; V246-A250 PolarHBondContact O-N 2.86Å; V246-A250 VanDerWaalsContact O-N 3.07Å
247	V	84.3	Confident	78.3	Confident	83 Å²	83	86 Å²	86	50%	0.503	46%	0.455	S	S	.	.	H	α-helix	trans	-62.7	-44.5	176.5	172.2	0	0	0	0	111.1	A243 S244 R245 R249 A250 I251	A243-V247 WeakPolarHBondContact O-CG2 3.33Å; A243-V247 PolarHBondContact O-N 3.21Å; S244-V247 PolarHBondContact O-N 3.26Å; R245-V247 VanDerWaalsContact C-N 3.34Å; V247-R249 VanDerWaalsContact C-N 3.29Å; V247-R249 PolarHBondContact O-N 3.15Å; V247-A250 PolarHBondContact O-N 3.33Å; V247-I251 HydrophobicContact CG1-CD1 3.63Å; V247-I251 HydrophobicContact CG1-CG1 4.32Å; V247-I251 VanDerWaalsContact O-CG1 3.27Å; V247-I251 WeakPolarHBondContact O-CG1 3.43Å; V247-I251 PolarHBondContact O-N 3.42Å
248	E	80.7	Confident	77.5	Confident	64 Å²	64	89.6 Å²	89.6	30%	0.299	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-33.6	177.5	-76	-177	-171	0	0	112.2	S244 R245 A252 F331 K333	S244-E248 VanDerWaalsContact O-CB 3.32Å; S244-E248 WeakPolarHBondContact O-CB 3.39Å; S244-E248 VanDerWaalsContact O-CG 3.27Å; S244-E248 WeakPolarHBondContact O-CG 3.45Å; S244-E248 PolarHBondContact O-N 3.38Å; R245-E248 PolarHBondContact O-N 2.96Å; E248-A252 WeakPolarHBondContact O-CB 3.38Å; E248-A252 PolarHBondContact O-N 3.26Å; E248-A252 VanDerWaalsContact O-N 3.08Å; E248-F331 HydrophobicContact CB-CD1 4.02Å; E248-F331 HydrophobicContact CB-CE1 3.36Å; E248-F331 HydrophobicContact CB-CZ 4.28Å; E248-K333 IonicContact OE1-NZ 3.77Å; E248-K333 PolarHBondContact OE1-NZ 2.69Å; E248-K333 IonicContact OE2-NZ 2.77Å; E248-K333 PolarHBondContact OE2-NZ 3.48Å
249	R	76.8	Confident	76.8	Confident	53 Å²	53	90.1 Å²	90.1	20%	0.2	48%	0.476	C	S	.	.	H	α-helix	trans	-64.9	-44.7	173.7	-73.3	173.6	-176.1	-158.2	4.3	110.7	R245 V246 V247 A252 E253 E304 N328 F331 E337	R245-R249 VanDerWaalsContact O-CG 3.29Å; R245-R249 WeakPolarHBondContact O-CG 3.35Å; R245-R249 PolarHBondContact O-N 3.26Å; V246-R249 WeakPolarHBondContact O-CB 3.29Å; V246-R249 PolarHBondContact O-N 2.99Å; V247-R249 VanDerWaalsContact C-N 3.29Å; V247-R249 PolarHBondContact O-N 3.15Å; R249-A252 PolarHBondContact O-N 3.39Å; R249-E253 PolarHBondContact O-N 2.79Å; R249-E304 IonicContact NH1-OE1 3.23Å; R249-E304 PolarHBondContact NH1-OE1 2.93Å; R249-N328 PolarHBondContact NE-ND2 3.29Å; R249-F331 HydrophobicContact CB-CE1 4.4Å; R249-F331 HydrophobicContact CG-CD1 4.48Å; R249-F331 HydrophobicContact CG-CE1 3.67Å; R249-F331 HydrophobicContact CG-CE2 4.31Å; R249-F331 HydrophobicContact CG-CZ 3.57Å; R249-E337 IonicContact CZ-OE1 3.72Å; R249-E337 IonicContact CZ-OE2 3.22Å; R249-E337 IonicContact NE-OE1 3.11Å; R249-E337 IonicContact NE-OE2 3.41Å; R249-E337 PolarHBondContact NE-OE2 3.02Å; R249-E337 IonicContact NH2-OE1 3.91Å; R249-E337 PolarHBondContact NH2-OE1 2.89Å; R249-E337 IonicContact NH2-OE2 3.83Å; R249-E337 PolarHBondContact NH2-OE2 2.83Å
250	A	78.1	Confident	76.2	Confident	64 Å²	64	90.4 Å²	90.4	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-64.6	-40.7	177.9	0	0	0	0	0	112	V246 V247 A252 E253	V246-A250 PolarHBondContact O-N 2.86Å; V246-A250 VanDerWaalsContact O-N 3.07Å; V247-A250 PolarHBondContact O-N 3.33Å; A250-A252 PolarHBondContact O-N 3.29Å; A250-E253 PolarHBondContact O-N 3.4Å
251	I	80.9	Confident	75.3	Confident	123 Å²	123	98 Å²	98	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-67.1	-27.4	177	-66.8	166.5	0	0	0	111.9	V247	V247-I251 HydrophobicContact CG1-CD1 3.63Å; V247-I251 HydrophobicContact CG1-CG1 4.32Å; V247-I251 VanDerWaalsContact O-CG1 3.27Å; V247-I251 WeakPolarHBondContact O-CG1 3.43Å; V247-I251 PolarHBondContact O-N 3.42Å
252	A	73.4	Confident	74.5	Confident	11 Å²	11	98.4 Å²	98.4	9%	0.091	53%	0.526	C	S	.	.	H	α-helix	trans	-79.5	-20.6	-177.9	0	0	0	0	0	113.7	E248 R249 A250 K254 K330	E248-A252 WeakPolarHBondContact O-CB 3.38Å; E248-A252 PolarHBondContact O-N 3.26Å; E248-A252 VanDerWaalsContact O-N 3.08Å; R249-A252 PolarHBondContact O-N 3.39Å; A250-A252 PolarHBondContact O-N 3.29Å; A252-K254 PolarHBondContact O-N 3.3Å; A252-K330 VanDerWaalsContact CB-O 3.26Å; A252-K330 WeakPolarHBondContact CB-O 3.45Å
253	E	70.1	Confident	73.4	Confident	99 Å²	99	103.3 Å²	103.3	46%	0.463	55%	0.545	S	S	.	.			trans	-62.9	120	173	-162.4	146.8	-113.9	0	0	108.8	R249 A250 D255 K330	R249-E253 PolarHBondContact O-N 2.79Å; A250-E253 PolarHBondContact O-N 3.4Å; E253-D255 VanDerWaalsContact C-N 3.27Å; E253-D255 HydrophobicContact CG-CB 4.37Å; E253-D255 PolarHBondContact O-N 3.36Å; E253-K330 IonicContact OE1-NZ 3.52Å; E253-K330 PolarHBondContact OE1-NZ 3.27Å
254	K	64.1	Low	71.9	Confident	158 Å²	158	104.7 Å²	104.7	69%	0.687	56%	0.561	S	S	*	*			trans	-89.3	8.3	-173.6	-70.3	-175.2	179.9	178.2	0	112.7	A252 D256	A252-K254 PolarHBondContact O-N 3.3Å; K254-D256 VanDerWaalsContact C-N 3.33Å; K254-D256 PolarHBondContact O-N 2.58Å
255	D	64.3	Low	70.3	Confident	125 Å²	125	110 Å²	110	67%	0.668	58%	0.584	S	S	*	*			trans	-74.9	91.2	-175.8	-61.2	-24.2	0	0	0	108.8	E253 V257	E253-D255 VanDerWaalsContact C-N 3.27Å; E253-D255 HydrophobicContact CG-CB 4.37Å; E253-D255 PolarHBondContact O-N 3.36Å; D255-V257 VanDerWaalsContact C-N 3.35Å; D255-V257 PolarHBondContact O-N 2.97Å
256	D	65.1	Low	69	Low	105 Å²	105	114.8 Å²	114.8	56%	0.561	61%	0.609	S	S	*	*			trans	-73.9	94	169.3	-165.2	0.4	0	0	0	108.3	K254 F258 A259	K254-D256 VanDerWaalsContact C-N 3.33Å; K254-D256 PolarHBondContact O-N 2.58Å; D256-F258 PolarHBondContact O-N 3.22Å; D256-F258 VanDerWaalsContact O-N 3.13Å; D256-F258 WeakPolarHBondContact OD1-CB 3.35Å; D256-F258 PolarHBondContact OD1-N 3.31Å; D256-A259 WeakPolarHBondContact O-CB 3.29Å; D256-A259 PolarHBondContact O-N 3.37Å; D256-A259 VanDerWaalsContact O-N 3.11Å
257	V	68.8	Low	67.2	Low	136 Å²	136	118.4 Å²	118.4	82%	0.824	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-18.9	173.2	-176.8	0	0	0	0	110.9	D255 A259	D255-V257 VanDerWaalsContact C-N 3.35Å; D255-V257 PolarHBondContact O-N 2.97Å; V257-A259 VanDerWaalsContact C-N 3.3Å; V257-A259 PolarHBondContact O-N 2.69Å
258	F	69.1	Low	65.7	Low	175 Å²	175	120.7 Å²	120.7	77%	0.768	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	14.4	177.6	-55.7	-79.6	0	0	0	113.8	D256 D260	D256-F258 PolarHBondContact O-N 3.22Å; D256-F258 VanDerWaalsContact O-N 3.13Å; D256-F258 WeakPolarHBondContact OD1-CB 3.35Å; D256-F258 PolarHBondContact OD1-N 3.31Å; F258-D260 PolarHBondContact O-N 3.41Å
259	A	67.1	Low	64	Low	62 Å²	62	126.4 Å²	126.4	51%	0.512	65%	0.653	S	S	.	*			trans	-62.7	102	170.6	0	0	0	0	0	110.3	D256 V257 Y261	D256-A259 WeakPolarHBondContact O-CB 3.29Å; D256-A259 PolarHBondContact O-N 3.37Å; D256-A259 VanDerWaalsContact O-N 3.11Å; V257-A259 VanDerWaalsContact C-N 3.3Å; V257-A259 PolarHBondContact O-N 2.69Å; A259-Y261 PolarHBondContact O-N 3.34Å; A259-Y261 VanDerWaalsContact O-N 3.07Å
260	D	72.9	Confident	62.7	Low	129 Å²	129	131 Å²	131	69%	0.69	68%	0.681	S	S	*	*			trans	-60.4	109.5	170.1	-76.7	-28.5	0	0	0	109	F258 G262 R263	F258-D260 PolarHBondContact O-N 3.41Å; D260-G262 PolarHBondContact O-N 3.22Å; D260-R263 PolarHBondContact O-N 3.07Å; D260-R263 VanDerWaalsContact O-N 3.15Å
261	Y	67.1	Low	61.3	Low	241 Å²	241	133.9 Å²	133.9	95%	0.945	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-9	175.6	-65.2	-83.7	0	0	0	114.4	A259	A259-Y261 PolarHBondContact O-N 3.34Å; A259-Y261 VanDerWaalsContact O-N 3.07Å
262	G	67.2	Low	60.1	Low	76 Å²	76	132.1 Å²	132.1	78%	0.784	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-7.6	-179.4	0	0	0	0	0	116.5	D260	D260-G262 PolarHBondContact O-N 3.22Å
263	R	59.4	Low	59.4	Low	230 Å²	230	136.1 Å²	136.1	87%	0.868	71%	0.71	S	S	*	*	S	Bend	trans	-106.6	89.3	179.4	-87.9	-168.8	179.2	-171.8	3.1	111.8	D260	D260-R263 PolarHBondContact O-N 3.07Å; D260-R263 VanDerWaalsContact O-N 3.15Å
264	G	53.5	Low	59.3	Low	61 Å²	61	134.9 Å²	134.9	63%	0.629	71%	0.709	S	S	*	*			trans	104.2	74.5	161.5	0	0	0	0	0	114	E266	G264-E266 PolarHBondContact O-N 3.07Å
265	I	51.8	Low	60	Low	162 Å²	162	131 Å²	131	83%	0.831	69%	0.692	S	S	*	*			trans	-70.6	64.2	144.5	-52.2	170	0	0	0	106.4
266	E	51.9	Low	61	Low	161 Å²	161	126 Å²	126	75%	0.752	67%	0.665	S	S	*	*			trans	-83.8	106.1	150.7	-72.6	-167	161.4	0	0	103.4	G264 D268	G264-E266 PolarHBondContact O-N 3.07Å; E266-D268 PolarHBondContact O-N 2.67Å
267	Q	45.7	Very low	62	Low	169 Å²	169	123.5 Å²	123.5	79%	0.79	66%	0.656	S	S	*	*			trans	-59.1	86.2	158.7	-84	177.7	-18.9	0	0	105.9	K269	Q267-K269 PolarHBondContact O-N 3Å
268	D	51.1	Low	62.9	Low	130 Å²	130	120.5 Å²	120.5	70%	0.695	64%	0.635	S	S	*	*			trans	-57.2	100.6	156.5	-89.4	-17.5	0	0	0	104.3	E266 L270	E266-D268 PolarHBondContact O-N 2.67Å; D268-L270 PolarHBondContact O-N 3.17Å
269	K	45.3	Very low	63.6	Low	185 Å²	185	115.5 Å²	115.5	80%	0.804	62%	0.617	S	S	*	*			trans	-60.5	83.4	161.6	-74.8	179.8	177.8	176.9	0	105	Q267 D271	Q267-K269 PolarHBondContact O-N 3Å; K269-D271 PolarHBondContact O-N 2.76Å
270	L	50.9	Low	64.4	Low	148 Å²	148	115.7 Å²	115.7	78%	0.775	60%	0.604	S	S	*	*			trans	-50.1	110.5	166.8	-87.1	143.7	0	0	0	105.6	D268 T272	D268-L270 PolarHBondContact O-N 3.17Å; L270-T272 VanDerWaalsContact C-N 3.27Å; L270-T272 PolarHBondContact O-N 3.16Å; L270-T272 PolarHBondContact O-OG1 2.59Å
271	D	48.4	Very low	65.1	Low	125 Å²	125	111.5 Å²	111.5	67%	0.668	58%	0.584	S	S	*	*			trans	-55.9	95.8	179.9	-87.5	-33.2	0	0	0	107.8	K269 S273 V274	K269-D271 PolarHBondContact O-N 2.76Å; D271-S273 PolarHBondContact O-N 2.9Å; D271-V274 PolarHBondContact O-N 2.79Å; D271-V274 VanDerWaalsContact O-N 3.16Å
272	T	54.5	Low	66.1	Low	86 Å²	86	100.7 Å²	100.7	53%	0.528	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-3	-177.6	-33.8	0	0	0	0	111.6	L270	L270-T272 VanDerWaalsContact C-N 3.27Å; L270-T272 PolarHBondContact O-N 3.16Å; L270-T272 PolarHBondContact O-OG1 2.59Å
273	S	59.9	Low	67.1	Low	95 Å²	95	100 Å²	100	66%	0.664	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-29	176.6	72.1	0	0	0	0	113.4	D271 K275	D271-S273 PolarHBondContact O-N 2.9Å; S273-K275 PolarHBondContact O-N 2.87Å; S273-K275 VanDerWaalsContact O-N 3.15Å
274	V	66.8	Low	68.4	Low	74 Å²	74	90.2 Å²	90.2	45%	0.448	48%	0.481	S	S	.	.			trans	-82.8	100.3	-178.1	-174.2	0	0	0	0	108.8	D271 L276 N611	D271-V274 PolarHBondContact O-N 2.79Å; D271-V274 VanDerWaalsContact O-N 3.16Å; V274-L276 WeakPolarHBondContact CG1-O 3.35Å; V274-N611 PolarHBondContact O-ND2 2.96Å
275	K	79.4	Confident	69.7	Low	75 Å²	75	93.8 Å²	93.8	33%	0.326	48%	0.481	S	S	.	.	S	Bend	trans	-78.6	-29.4	179.8	-61	-171.1	-169.2	172.9	0	112.9	S273 V573 A574 N611 L614	S273-K275 PolarHBondContact O-N 2.87Å; S273-K275 VanDerWaalsContact O-N 3.15Å; K275-V573 HydrophobicContact CD-CG1 3.36Å; K275-V573 WeakPolarHBondContact CD-O 3.34Å; K275-V573 PolarHBondContact NZ-O 3.14Å; K275-A574 HydrophobicContact CB-CB 4.16Å; K275-N611 PolarHBondContact O-N 2.56Å; K275-L614 HydrophobicContact CB-CD1 3.66Å; K275-L614 HydrophobicContact CD-CD1 3.96Å; K275-L614 HydrophobicContact CG-CD1 3.89Å
276	L	85.3	Confident	71	Confident	21 Å²	21	90 Å²	90	11%	0.11	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.4	176.4	-73.6	175.8	0	0	0	108.8	V274 L560 L562 A574 D609 V610	V274-L276 WeakPolarHBondContact CG1-O 3.35Å; L276-L560 HydrophobicContact CD1-CD2 4.49Å; L276-L562 HydrophobicContact CD1-CB 4.03Å; L276-L562 HydrophobicContact CD1-CD2 4.38Å; L276-L562 HydrophobicContact CD2-CD2 3.99Å; L276-L562 HydrophobicContact CG-CD2 4.11Å; L276-A574 HydrophobicContact CD1-CB 3.69Å; L276-A574 HydrophobicContact CG-CB 4Å; L276-D609 WeakPolarHBondContact CA-O 3.36Å; L276-V610 HydrophobicContact CD2-CB 4.3Å; L276-V610 HydrophobicContact CD2-CG1 4.46Å; L276-V610 HydrophobicContact CD2-CG2 3.71Å
277	S	86	Confident	72.3	Confident	53 Å²	53	84.2 Å²	84.2	37%	0.371	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.1	173.9	70	0	0	0	0	110.6	N279 Y608 D609	S277-N279 PolarHBondContact O-N 2.94Å; S277-Y608 CarbonylContact O-C 3.54Å; S277-Y608 VanDerWaalsContact O-CA 3.31Å; S277-Y608 WeakPolarHBondContact O-CA 3.3Å; S277-D609 PolarHBondContact N-O 3.5Å; S277-D609 PolarHBondContact O-N 2.86Å
278	L	87	Confident	73.9	Confident	72 Å²	72	76.2 Å²	76.2	38%	0.377	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	115.5	173.7	178	67.2	0	0	0	108.5	W606 Y608	L278-W606 HydrophobicContact CD1-CB 4.07Å; L278-W606 HydrophobicContact CD1-CG 4.43Å; L278-Y608 HydrophobicContact CB-CD1 4.08Å; L278-Y608 HydrophobicContact CB-CE1 3.95Å; L278-Y608 HydrophobicContact CD1-CD1 3.86Å; L278-Y608 HydrophobicContact CD1-CE1 3.45Å; L278-Y608 VanDerWaalsContact CD1-CE1 3.45Å; L278-Y608 HydrophobicContact CG-CE1 4.25Å
279	N	83.8	Confident	75.3	Confident	71 Å²	71	77 Å²	77	38%	0.38	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-56.6	177.5	-168.2	-25.3	0	0	0	110.1	S277 A607 D609	S277-N279 PolarHBondContact O-N 2.94Å; N279-A607 WeakPolarHBondContact CB-O 3.45Å; N279-A607 PolarHBondContact N-O 2.85Å; N279-D609 HydrophobicContact CB-CB 4.44Å
280	R	84.3	Confident	77	Confident	65 Å²	65	69.5 Å²	69.5	25%	0.245	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.7	-177.2	-62.9	-171.2	-170.6	-175.5	8.6	112.5	F282 G329 K330 F331 A607	R280-F282 HydrophobicContact CB-CZ 4.41Å; R280-G329 PolarHBondContact NH1-O 3.4Å; R280-K330 PolarHBondContact NH1-O 3.27Å; R280-F331 PolarHBondContact NH1-O 2.86Å; R280-A607 PolarHBondContact N-O 3.43Å; R280-A607 PolarHBondContact O-N 3.35Å
281	C	88.2	Confident	78.8	Confident	41 Å²	41	62.6 Å²	62.6	28%	0.277	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.4	165.2	-179.2	0	0	0	0	108.6	I605	C281-I605 CarbonylContact C-O 3.58Å; C281-I605 VanDerWaalsContact CA-O 3.28Å; C281-I605 WeakPolarHBondContact CA-O 3.39Å
282	F	88.3	Confident	80.8	Confident	14 Å²	14	58.7 Å²	58.7	6%	0.061	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.1	171.9	-54.9	-81.2	0	0	0	108.9	R280 M306 W327 I605 A607	R280-F282 HydrophobicContact CB-CZ 4.41Å; F282-M306 HydrophobicContact CD2-CE 3.74Å; F282-M306 HydrophobicContact CE2-CE 3.86Å; F282-M306 HydrophobicContact CG-CE 4.4Å; F282-W327 HydrophobicContact CB-CD2 3.85Å; F282-W327 HydrophobicContact CB-CE3 3.75Å; F282-W327 HydrophobicContact CB-CG 4.43Å; F282-W327 HydrophobicContact CB-CH2 4.24Å; F282-W327 HydrophobicContact CB-CZ2 4.38Å; F282-W327 HydrophobicContact CB-CZ3 3.94Å; F282-W327 HydrophobicContact CD1-CB 4.34Å; F282-W327 HydrophobicContact CD1-CD2 4.11Å; F282-W327 AromaticContact CD1-CE3 3.56Å; F282-W327 HydrophobicContact CD1-CE3 3.56Å; F282-W327 HydrophobicContact CD1-CG 4.45Å; F282-W327 HydrophobicContact CD1-CZ3 4.18Å; F282-W327 HydrophobicContact CG-CD2 4.17Å; F282-W327 AromaticContact CG-CE3 3.98Å; F282-W327 HydrophobicContact CG-CE3 3.98Å; F282-W327 HydrophobicContact CG-CG 4.43Å; F282-I605 HydrophobicContact CB-CB 4.19Å; F282-I605 HydrophobicContact CB-CD1 4.1Å; F282-I605 HydrophobicContact CD2-CB 4.32Å; F282-I605 HydrophobicContact CD2-CG2 4.24Å; F282-I605 PolarHBondContact N-O 2.81Å; F282-I605 PolarHBondContact O-N 3.48Å; F282-A607 HydrophobicContact CE2-CB 4.05Å
283	Y	88.3	Confident	82.7	Confident	62 Å²	62	54.6 Å²	54.6	24%	0.243	29%	0.294	C	S	.	.			trans	-158.3	122.2	179.7	179.6	-103.3	0	0	0	109.7	E285 S288 R289 N334 K604	Y283-E285 HydrophobicContact CE1-CB 4.39Å; Y283-S288 WeakPolarHBondContact CD2-OG 3.32Å; Y283-S288 WeakPolarHBondContact CE2-OG 3.45Å; Y283-R289 WeakPolarHBondContact OH-CB 3.4Å; Y283-N334 WeakPolarHBondContact O-CB 3.49Å; Y283-K604 HydrophobicContact CD2-CB 4.45Å; Y283-K604 HydrophobicContact CD2-CG 3.44Å; Y283-K604 VanDerWaalsContact CD2-CG 3.44Å; Y283-K604 HydrophobicContact CE2-CG 4.1Å; Y283-K604 HydrophobicContact CG-CG 3.93Å
284	D	85.8	Confident	84.2	Confident	24 Å²	24	50.7 Å²	50.7	13%	0.128	27%	0.266	C	S	.	.			trans	-111.5	122	171.3	-178.7	-4.5	0	0	0	108.9	S286 L287 S288 W327	D284-S286 PolarHBondContact O-N 2.65Å; D284-S286 PolarHBondContact OD1-N 2.86Å; D284-S286 VanDerWaalsContact OD1-N 3.07Å; D284-S286 PolarHBondContact OD1-OG 3.32Å; D284-S286 PolarHBondContact OD2-OG 2.76Å; D284-L287 HydrophobicContact CB-CB 4.34Å; D284-L287 PolarHBondContact O-N 3.05Å; D284-L287 WeakPolarHBondContact OD2-CD1 3.44Å; D284-S288 PolarHBondContact N-OG 3.49Å; D284-S288 WeakPolarHBondContact O-CB 3.33Å; D284-S288 PolarHBondContact O-N 2.87Å; D284-S288 PolarHBondContact O-OG 2.91Å; D284-W327 HydrophobicContact CB-CH2 3.98Å
285	E	80.5	Confident	85.5	Confident	136 Å²	136	48.6 Å²	48.6	64%	0.636	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.4	-177.6	-174.5	175.4	-173.9	0	0	112.5	Y283 R289	Y283-E285 HydrophobicContact CE1-CB 4.39Å; E285-R289 VanDerWaalsContact O-CB 3.25Å; E285-R289 WeakPolarHBondContact O-CB 3.49Å
286	S	79.5	Confident	86.2	Confident	83 Å²	83	45.3 Å²	45.3	58%	0.58	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-39.7	-176	65.7	0	0	0	0	112.9	D284	D284-S286 PolarHBondContact O-N 2.65Å; D284-S286 PolarHBondContact OD1-N 2.86Å; D284-S286 VanDerWaalsContact OD1-N 3.07Å; D284-S286 PolarHBondContact OD1-OG 3.32Å; D284-S286 PolarHBondContact OD2-OG 2.76Å
287	L	79.8	Confident	86.7	Confident	40 Å²	40	46.2 Å²	46.2	21%	0.209	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-36.5	-170.9	-68.2	178.1	0	0	0	113.2	D284 R291 L323 P336 C339	D284-L287 HydrophobicContact CB-CB 4.34Å; D284-L287 PolarHBondContact O-N 3.05Å; D284-L287 WeakPolarHBondContact OD2-CD1 3.44Å; L287-R291 WeakPolarHBondContact O-CD 3.1Å; L287-R291 PolarHBondContact O-NE 2.86Å; L287-L323 HydrophobicContact CB-CD2 4.1Å; L287-L323 WeakPolarHBondContact O-CD2 3.37Å; L287-P336 HydrophobicContact CD1-CG 3.71Å; L287-C339 HydrophobicContact CD1-CB 4.44Å
288	S	77.7	Confident	87	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-15.2	-169.3	68.9	0	0	0	0	114.4	Y283 D284 G290 R291 G603	Y283-S288 WeakPolarHBondContact CD2-OG 3.32Å; Y283-S288 WeakPolarHBondContact CE2-OG 3.45Å; D284-S288 PolarHBondContact N-OG 3.49Å; D284-S288 WeakPolarHBondContact O-CB 3.33Å; D284-S288 PolarHBondContact O-N 2.87Å; D284-S288 PolarHBondContact O-OG 2.91Å; S288-G290 PolarHBondContact O-N 3.44Å; S288-R291 PolarHBondContact O-N 3.36Å; S288-R291 VanDerWaalsContact O-N 3.15Å; S288-G603 WeakPolarHBondContact CB-O 3.28Å; S288-G603 WeakPolarHBondContact O-CA 3.36Å
289	R	81.4	Confident	87.2	Confident	145 Å²	145	41.7 Å²	41.7	55%	0.547	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	121.8	-175.5	-178	175.4	176.8	174.5	-0.2	112	Y283 E285 R291 N313	Y283-R289 WeakPolarHBondContact OH-CB 3.4Å; E285-R289 VanDerWaalsContact O-CB 3.25Å; E285-R289 WeakPolarHBondContact O-CB 3.49Å; R289-R291 PolarHBondContact O-N 3.15Å; R289-N313 PolarHBondContact O-ND2 2.64Å; R289-N313 VanDerWaalsContact O-ND2 3.15Å
290	G	81.6	Confident	87.4	Confident	29 Å²	29	43 Å²	43	30%	0.299	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	9	175.8	0	0	0	0	0	114.7	S288	S288-G290 PolarHBondContact O-N 3.44Å
291	R	88.8	Confident	87.5	Confident	2 Å²	2	44 Å²	44	1%	0.008	23%	0.234	C	C	.	.			trans	-99.8	128.3	178	-62.9	-174.3	-173.8	-115.7	4.9	110.8	L287 S288 R289 Y310 D311 N313 D319 P320 D601 G603	L287-R291 WeakPolarHBondContact O-CD 3.1Å; L287-R291 PolarHBondContact O-NE 2.86Å; S288-R291 PolarHBondContact O-N 3.36Å; S288-R291 VanDerWaalsContact O-N 3.15Å; R289-R291 PolarHBondContact O-N 3.15Å; R291-Y310 HydrophobicContact CB-CD1 3.78Å; R291-Y310 HydrophobicContact CB-CG 4.32Å; R291-D311 WeakPolarHBondContact CD-O 3.5Å; R291-D311 WeakPolarHBondContact CG-O 3.33Å; R291-D311 PolarHBondContact NH1-O 3.39Å; R291-N313 HydrophobicContact CG-CB 3.86Å; R291-D319 IonicContact CZ-OD2 3.75Å; R291-D319 VanDerWaalsContact NH2-CB 3.31Å; R291-D319 IonicContact NH2-OD2 3.58Å; R291-D319 PolarHBondContact NH2-OD2 3.19Å; R291-P320 PolarHBondContact NH1-O 2.76Å; R291-D601 CarbonylContact C-O 3.47Å; R291-G603 WeakPolarHBondContact O-CA 3.1Å; R291-G603 PolarHBondContact O-N 3.23Å
292	V	90.5	Very high	87.4	Confident	43 Å²	43	46.6 Å²	46.6	26%	0.261	24%	0.239	S	C	.	.			trans	-70.9	133.3	175.3	177.7	0	0	0	0	110.5	N294 Y310 D311 K585 D601	V292-N294 PolarHBondContact O-N 3.3Å; V292-Y310 CarbonylContact O-C 3.58Å; V292-Y310 WeakPolarHBondContact O-CA 3.32Å; V292-D311 HydrophobicContact CB-CB 4.24Å; V292-D311 PolarHBondContact O-N 3.32Å; V292-K585 HydrophobicContact CG1-CD 3.87Å; V292-D601 WeakPolarHBondContact CA-O 3.21Å; V292-D601 HydrophobicContact CG2-CB 4.19Å; V292-D601 PolarHBondContact N-O 3.23Å
293	V	93.4	Very high	87.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	111.2	170.9	-176.5	0	0	0	0	109.4	I296 V308 Y310 S586 G600 I605	V293-I296 HydrophobicContact CG1-CD1 3.99Å; V293-I296 HydrophobicContact CG1-CG1 3.74Å; V293-V308 HydrophobicContact CG1-CG1 3.49Å; V293-V308 VanDerWaalsContact CG1-CG1 3.49Å; V293-V308 HydrophobicContact CG2-CG1 4.39Å; V293-Y310 HydrophobicContact CG2-CD1 3.99Å; V293-Y310 HydrophobicContact CG2-CE1 3.6Å; V293-S586 WeakPolarHBondContact CG1-OG 3.21Å; V293-G600 PolarHBondContact N-O 2.75Å; V293-I605 HydrophobicContact CG2-CG1 4.09Å
294	N	92.7	Very high	87.2	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.07	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-45.9	-177.7	-73.8	-30.9	0	0	0	112.6	V292 A309 V346 L347 K585	V292-N294 PolarHBondContact O-N 3.3Å; N294-A309 PolarHBondContact N-O 3.25Å; N294-V346 PolarHBondContact ND2-O 3.42Å; N294-L347 WeakPolarHBondContact CB-O 3.28Å; N294-K585 PolarHBondContact OD1-NZ 3.12Å
295	C	93.2	Very high	87.4	Confident	30 Å²	30	48 Å²	48	20%	0.203	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	144.9	-173.7	-174.2	0	0	0	0	109.8	A309 L347 L349	C295-A309 HydrophobicContact CB-CB 4.38Å; C295-A309 PolarHBondContact O-N 2.93Å; C295-L347 WeakPolarHBondContact CB-O 3.24Å; C295-L349 HydrophobicContact CB-CB 4.34Å; C295-L349 PolarHBondContact SG-O 3.3Å
296	I	94.7	Very high	88	Confident	7 Å²	7	41.8 Å²	41.8	4%	0.036	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143	176.3	-59.2	178.2	0	0	0	105.8	V293 M306 A307 V308 S586 V588 V597 I605	V293-I296 HydrophobicContact CG1-CD1 3.99Å; V293-I296 HydrophobicContact CG1-CG1 3.74Å; I296-M306 HydrophobicContact CG2-CG 3.54Å; I296-M306 HydrophobicContact CG2-SD 3.51Å; I296-M306 VanDerWaalsContact CG2-SD 3.51Å; I296-A307 CarbonylContact C-O 3.51Å; I296-A307 WeakPolarHBondContact CA-O 3.26Å; I296-V308 HydrophobicContact CG1-CG1 4.23Å; I296-V308 HydrophobicContact CG1-CG2 4.21Å; I296-V308 HydrophobicContact CG2-CG2 4.32Å; I296-S586 WeakPolarHBondContact CD1-OG 3.26Å; I296-V588 HydrophobicContact CB-CG2 3.8Å; I296-V588 HydrophobicContact CG2-CB 4.37Å; I296-V588 HydrophobicContact CG2-CG2 4.11Å; I296-V588 VanDerWaalsContact O-CG2 3.24Å; I296-V588 WeakPolarHBondContact O-CG2 3.38Å; I296-V597 HydrophobicContact CD1-CG1 4.03Å; I296-I605 HydrophobicContact CD1-CG2 4.05Å
297	D	94.3	Very high	88.7	Confident	39 Å²	39	37.9 Å²	37.9	21%	0.209	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	143.8	170.7	-167.3	22.5	0	0	0	111	A307 T350 W351	D297-A307 PolarHBondContact N-O 2.92Å; D297-A307 PolarHBondContact O-N 3.13Å; D297-T350 VanDerWaalsContact OD2-CA 3.25Å; D297-T350 WeakPolarHBondContact OD2-CA 3.27Å; D297-W351 PolarHBondContact O-NE1 3.42Å; D297-W351 PolarHBondContact OD2-N 3.42Å
298	F	92.8	Very high	89.4	Confident	25 Å²	25	36 Å²	36	11%	0.11	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.2	177.6	-78.3	-78.2	0	0	0	110.8	M306 W351 V588 A590 V597	F298-M306 HydrophobicContact CD1-CB 4.03Å; F298-M306 HydrophobicContact CD1-CG 4.45Å; F298-M306 HydrophobicContact CE1-CB 3.86Å; F298-M306 HydrophobicContact CE1-CG 4.2Å; F298-M306 HydrophobicContact CE1-SD 4.38Å; F298-M306 HydrophobicContact CZ-CG 4.45Å; F298-M306 HydrophobicContact CZ-SD 4.21Å; F298-W351 VanDerWaalsContact C-CD1 3.49Å; F298-V588 HydrophobicContact CD2-CB 4.42Å; F298-V588 HydrophobicContact CD2-CG1 3.58Å; F298-V588 HydrophobicContact CE2-CB 4.29Å; F298-V588 HydrophobicContact CE2-CG1 3.89Å; F298-A590 HydrophobicContact CE2-CB 4.29Å; F298-A590 HydrophobicContact CZ-CB 4.21Å; F298-V597 HydrophobicContact CE2-CB 4.39Å; F298-V597 HydrophobicContact CE2-CG2 4.13Å; F298-V597 HydrophobicContact CZ-CB 4.25Å; F298-V597 HydrophobicContact CZ-CG2 3.57Å
299	S	91.4	Very high	90.2	Very high	6 Å²	6	35.9 Å²	35.9	4%	0.042	19%	0.188	C	C	.	.			trans	-74.7	136.9	172	125.1	0	0	0	0	110.2	Q301 Y302 L305	S299-Q301 VanDerWaalsContact C-N 3.34Å; S299-Q301 PolarHBondContact OG-N 3.01Å; S299-Y302 WeakPolarHBondContact CB-O 3.09Å; S299-Y302 WeakPolarHBondContact OG-CA 3.4Å; S299-Y302 WeakPolarHBondContact OG-CB 3.42Å; S299-Y302 PolarHBondContact OG-N 3.39Å; S299-Y302 PolarHBondContact OG-O 3.5Å; S299-L305 PolarHBondContact N-O 3.22Å
300	V	87	Confident	90.8	Very high	99 Å²	99	29 Å²	29	60%	0.6	16%	0.162	S	C	*	.	S	Bend	trans	-72.1	-30	179.8	-178.6	0	0	0	0	111.9	K353	V300-K353 HydrophobicContact CG2-CG 4.36Å
301	Q	87	Confident	91.1	Very high	84 Å²	84	28.9 Å²	28.9	39%	0.393	16%	0.155	S	C	.	.	S	Bend	trans	-91.3	-39.7	-174	-58	-168.4	11.4	0	0	112.3	S299 F354 P356	S299-Q301 VanDerWaalsContact C-N 3.34Å; S299-Q301 PolarHBondContact OG-N 3.01Å; Q301-F354 VanDerWaalsContact NE2-C 3.32Å; Q301-F354 PolarHBondContact NE2-O 3.5Å; Q301-P356 HydrophobicContact CB-CB 4.28Å; Q301-P356 HydrophobicContact CG-CB 4.43Å
302	Y	87.4	Confident	90.8	Very high	97 Å²	97	29.5 Å²	29.5	38%	0.38	16%	0.162	S	C	.	.			trans	-114.2	93.1	175.3	-58.9	-59.5	0	0	0	108.4	S299 E304 L305 P356	S299-Y302 WeakPolarHBondContact CB-O 3.09Å; S299-Y302 WeakPolarHBondContact OG-CA 3.4Å; S299-Y302 WeakPolarHBondContact OG-CB 3.42Å; S299-Y302 PolarHBondContact OG-N 3.39Å; S299-Y302 PolarHBondContact OG-O 3.5Å; Y302-E304 VanDerWaalsContact C-OE2 3.25Å; Y302-E304 WeakPolarHBondContact CA-OE2 3.49Å; Y302-E304 WeakPolarHBondContact CB-OE2 3.47Å; Y302-E304 PolarHBondContact O-N 2.96Å; Y302-L305 HydrophobicContact CD2-CD1 3.97Å; Y302-L305 HydrophobicContact CG-CD1 4.16Å; Y302-L305 PolarHBondContact O-N 3.19Å; Y302-L305 VanDerWaalsContact O-N 3.07Å; Y302-P356 HydrophobicContact CD2-CB 4.22Å; Y302-P356 HydrophobicContact CE2-CB 3.65Å
303	P	85.6	Confident	90.3	Very high	90 Å²	90	28.8 Å²	28.8	58%	0.584	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.4	-176	27.4	-35.1	0	0	0	112.8	L305	P303-L305 VanDerWaalsContact C-N 3.29Å
304	E	86.1	Confident	89.6	Confident	38 Å²	38	33.9 Å²	33.9	18%	0.178	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.3	174.6	76.7	-79.5	-166.7	0	0	113.4	R249 Y302 N328 G329 K330	R249-E304 IonicContact NH1-OE1 3.23Å; R249-E304 PolarHBondContact NH1-OE1 2.93Å; Y302-E304 VanDerWaalsContact C-OE2 3.25Å; Y302-E304 WeakPolarHBondContact CA-OE2 3.49Å; Y302-E304 WeakPolarHBondContact CB-OE2 3.47Å; Y302-E304 PolarHBondContact O-N 2.96Å; E304-N328 WeakPolarHBondContact CG-OD1 3.37Å; E304-N328 CarbonylContact O-C 3.53Å; E304-N328 WeakPolarHBondContact O-CA 3.47Å; E304-G329 PolarHBondContact O-N 2.95Å; E304-K330 HydrophobicContact CB-CG 4.07Å
305	L	90.3	Very high	88.8	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123.7	-177.3	-63.6	-177.1	0	0	0	111	S299 Y302 P303 I326 N328 W351 M373	S299-L305 PolarHBondContact N-O 3.22Å; Y302-L305 HydrophobicContact CD2-CD1 3.97Å; Y302-L305 HydrophobicContact CG-CD1 4.16Å; Y302-L305 PolarHBondContact O-N 3.19Å; Y302-L305 VanDerWaalsContact O-N 3.07Å; P303-L305 VanDerWaalsContact C-N 3.29Å; L305-I326 HydrophobicContact CB-CG2 4.34Å; L305-I326 HydrophobicContact CD2-CG2 4.08Å; L305-N328 HydrophobicContact CD2-CB 4.04Å; L305-W351 HydrophobicContact CB-CZ2 4.25Å; L305-W351 HydrophobicContact CD1-CH2 4.41Å; L305-M373 HydrophobicContact CD1-CE 4.08Å
306	M	93.1	Very high	87.7	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.7	176.2	177.8	-179.2	62.5	0	0	108.8	F282 I296 F298 V308 I326 W327 V597 I605	F282-M306 HydrophobicContact CD2-CE 3.74Å; F282-M306 HydrophobicContact CE2-CE 3.86Å; F282-M306 HydrophobicContact CG-CE 4.4Å; I296-M306 HydrophobicContact CG2-CG 3.54Å; I296-M306 HydrophobicContact CG2-SD 3.51Å; I296-M306 VanDerWaalsContact CG2-SD 3.51Å; F298-M306 HydrophobicContact CD1-CB 4.03Å; F298-M306 HydrophobicContact CD1-CG 4.45Å; F298-M306 HydrophobicContact CE1-CB 3.86Å; F298-M306 HydrophobicContact CE1-CG 4.2Å; F298-M306 HydrophobicContact CE1-SD 4.38Å; F298-M306 HydrophobicContact CZ-CG 4.45Å; F298-M306 HydrophobicContact CZ-SD 4.21Å; M306-V308 HydrophobicContact CE-CG2 3.98Å; M306-V308 HydrophobicContact CG-CG2 3.97Å; M306-V308 HydrophobicContact SD-CG2 4.22Å; M306-I326 CarbonylContact O-C 3.4Å; M306-I326 WeakPolarHBondContact O-CA 3.4Å; M306-W327 HydrophobicContact CB-CB 4.5Å; M306-W327 HydrophobicContact CE-CB 3.77Å; M306-W327 HydrophobicContact CE-CG 4.09Å; M306-W327 PolarHBondContact N-O 2.97Å; M306-W327 PolarHBondContact O-N 2.86Å; M306-V597 HydrophobicContact CE-CG1 4.37Å; M306-V597 HydrophobicContact SD-CB 4.21Å; M306-V597 HydrophobicContact SD-CG1 3.58Å; M306-V597 VanDerWaalsContact SD-CG1 3.58Å; M306-V597 HydrophobicContact SD-CG2 4.23Å; M306-I605 HydrophobicContact CE-CD1 4.19Å; M306-I605 HydrophobicContact CE-CG2 3.94Å; M306-I605 HydrophobicContact SD-CG2 4.36Å
307	A	94.3	Very high	86.6	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	139	172.9	0	0	0	0	0	109.8	I296 D297 I326 L349 W351 L359	I296-A307 CarbonylContact C-O 3.51Å; I296-A307 WeakPolarHBondContact CA-O 3.26Å; D297-A307 PolarHBondContact N-O 2.92Å; D297-A307 PolarHBondContact O-N 3.13Å; A307-I326 HydrophobicContact CB-CG1 4.3Å; A307-L349 HydrophobicContact CB-CD2 3.51Å; A307-L349 HydrophobicContact CB-CG 4.47Å; A307-W351 HydrophobicContact CB-CZ2 3.94Å; A307-L359 HydrophobicContact CB-CD1 3.77Å; A307-L359 HydrophobicContact CB-CD2 4.16Å
308	V	94.5	Very high	85.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.1	-174.9	-177.1	0	0	0	0	109.7	V293 I296 M306 Y310 V324 T325 I605	V293-V308 HydrophobicContact CG1-CG1 3.49Å; V293-V308 VanDerWaalsContact CG1-CG1 3.49Å; V293-V308 HydrophobicContact CG2-CG1 4.39Å; I296-V308 HydrophobicContact CG1-CG1 4.23Å; I296-V308 HydrophobicContact CG1-CG2 4.21Å; I296-V308 HydrophobicContact CG2-CG2 4.32Å; M306-V308 HydrophobicContact CE-CG2 3.98Å; M306-V308 HydrophobicContact CG-CG2 3.97Å; M306-V308 HydrophobicContact SD-CG2 4.22Å; V308-Y310 HydrophobicContact CB-CE2 3.95Å; V308-Y310 HydrophobicContact CG1-CD2 4.05Å; V308-Y310 HydrophobicContact CG1-CE2 3.55Å; V308-V324 CarbonylContact O-C 3.51Å; V308-V324 WeakPolarHBondContact O-CA 3.3Å; V308-T325 PolarHBondContact N-O 2.74Å; V308-T325 PolarHBondContact O-N 3.03Å; V308-I605 HydrophobicContact CB-CD1 4.25Å; V308-I605 HydrophobicContact CG1-CD1 3.99Å; V308-I605 HydrophobicContact CG1-CG1 4.47Å; V308-I605 HydrophobicContact CG2-CD1 3.71Å
309	A	94.3	Very high	85	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.6	173.6	0	0	0	0	0	110.6	N294 C295 V346 L349	N294-A309 PolarHBondContact N-O 3.25Å; C295-A309 HydrophobicContact CB-CB 4.38Å; C295-A309 PolarHBondContact O-N 2.93Å; A309-V346 HydrophobicContact CB-CB 4.13Å; A309-V346 HydrophobicContact CB-CG1 3.76Å; A309-L349 HydrophobicContact CB-CB 4.07Å; A309-L349 HydrophobicContact CB-CD2 4.28Å
310	Y	92.8	Very high	84.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.1	176.5	-68.7	-90.5	0	0	0	110.8	R291 V292 V293 V308 L323 T325 W327 I605	R291-Y310 HydrophobicContact CB-CD1 3.78Å; R291-Y310 HydrophobicContact CB-CG 4.32Å; V292-Y310 CarbonylContact O-C 3.58Å; V292-Y310 WeakPolarHBondContact O-CA 3.32Å; V293-Y310 HydrophobicContact CG2-CD1 3.99Å; V293-Y310 HydrophobicContact CG2-CE1 3.6Å; V308-Y310 HydrophobicContact CB-CE2 3.95Å; V308-Y310 HydrophobicContact CG1-CD2 4.05Å; V308-Y310 HydrophobicContact CG1-CE2 3.55Å; Y310-L323 HydrophobicContact CD2-CD2 4.24Å; Y310-L323 HydrophobicContact CD2-CG 4.48Å; Y310-L323 HydrophobicContact CG-CD2 4.44Å; Y310-L323 PolarHBondContact N-O 3.17Å; Y310-T325 HydrophobicContact CD2-CG2 4.19Å; Y310-T325 HydrophobicContact CE2-CG2 3.97Å; Y310-T325 VanDerWaalsContact CE2-OG1 3.25Å; Y310-T325 WeakPolarHBondContact CE2-OG1 3.49Å; Y310-W327 PolarHBondContact OH-NE1 3.07Å; Y310-I605 WeakPolarHBondContact OH-CD1 3.21Å
311	D	88.5	Confident	84.4	Confident	26 Å²	26	56.8 Å²	56.8	14%	0.139	31%	0.31	C	S	.	.			trans	-76.2	174.4	167.5	-154.1	-3.5	0	0	0	111.7	R291 V292 I321 R345	R291-D311 WeakPolarHBondContact CD-O 3.5Å; R291-D311 WeakPolarHBondContact CG-O 3.33Å; R291-D311 PolarHBondContact NH1-O 3.39Å; V292-D311 HydrophobicContact CB-CB 4.24Å; V292-D311 PolarHBondContact O-N 3.32Å; D311-I321 CarbonylContact C-O 3.54Å; D311-R345 WeakPolarHBondContact OD1-CB 3.4Å; D311-R345 WeakPolarHBondContact OD1-CD 3.22Å; D311-R345 WeakPolarHBondContact OD1-CG 3.36Å; D311-R345 IonicContact OD1-CZ 3.49Å; D311-R345 IonicContact OD1-NE 2.65Å; D311-R345 IonicContact OD1-NH1 2.9Å; D311-R345 PolarHBondContact OD1-NH1 2.85Å; D311-R345 IonicContact OD2-NH1 2.59Å; D311-R345 PolarHBondContact OD2-NH1 2.84Å; D311-R345 VanDerWaalsContact OD2-NH1 3.09Å
312	G	82.9	Confident	84.3	Confident	16 Å²	16	52.8 Å²	52.8	17%	0.165	29%	0.292	C	S	.	.			trans	-69.7	136.5	173	0	0	0	0	0	110.9	P314 I321	G312-P314 WeakPolarHBondContact O-CD 3.27Å; G312-I321 WeakPolarHBondContact CA-O 3.4Å; G312-I321 PolarHBondContact N-O 3.48Å
313	N	80.9	Confident	84.5	Confident	28 Å²	28	48.2 Å²	48.2	15%	0.15	27%	0.273	C	S	.	.			trans	-70.1	123.8	172	-174.5	-7	0	0	0	108.9	R289 R291 D315	R289-N313 PolarHBondContact O-ND2 2.64Å; R289-N313 VanDerWaalsContact O-ND2 3.15Å; R291-N313 HydrophobicContact CG-CB 3.86Å; N313-D315 PolarHBondContact O-N 3.45Å; N313-D315 WeakPolarHBondContact OD1-CB 3.43Å; N313-D315 PolarHBondContact OD1-N 3.16Å
314	P	77.7	Confident	84.9	Confident	106 Å²	106	43.9 Å²	43.9	69%	0.688	25%	0.246	S	C	*	.	S	Bend	trans	-66.4	-25.5	175.2	27.2	-34.8	0	0	0	113.1	G312	G312-P314 WeakPolarHBondContact O-CD 3.27Å
315	D	75	Confident	85.2	Confident	134 Å²	134	42.1 Å²	42.1	72%	0.717	24%	0.237	S	C	*	.	S	Bend	trans	-84	-30.1	-171.3	-63.6	-27	0	0	0	113.2	N313	N313-D315 PolarHBondContact O-N 3.45Å; N313-D315 WeakPolarHBondContact OD1-CB 3.43Å; N313-D315 PolarHBondContact OD1-N 3.16Å
316	A	72.1	Confident	85.3	Confident	33 Å²	33	42 Å²	42	27%	0.273	24%	0.237	S	C	.	.			trans	-110.6	94.9	-175.2	0	0	0	0	0	110.9	N318 D319	A316-N318 PolarHBondContact O-N 3.31Å; A316-D319 HydrophobicContact CB-CB 4.09Å; A316-D319 WeakPolarHBondContact O-CB 3.5Å; A316-D319 PolarHBondContact O-N 3.05Å
317	M	70.9	Confident	85.2	Confident	180 Å²	180	42 Å²	42	89%	0.887	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.3	-178.1	-64.3	-172.7	74.4	0	0	114.5	D319	M317-D319 VanDerWaalsContact C-N 3.35Å
318	N	75.8	Confident	84.9	Confident	163 Å²	163	42.2 Å²	42.2	87%	0.872	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11	-177.8	-70	-8	0	0	0	113.2	A316	A316-N318 PolarHBondContact O-N 3.31Å
319	D	78.3	Confident	84.4	Confident	58 Å²	58	43.7 Å²	43.7	31%	0.31	25%	0.253	S	S	.	.	S	Bend	trans	-76.2	148.2	-177.1	-92.5	14.8	0	0	0	111.4	R291 A316 M317 I321	R291-D319 IonicContact CZ-OD2 3.75Å; R291-D319 VanDerWaalsContact NH2-CB 3.31Å; R291-D319 IonicContact NH2-OD2 3.58Å; R291-D319 PolarHBondContact NH2-OD2 3.19Å; A316-D319 HydrophobicContact CB-CB 4.09Å; A316-D319 WeakPolarHBondContact O-CB 3.5Å; A316-D319 PolarHBondContact O-N 3.05Å; M317-D319 VanDerWaalsContact C-N 3.35Å; D319-I321 PolarHBondContact O-N 3.38Å
320	P	80.3	Confident	83.7	Confident	46 Å²	46	47.6 Å²	47.6	30%	0.299	27%	0.27	S	S	.	.			trans	-60.4	130.5	175.4	22.7	-29.4	0	0	0	110.1	R291 G322 H341	R291-P320 PolarHBondContact NH1-O 2.76Å; P320-G322 PolarHBondContact O-N 3.47Å; P320-H341 HydrophobicContact CB-CB 3.98Å; P320-H341 HydrophobicContact CG-CB 4.37Å; P320-H341 WeakPolarHBondContact CG-CD2 3.2Å
321	I	85.6	Confident	83	Confident	87 Å²	87	48.2 Å²	48.2	45%	0.446	27%	0.273	S	S	.	.	S	Bend	trans	-63.2	-43	-174	-60.9	172.9	0	0	0	111	D311 G312 D319 R345	D311-I321 CarbonylContact C-O 3.54Å; G312-I321 WeakPolarHBondContact CA-O 3.4Å; G312-I321 PolarHBondContact N-O 3.48Å; D319-I321 PolarHBondContact O-N 3.38Å; I321-R345 HydrophobicContact CG2-CB 4.41Å; I321-R345 HydrophobicContact CG2-CG 3.38Å
322	G	84.8	Confident	82.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.5	173.9	0	0	0	0	0	110.9	P320 H341 S342 S344	P320-G322 PolarHBondContact O-N 3.47Å; G322-H341 CarbonylContact O-C 3.5Å; G322-H341 WeakPolarHBondContact O-CA 3.37Å; G322-S342 PolarHBondContact N-O 3.38Å; G322-S342 PolarHBondContact O-N 3.2Å; G322-S344 WeakPolarHBondContact CA-O 3.31Å
323	L	90.9	Very high	82	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.5	177.8	178.1	74.4	0	0	0	109.2	L287 Y310 T325 C339	L287-L323 HydrophobicContact CB-CD2 4.1Å; L287-L323 WeakPolarHBondContact O-CD2 3.37Å; Y310-L323 HydrophobicContact CD2-CD2 4.24Å; Y310-L323 HydrophobicContact CD2-CG 4.48Å; Y310-L323 HydrophobicContact CG-CD2 4.44Å; Y310-L323 PolarHBondContact N-O 3.17Å; L323-T325 HydrophobicContact CD1-CG2 4.32Å; L323-T325 HydrophobicContact CD2-CG2 4Å; L323-T325 HydrophobicContact CG-CG2 3.94Å; L323-C339 WeakPolarHBondContact CD1-SG 3.34Å
324	V	93.3	Very high	82	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.7	174.3	178.8	0	0	0	0	107.8	V308 F340 V346 L349 L359 W371	V308-V324 CarbonylContact O-C 3.51Å; V308-V324 WeakPolarHBondContact O-CA 3.3Å; V324-F340 HydrophobicContact CB-CB 4.26Å; V324-F340 PolarHBondContact N-O 3.48Å; V324-F340 PolarHBondContact O-N 2.92Å; V324-V346 HydrophobicContact CG2-CB 4.12Å; V324-V346 HydrophobicContact CG2-CG1 4.01Å; V324-V346 HydrophobicContact CG2-CG2 3.85Å; V324-L349 HydrophobicContact CG1-CD1 3.77Å; V324-L349 HydrophobicContact CG1-CD2 3.83Å; V324-L349 HydrophobicContact CG1-CG 4.49Å; V324-L349 HydrophobicContact CG2-CD1 4.19Å; V324-L359 HydrophobicContact CG1-CD2 3.51Å; V324-W371 HydrophobicContact CG2-CH2 3.94Å; V324-W371 HydrophobicContact CG2-CZ2 4.23Å; V324-W371 HydrophobicContact CG2-CZ3 4.29Å
325	T	92.1	Very high	82.4	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	146.1	179.9	66.5	0	0	0	0	110.3	V308 Y310 L323 W327 P336 Y338	V308-T325 PolarHBondContact N-O 2.74Å; V308-T325 PolarHBondContact O-N 3.03Å; Y310-T325 HydrophobicContact CD2-CG2 4.19Å; Y310-T325 HydrophobicContact CE2-CG2 3.97Å; Y310-T325 VanDerWaalsContact CE2-OG1 3.25Å; Y310-T325 WeakPolarHBondContact CE2-OG1 3.49Å; L323-T325 HydrophobicContact CD1-CG2 4.32Å; L323-T325 HydrophobicContact CD2-CG2 4Å; L323-T325 HydrophobicContact CG-CG2 3.94Å; T325-W327 PolarHBondContact OG1-NE1 2.66Å; T325-P336 HydrophobicContact CG2-CB 4.38Å; T325-P336 HydrophobicContact CG2-CG 4.36Å; T325-Y338 CarbonylContact C-O 3.56Å; T325-Y338 VanDerWaalsContact CA-O 3.3Å; T325-Y338 WeakPolarHBondContact CA-O 3.29Å
326	I	93	Very high	83	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.1	170.5	-59.4	-179.4	0	0	0	108	L305 M306 A307 P336 E337 Y338 F340 W351 M373	L305-I326 HydrophobicContact CB-CG2 4.34Å; L305-I326 HydrophobicContact CD2-CG2 4.08Å; M306-I326 CarbonylContact O-C 3.4Å; M306-I326 WeakPolarHBondContact O-CA 3.4Å; A307-I326 HydrophobicContact CB-CG1 4.3Å; I326-P336 CarbonylContact O-C 3.58Å; I326-E337 PolarHBondContact O-N 3.06Å; I326-Y338 HydrophobicContact CB-CD2 4.23Å; I326-Y338 HydrophobicContact CD1-CD2 4.19Å; I326-Y338 HydrophobicContact CD1-CG 4.44Å; I326-Y338 HydrophobicContact CG2-CD2 4.43Å; I326-Y338 PolarHBondContact N-O 2.86Å; I326-Y338 PolarHBondContact O-N 2.84Å; I326-F340 HydrophobicContact CD1-CE2 3.72Å; I326-F340 HydrophobicContact CG1-CE2 4.25Å; I326-W351 HydrophobicContact CD1-CH2 3.84Å; I326-W351 HydrophobicContact CD1-CZ2 4.02Å; I326-W351 HydrophobicContact CG1-CZ2 4.41Å; I326-W351 HydrophobicContact CG2-CZ2 4.33Å; I326-M373 HydrophobicContact CD1-CE 3.66Å; I326-M373 HydrophobicContact CD1-CG 3.8Å; I326-M373 HydrophobicContact CD1-SD 3.68Å
327	W	91.5	Very high	83.6	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	147.5	173	-63.9	90.6	0	0	0	109.5	F282 D284 M306 Y310 T325 N334 P336	F282-W327 HydrophobicContact CB-CD2 3.85Å; F282-W327 HydrophobicContact CB-CE3 3.75Å; F282-W327 HydrophobicContact CB-CG 4.43Å; F282-W327 HydrophobicContact CB-CH2 4.24Å; F282-W327 HydrophobicContact CB-CZ2 4.38Å; F282-W327 HydrophobicContact CB-CZ3 3.94Å; F282-W327 HydrophobicContact CD1-CB 4.34Å; F282-W327 HydrophobicContact CD1-CD2 4.11Å; F282-W327 AromaticContact CD1-CE3 3.56Å; F282-W327 HydrophobicContact CD1-CE3 3.56Å; F282-W327 HydrophobicContact CD1-CG 4.45Å; F282-W327 HydrophobicContact CD1-CZ3 4.18Å; F282-W327 HydrophobicContact CG-CD2 4.17Å; F282-W327 AromaticContact CG-CE3 3.98Å; F282-W327 HydrophobicContact CG-CE3 3.98Å; F282-W327 HydrophobicContact CG-CG 4.43Å; D284-W327 HydrophobicContact CB-CH2 3.98Å; M306-W327 HydrophobicContact CB-CB 4.5Å; M306-W327 HydrophobicContact CE-CB 3.77Å; M306-W327 HydrophobicContact CE-CG 4.09Å; M306-W327 PolarHBondContact N-O 2.97Å; M306-W327 PolarHBondContact O-N 2.86Å; Y310-W327 PolarHBondContact OH-NE1 3.07Å; T325-W327 PolarHBondContact OG1-NE1 2.66Å; W327-N334 VanDerWaalsContact CH2-O 3.3Å; W327-N334 WeakPolarHBondContact CH2-O 3.44Å; W327-N334 WeakPolarHBondContact CZ3-O 3.49Å; W327-P336 HydrophobicContact CD2-CB 4.17Å; W327-P336 HydrophobicContact CE3-CB 4.28Å; W327-P336 HydrophobicContact CH2-CB 4.33Å; W327-P336 HydrophobicContact CH2-CG 4.43Å; W327-P336 HydrophobicContact CZ2-CB 4.17Å; W327-P336 HydrophobicContact CZ2-CG 4.41Å; W327-P336 HydrophobicContact CZ3-CB 4.37Å
328	N	88.1	Confident	84.5	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.6	173.8	-168.9	-39.1	0	0	0	108.3	R249 E304 L305 K330 F331 E337	R249-N328 PolarHBondContact NE-ND2 3.29Å; E304-N328 WeakPolarHBondContact CG-OD1 3.37Å; E304-N328 CarbonylContact O-C 3.53Å; E304-N328 WeakPolarHBondContact O-CA 3.47Å; L305-N328 HydrophobicContact CD2-CB 4.04Å; N328-K330 PolarHBondContact O-N 2.94Å; N328-K330 WeakPolarHBondContact OD1-CB 3.39Å; N328-K330 PolarHBondContact OD1-N 3.32Å; N328-F331 HydrophobicContact CB-CB 4.35Å; N328-F331 HydrophobicContact CB-CD2 3.35Å; N328-F331 HydrophobicContact CB-CE2 3.86Å; N328-F331 HydrophobicContact CB-CG 4.1Å; N328-F331 PolarHBondContact O-N 2.91Å; N328-E337 PolarHBondContact ND2-OE2 3.24Å; N328-E337 VanDerWaalsContact ND2-OE2 3.09Å
329	G	82.6	Confident	85.1	Confident	31 Å²	31	39.2 Å²	39.2	32%	0.32	21%	0.205	S	C	.	.	S	Bend	trans	-63.7	-23.2	178.8	0	0	0	0	0	113.7	R280 E304	R280-G329 PolarHBondContact NH1-O 3.4Å; E304-G329 PolarHBondContact O-N 2.95Å
330	K	81.6	Confident	85.8	Confident	82 Å²	82	36.7 Å²	36.7	36%	0.357	19%	0.191	S	C	.	.	S	Bend	trans	-76.6	-39.8	176.6	-64.7	-166.4	175.8	-164	0	111.6	A252 E253 R280 E304 N328 K332	A252-K330 VanDerWaalsContact CB-O 3.26Å; A252-K330 WeakPolarHBondContact CB-O 3.45Å; E253-K330 IonicContact OE1-NZ 3.52Å; E253-K330 PolarHBondContact OE1-NZ 3.27Å; R280-K330 PolarHBondContact NH1-O 3.27Å; E304-K330 HydrophobicContact CB-CG 4.07Å; N328-K330 PolarHBondContact O-N 2.94Å; N328-K330 WeakPolarHBondContact OD1-CB 3.39Å; N328-K330 PolarHBondContact OD1-N 3.32Å; K330-K332 PolarHBondContact O-N 2.74Å
331	F	77.9	Confident	86.3	Confident	14 Å²	14	36.1 Å²	36.1	6%	0.061	18%	0.184	C	C	.	.			trans	-58.8	129.8	-176.5	-77.1	-43.2	0	0	0	112.6	R245 E248 R249 R280 N328 K333 E337	R245-F331 HydrophobicContact CB-CZ 4.23Å; R245-F331 WeakPolarHBondContact O-CZ 3.48Å; E248-F331 HydrophobicContact CB-CD1 4.02Å; E248-F331 HydrophobicContact CB-CE1 3.36Å; E248-F331 HydrophobicContact CB-CZ 4.28Å; R249-F331 HydrophobicContact CB-CE1 4.4Å; R249-F331 HydrophobicContact CG-CD1 4.48Å; R249-F331 HydrophobicContact CG-CE1 3.67Å; R249-F331 HydrophobicContact CG-CE2 4.31Å; R249-F331 HydrophobicContact CG-CZ 3.57Å; R280-F331 PolarHBondContact NH1-O 2.86Å; N328-F331 HydrophobicContact CB-CB 4.35Å; N328-F331 HydrophobicContact CB-CD2 3.35Å; N328-F331 HydrophobicContact CB-CE2 3.86Å; N328-F331 HydrophobicContact CB-CG 4.1Å; N328-F331 PolarHBondContact O-N 2.91Å; F331-K333 VanDerWaalsContact C-N 3.3Å; F331-E337 HydrophobicContact CE2-CB 4.08Å; F331-E337 HydrophobicContact CE2-CG 3.86Å; F331-E337 WeakPolarHBondContact CE2-OE2 3.42Å
332	K	73.6	Confident	86.5	Confident	124 Å²	124	32.3 Å²	32.3	54%	0.539	17%	0.165	S	C	.	.			trans	-80.5	-12.2	174.5	-66.4	177.3	-177	167.3	0	113	K330	K330-K332 PolarHBondContact O-N 2.74Å
333	K	76.1	Confident	86.7	Confident	106 Å²	106	39.5 Å²	39.5	46%	0.461	20%	0.199	S	C	.	.	S	Bend	trans	-81.9	146.7	177.8	-66.1	178.6	-176.9	169.1	0	109.9	E248 F331 T335	E248-K333 IonicContact OE1-NZ 3.77Å; E248-K333 PolarHBondContact OE1-NZ 2.69Å; E248-K333 IonicContact OE2-NZ 2.77Å; E248-K333 PolarHBondContact OE2-NZ 3.48Å; F331-K333 VanDerWaalsContact C-N 3.3Å; K333-T335 PolarHBondContact O-N 3.35Å
334	N	81.4	Confident	86.7	Confident	99 Å²	99	40.5 Å²	40.5	53%	0.529	21%	0.206	S	C	.	.	S	Bend	trans	-81	13.1	176.1	-67.5	2	0	0	0	113.4	Y283 W327	Y283-N334 WeakPolarHBondContact O-CB 3.49Å; W327-N334 VanDerWaalsContact CH2-O 3.3Å; W327-N334 WeakPolarHBondContact CH2-O 3.44Å; W327-N334 WeakPolarHBondContact CZ3-O 3.49Å
335	T	85.5	Confident	86.7	Confident	75 Å²	75	45.9 Å²	45.9	46%	0.46	23%	0.226	S	C	.	.	S	Bend	trans	-98	136.9	179.7	54.2	0	0	0	0	110.4	K333	K333-T335 PolarHBondContact O-N 3.35Å
336	P	87.8	Confident	86.7	Confident	21 Å²	21	45.8 Å²	45.8	14%	0.136	23%	0.226	C	C	.	.			trans	-67.7	151.9	174.4	28.6	-33.8	0	0	0	111.4	L287 T325 I326 W327	L287-P336 HydrophobicContact CD1-CG 3.71Å; T325-P336 HydrophobicContact CG2-CB 4.38Å; T325-P336 HydrophobicContact CG2-CG 4.36Å; I326-P336 CarbonylContact O-C 3.58Å; W327-P336 HydrophobicContact CD2-CB 4.17Å; W327-P336 HydrophobicContact CE3-CB 4.28Å; W327-P336 HydrophobicContact CH2-CB 4.33Å; W327-P336 HydrophobicContact CH2-CG 4.43Å; W327-P336 HydrophobicContact CZ2-CB 4.17Å; W327-P336 HydrophobicContact CZ2-CG 4.41Å; W327-P336 HydrophobicContact CZ3-CB 4.37Å
337	E	84.8	Confident	86.7	Confident	9 Å²	9	47 Å²	47	4%	0.042	23%	0.232	C	C	.	.	S	Bend	trans	-75.9	-43.1	179.5	-169.3	179.3	157.1	0	0	112	R245 R249 I326 N328 F331	R245-E337 HydrophobicContact CG-CG 4.49Å; R245-E337 PolarHBondContact NH1-O 2.96Å; R245-E337 PolarHBondContact NH2-O 2.79Å; R249-E337 IonicContact CZ-OE1 3.72Å; R249-E337 IonicContact CZ-OE2 3.22Å; R249-E337 IonicContact NE-OE1 3.11Å; R249-E337 IonicContact NE-OE2 3.41Å; R249-E337 PolarHBondContact NE-OE2 3.02Å; R249-E337 IonicContact NH2-OE1 3.91Å; R249-E337 PolarHBondContact NH2-OE1 2.89Å; R249-E337 IonicContact NH2-OE2 3.83Å; R249-E337 PolarHBondContact NH2-OE2 2.83Å; I326-E337 PolarHBondContact O-N 3.06Å; N328-E337 PolarHBondContact ND2-OE2 3.24Å; N328-E337 VanDerWaalsContact ND2-OE2 3.09Å; F331-E337 HydrophobicContact CE2-CB 4.08Å; F331-E337 HydrophobicContact CE2-CG 3.86Å; F331-E337 WeakPolarHBondContact CE2-OE2 3.42Å
338	Y	88.5	Confident	86.8	Confident	44 Å²	44	47 Å²	47	17%	0.173	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.7	175	-59.8	-91.3	0	0	0	110.4	R245 T325 I326 F340 M373	R245-Y338 PolarHBondContact NH1-OH 2.98Å; T325-Y338 CarbonylContact C-O 3.56Å; T325-Y338 VanDerWaalsContact CA-O 3.3Å; T325-Y338 WeakPolarHBondContact CA-O 3.29Å; I326-Y338 HydrophobicContact CB-CD2 4.23Å; I326-Y338 HydrophobicContact CD1-CD2 4.19Å; I326-Y338 HydrophobicContact CD1-CG 4.44Å; I326-Y338 HydrophobicContact CG2-CD2 4.43Å; I326-Y338 PolarHBondContact N-O 2.86Å; I326-Y338 PolarHBondContact O-N 2.84Å; Y338-F340 HydrophobicContact CG-CZ 4.48Å; Y338-M373 HydrophobicContact CD2-CE 3.41Å; Y338-M373 VanDerWaalsContact CD2-CE 3.41Å; Y338-M373 HydrophobicContact CE2-CE 3.2Å; Y338-M373 HydrophobicContact CG-CE 4.31Å
339	C	90.3	Very high	87.1	Confident	18 Å²	18	47.1 Å²	47.1	12%	0.122	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	112.7	-179	-179.5	0	0	0	0	108.2	L287 L323 H341 R378	L287-C339 HydrophobicContact CD1-CB 4.44Å; L323-C339 WeakPolarHBondContact CD1-SG 3.34Å; C339-H341 PolarHBondContact SG-NE2 2.82Å; C339-H341 VanDerWaalsContact SG-NE2 3.35Å; C339-R378 WeakPolarHBondContact O-CG 3.49Å
340	F	92.4	Very high	87.7	Confident	5 Å²	5	46.1 Å²	46.1	2%	0.022	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	147.1	177.4	-56.6	-72	0	0	0	110.3	V324 I326 Y338 L359 W371 M373 R378	V324-F340 HydrophobicContact CB-CB 4.26Å; V324-F340 PolarHBondContact N-O 3.48Å; V324-F340 PolarHBondContact O-N 2.92Å; I326-F340 HydrophobicContact CD1-CE2 3.72Å; I326-F340 HydrophobicContact CG1-CE2 4.25Å; Y338-F340 HydrophobicContact CG-CZ 4.48Å; F340-L359 HydrophobicContact CD2-CD2 4.46Å; F340-W371 HydrophobicContact CB-CG 4.1Å; F340-W371 HydrophobicContact CD1-CB 4.15Å; F340-W371 AromaticContact CD1-CD1 3.77Å; F340-W371 HydrophobicContact CD1-CG 4.18Å; F340-W371 HydrophobicContact CD2-CB 4.35Å; F340-W371 HydrophobicContact CD2-CG 4.44Å; F340-W371 HydrophobicContact CE1-CB 4.28Å; F340-W371 HydrophobicContact CE2-CB 4.47Å; F340-W371 HydrophobicContact CG-CB 4.19Å; F340-W371 AromaticContact CG-CD1 3.75Å; F340-W371 AromaticContact CG-CG 4Å; F340-W371 HydrophobicContact CG-CG 4Å; F340-W371 HydrophobicContact CZ-CB 4.44Å; F340-M373 HydrophobicContact CE2-CG 4.47Å; F340-M373 HydrophobicContact CZ-CG 4.19Å; F340-R378 CarbonylContact C-O 3.58Å; F340-R378 VanDerWaalsContact CA-O 3.29Å; F340-R378 WeakPolarHBondContact CA-O 3.36Å
341	H	91.3	Very high	88.2	Confident	35 Å²	35	42.5 Å²	42.5	16%	0.162	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.2	-178.6	-50.4	96.7	0	0	0	109.6	P320 G322 C339 R378 P380	P320-H341 HydrophobicContact CB-CB 3.98Å; P320-H341 HydrophobicContact CG-CB 4.37Å; P320-H341 WeakPolarHBondContact CG-CD2 3.2Å; G322-H341 CarbonylContact O-C 3.5Å; G322-H341 WeakPolarHBondContact O-CA 3.37Å; C339-H341 PolarHBondContact SG-NE2 2.82Å; C339-H341 VanDerWaalsContact SG-NE2 3.35Å; H341-R378 PolarHBondContact N-O 2.77Å; H341-R378 VanDerWaalsContact ND1-CB 3.3Å; H341-R378 WeakPolarHBondContact ND1-CB 3.21Å; H341-P380 VanDerWaalsContact O-CD 3.23Å; H341-P380 WeakPolarHBondContact O-CD 3.35Å
342	S	89.5	Confident	88.8	Confident	7 Å²	7	42.1 Å²	42.1	5%	0.049	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.7	169.6	-173.5	0	0	0	0	109.7	G322 S344	G322-S342 PolarHBondContact N-O 3.38Å; G322-S342 PolarHBondContact O-N 3.2Å; S342-S344 VanDerWaalsContact CB-O 3.32Å; S342-S344 WeakPolarHBondContact CB-O 3.11Å; S342-S344 PolarHBondContact O-N 2.98Å; S342-S344 PolarHBondContact OG-N 3.45Å; S342-S344 PolarHBondContact OG-O 3.26Å
343	Q	88.8	Confident	89.4	Confident	150 Å²	150	40.1 Å²	40.1	70%	0.701	20%	0.196	S	C	*	.	S	Bend	trans	-70.9	-20.4	175.4	-71	170.5	-18.2	0	0	112.3
344	S	90.6	Very high	89.9	Confident	21 Å²	21	38.2 Å²	38.2	15%	0.147	19%	0.188	C	C	.	.	S	Bend	trans	-128	155.1	-177.3	-176.8	0	0	0	0	109.7	G322 S342 V346 S365	G322-S344 WeakPolarHBondContact CA-O 3.31Å; S342-S344 VanDerWaalsContact CB-O 3.32Å; S342-S344 WeakPolarHBondContact CB-O 3.11Å; S342-S344 PolarHBondContact O-N 2.98Å; S342-S344 PolarHBondContact OG-N 3.45Å; S342-S344 PolarHBondContact OG-O 3.26Å; S344-V346 PolarHBondContact O-N 2.86Å; S344-S365 VanDerWaalsContact CB-OG 3.31Å; S344-S365 WeakPolarHBondContact CB-OG 3.44Å; S344-S365 PolarHBondContact OG-N 3.27Å; S344-S365 PolarHBondContact OG-OG 2.81Å
345	R	92.4	Very high	90.2	Very high	113 Å²	113	36.9 Å²	36.9	43%	0.426	18%	0.178	S	C	.	.			trans	-57.8	133	-178.5	-56.5	171.7	176.5	-143.8	8.3	109.7	D311 I321 T363 Y364	D311-R345 WeakPolarHBondContact OD1-CB 3.4Å; D311-R345 WeakPolarHBondContact OD1-CD 3.22Å; D311-R345 WeakPolarHBondContact OD1-CG 3.36Å; D311-R345 IonicContact OD1-CZ 3.49Å; D311-R345 IonicContact OD1-NE 2.65Å; D311-R345 IonicContact OD1-NH1 2.9Å; D311-R345 PolarHBondContact OD1-NH1 2.85Å; D311-R345 IonicContact OD2-NH1 2.59Å; D311-R345 PolarHBondContact OD2-NH1 2.84Å; D311-R345 VanDerWaalsContact OD2-NH1 3.09Å; I321-R345 HydrophobicContact CG2-CB 4.41Å; I321-R345 HydrophobicContact CG2-CG 3.38Å; R345-T363 CarbonylContact O-C 3.55Å; R345-T363 WeakPolarHBondContact O-CA 3.45Å; R345-Y364 PolarHBondContact O-N 2.77Å
346	V	93.5	Very high	90.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.8	177.2	-175.7	0	0	0	0	107.9	N294 A309 V324 S344 S348 W371	N294-V346 PolarHBondContact ND2-O 3.42Å; A309-V346 HydrophobicContact CB-CB 4.13Å; A309-V346 HydrophobicContact CB-CG1 3.76Å; V324-V346 HydrophobicContact CG2-CB 4.12Å; V324-V346 HydrophobicContact CG2-CG1 4.01Å; V324-V346 HydrophobicContact CG2-CG2 3.85Å; S344-V346 PolarHBondContact O-N 2.86Å; V346-S348 WeakPolarHBondContact CG1-O 3.29Å; V346-W371 HydrophobicContact CG2-CH2 4.18Å
347	L	93.4	Very high	90.3	Very high	26 Å²	26	35.7 Å²	35.7	14%	0.136	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-41.6	-177.2	-65.8	179.8	0	0	0	111.7	N294 C295 G362 Y364 P394 I395 Y396	N294-L347 WeakPolarHBondContact CB-O 3.28Å; C295-L347 WeakPolarHBondContact CB-O 3.24Å; L347-G362 PolarHBondContact N-O 2.87Å; L347-Y364 HydrophobicContact CD1-CD2 4.07Å; L347-P394 HydrophobicContact CD1-CB 3.4Å; L347-P394 VanDerWaalsContact CD1-CB 3.4Å; L347-I395 WeakPolarHBondContact CB-O 3.32Å; L347-Y396 HydrophobicContact CD1-CD1 4.24Å; L347-Y396 HydrophobicContact CD1-CE1 4.27Å
348	S	93.6	Very high	90.6	Very high	3 Å²	3	36 Å²	36	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.3	-179.5	45.8	0	0	0	0	110.4	V346 G361 G362 I395 Y396 L398	V346-S348 WeakPolarHBondContact CG1-O 3.29Å; S348-G361 CarbonylContact O-C 3.58Å; S348-G361 VanDerWaalsContact O-CA 3.28Å; S348-G361 WeakPolarHBondContact O-CA 3.35Å; S348-G362 PolarHBondContact N-O 3.45Å; S348-G362 PolarHBondContact O-N 3.27Å; S348-I395 PolarHBondContact OG-O 2.8Å; S348-Y396 WeakPolarHBondContact CB-O 3.32Å; S348-L398 WeakPolarHBondContact OG-CD1 3.23Å; S348-L398 WeakPolarHBondContact OG-CG 3.46Å
349	L	94.6	Very high	90.9	Very high	6 Å²	6	34 Å²	34	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	137.3	-179	-168.5	71.8	0	0	0	108.8	C295 A307 A309 V324 L359 W371	C295-L349 HydrophobicContact CB-CB 4.34Å; C295-L349 PolarHBondContact SG-O 3.3Å; A307-L349 HydrophobicContact CB-CD2 3.51Å; A307-L349 HydrophobicContact CB-CG 4.47Å; A309-L349 HydrophobicContact CB-CB 4.07Å; A309-L349 HydrophobicContact CB-CD2 4.28Å; V324-L349 HydrophobicContact CG1-CD1 3.77Å; V324-L349 HydrophobicContact CG1-CD2 3.83Å; V324-L349 HydrophobicContact CG1-CG 4.49Å; V324-L349 HydrophobicContact CG2-CD1 4.19Å; L349-L359 HydrophobicContact CD1-CD1 3.95Å; L349-L359 HydrophobicContact CD1-CD2 3.92Å; L349-L359 HydrophobicContact CD1-CG 3.78Å; L349-L359 HydrophobicContact CD2-CD1 4.27Å; L349-L359 HydrophobicContact CD2-CD2 4.44Å; L349-L359 HydrophobicContact CG-CD1 3.93Å; L349-L359 HydrophobicContact CG-CG 4.33Å; L349-W371 HydrophobicContact CD1-CZ3 4.05Å
350	T	93.6	Very high	91.1	Very high	10 Å²	10	33.1 Å²	33.1	6%	0.061	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	138	174.1	-173.1	0	0	0	0	111	D297 V360 L398 V400	D297-T350 VanDerWaalsContact OD2-CA 3.25Å; D297-T350 WeakPolarHBondContact OD2-CA 3.27Å; T350-V360 HydrophobicContact CG2-CB 4.03Å; T350-V360 PolarHBondContact N-O 2.85Å; T350-V360 PolarHBondContact O-N 3.49Å; T350-V360 VanDerWaalsContact O-O 3.12Å; T350-L398 HydrophobicContact CG2-CB 3.9Å; T350-V400 HydrophobicContact CG2-CG2 3.76Å
351	W	93.4	Very high	91.2	Very high	6 Å²	6	32.9 Å²	32.9	2%	0.023	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	142.2	169.3	-78.8	94.3	0	0	0	111	D297 F298 L305 A307 I326 K353 P356 L359 M373	D297-W351 PolarHBondContact O-NE1 3.42Å; D297-W351 PolarHBondContact OD2-N 3.42Å; F298-W351 VanDerWaalsContact C-CD1 3.49Å; L305-W351 HydrophobicContact CB-CZ2 4.25Å; L305-W351 HydrophobicContact CD1-CH2 4.41Å; A307-W351 HydrophobicContact CB-CZ2 3.94Å; I326-W351 HydrophobicContact CD1-CH2 3.84Å; I326-W351 HydrophobicContact CD1-CZ2 4.02Å; I326-W351 HydrophobicContact CG1-CZ2 4.41Å; I326-W351 HydrophobicContact CG2-CZ2 4.33Å; W351-K353 PolarHBondContact O-N 3.28Å; W351-P356 WeakPolarHBondContact CZ3-O 3.29Å; W351-L359 HydrophobicContact CD2-CD1 3.91Å; W351-L359 HydrophobicContact CE3-CD1 4.39Å; W351-L359 HydrophobicContact CG-CD1 4.05Å; W351-M373 HydrophobicContact CH2-CE 4.19Å; W351-M373 HydrophobicContact CH2-SD 3.31Å; W351-M373 WeakPolarHBondContact CH2-SD 3.35Å; W351-M373 HydrophobicContact CZ3-SD 3.54Å; W351-M373 VanDerWaalsContact CZ3-SD 3.54Å
352	A	89.7	Confident	91.3	Very high	7 Å²	7	31.2 Å²	31.2	6%	0.058	15%	0.149	C	C	.	.			trans	-68.3	108.2	167.5	0	0	0	0	0	109.4	F354 H355 L358	A352-F354 PolarHBondContact O-N 3.35Å; A352-H355 HydrophobicContact CB-CB 3.97Å; A352-H355 PolarHBondContact O-N 2.89Å; A352-H355 VanDerWaalsContact O-N 3.11Å; A352-H355 VanDerWaalsContact O-O 3.08Å; A352-L358 HydrophobicContact CB-CB 3.9Å; A352-L358 WeakPolarHBondContact CB-O 3.32Å; A352-L358 PolarHBondContact N-O 3.13Å; A352-L358 VanDerWaalsContact N-O 3.11Å
353	K	85.7	Confident	91.5	Very high	81 Å²	81	30.9 Å²	30.9	35%	0.352	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-36.2	-177.5	-68.1	178.9	177.4	167.2	0	113.7	V300 W351 E399 V400	V300-K353 HydrophobicContact CG2-CG 4.36Å; W351-K353 PolarHBondContact O-N 3.28Å; K353-E399 IonicContact NZ-OE1 2.7Å; K353-V400 HydrophobicContact CD-CB 4.5Å; K353-V400 WeakPolarHBondContact CD-O 3.35Å; K353-V400 WeakPolarHBondContact CE-O 3.21Å; K353-V400 HydrophobicContact CG-CB 4.36Å; K353-V400 PolarHBondContact NZ-O 3.28Å
354	F	86.9	Confident	91.7	Very high	66 Å²	66	30 Å²	30	29%	0.289	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-15.5	-174.8	-54.2	-67.5	0	0	0	114.6	Q301 A352 G402 S403 A404 H407	Q301-F354 VanDerWaalsContact NE2-C 3.32Å; Q301-F354 PolarHBondContact NE2-O 3.5Å; A352-F354 PolarHBondContact O-N 3.35Å; F354-G402 VanDerWaalsContact CZ-O 3.28Å; F354-G402 WeakPolarHBondContact CZ-O 3.5Å; F354-S403 VanDerWaalsContact CE2-O 3.25Å; F354-S403 WeakPolarHBondContact CE2-O 3.45Å; F354-A404 VanDerWaalsContact CD1-CA 3.46Å; F354-A404 HydrophobicContact CD1-CB 3.7Å; F354-A404 HydrophobicContact CE1-CB 4.06Å; F354-A404 HydrophobicContact CG-CB 4.16Å; F354-H407 HydrophobicContact CD2-CB 3.72Å; F354-H407 AromaticContact CD2-CG 3.84Å; F354-H407 AromaticContact CD2-ND1 3.97Å; F354-H407 HydrophobicContact CE2-CB 3.74Å
355	H	87.2	Confident	91.8	Very high	72 Å²	72	30.8 Å²	30.8	33%	0.333	14%	0.144	S	C	.	.			trans	-119.8	110.9	-176.3	-69.5	103.7	0	0	0	110.2	A352 N357 L358 H407	A352-H355 HydrophobicContact CB-CB 3.97Å; A352-H355 PolarHBondContact O-N 2.89Å; A352-H355 VanDerWaalsContact O-N 3.11Å; A352-H355 VanDerWaalsContact O-O 3.08Å; H355-N357 PolarHBondContact O-N 3.06Å; H355-N357 VanDerWaalsContact O-N 3.08Å; H355-L358 HydrophobicContact CB-CB 4.03Å; H355-L358 HydrophobicContact CB-CD1 3.78Å; H355-L358 HydrophobicContact CB-CG 4.04Å; H355-L358 PolarHBondContact O-N 3.05Å; H355-H407 AromaticContact CE1-CE1 3.61Å; H355-H407 AromaticContact CE1-NE2 3.74Å; H355-H407 AromaticContact ND1-CE1 3.97Å; H355-H407 AromaticContact ND1-NE2 3.77Å
356	P	86.5	Confident	91.7	Very high	30 Å²	30	25.4 Å²	25.4	20%	0.195	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-23.1	-170.1	14.9	-23	0	0	0	114.9	Q301 Y302 W351	Q301-P356 HydrophobicContact CB-CB 4.28Å; Q301-P356 HydrophobicContact CG-CB 4.43Å; Y302-P356 HydrophobicContact CD2-CB 4.22Å; Y302-P356 HydrophobicContact CE2-CB 3.65Å; W351-P356 WeakPolarHBondContact CZ3-O 3.29Å
357	N	89.4	Confident	91.6	Very high	40 Å²	40	27.6 Å²	27.6	21%	0.214	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-4.5	-169.4	-60.1	-52.9	0	0	0	112.6	H355 D372 M373 R374	H355-N357 PolarHBondContact O-N 3.06Å; H355-N357 VanDerWaalsContact O-N 3.08Å; N357-D372 WeakPolarHBondContact CB-OD1 3.48Å; N357-D372 CarbonylContact O-C 3.6Å; N357-D372 WeakPolarHBondContact O-CA 3.24Å; N357-M373 HydrophobicContact CB-CB 4.24Å; N357-M373 WeakPolarHBondContact O-CG 3.28Å; N357-M373 PolarHBondContact O-N 3.06Å; N357-R374 HydrophobicContact CB-CG 3.98Å; N357-R374 WeakPolarHBondContact ND2-CD 3.41Å
358	L	91.9	Very high	91.7	Very high	17 Å²	17	26.4 Å²	26.4	9%	0.089	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.6	-174.3	-66.5	178.7	0	0	0	110.5	A352 H355 L370 W371 D372 L423	A352-L358 HydrophobicContact CB-CB 3.9Å; A352-L358 WeakPolarHBondContact CB-O 3.32Å; A352-L358 PolarHBondContact N-O 3.13Å; A352-L358 VanDerWaalsContact N-O 3.11Å; H355-L358 HydrophobicContact CB-CB 4.03Å; H355-L358 HydrophobicContact CB-CD1 3.78Å; H355-L358 HydrophobicContact CB-CG 4.04Å; H355-L358 PolarHBondContact O-N 3.05Å; L358-L370 HydrophobicContact CD2-CD2 4.44Å; L358-W371 WeakPolarHBondContact CA-O 3.42Å; L358-D372 HydrophobicContact CD2-CB 3.68Å; L358-L423 HydrophobicContact CD1-CD2 3.72Å; L358-L423 HydrophobicContact CD1-CG 4.42Å
359	L	93.7	Very high	91.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.8	179.7	-173.2	67.4	0	0	0	109.1	A307 V324 F340 L349 W351 L370 W371	A307-L359 HydrophobicContact CB-CD1 3.77Å; A307-L359 HydrophobicContact CB-CD2 4.16Å; V324-L359 HydrophobicContact CG1-CD2 3.51Å; F340-L359 HydrophobicContact CD2-CD2 4.46Å; L349-L359 HydrophobicContact CD1-CD1 3.95Å; L349-L359 HydrophobicContact CD1-CD2 3.92Å; L349-L359 HydrophobicContact CD1-CG 3.78Å; L349-L359 HydrophobicContact CD2-CD1 4.27Å; L349-L359 HydrophobicContact CD2-CD2 4.44Å; L349-L359 HydrophobicContact CG-CD1 3.93Å; L349-L359 HydrophobicContact CG-CG 4.33Å; W351-L359 HydrophobicContact CD2-CD1 3.91Å; W351-L359 HydrophobicContact CE3-CD1 4.39Å; W351-L359 HydrophobicContact CG-CD1 4.05Å; L359-L370 WeakPolarHBondContact O-CA 3.45Å; L359-W371 HydrophobicContact CB-CB 4.4Å; L359-W371 HydrophobicContact CB-CE3 4.4Å; L359-W371 HydrophobicContact CD2-CE3 4.3Å; L359-W371 HydrophobicContact CG-CE3 4.21Å; L359-W371 PolarHBondContact N-O 3.11Å; L359-W371 PolarHBondContact O-N 2.94Å
360	V	94.2	Very high	91.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	136.1	-178.7	-174.8	0	0	0	0	108.5	T350 I368 C369 L370 L398 I409 L423	T350-V360 HydrophobicContact CG2-CB 4.03Å; T350-V360 PolarHBondContact N-O 2.85Å; T350-V360 PolarHBondContact O-N 3.49Å; T350-V360 VanDerWaalsContact O-O 3.12Å; V360-I368 HydrophobicContact CG1-CG2 3.55Å; V360-C369 WeakPolarHBondContact CA-O 3.36Å; V360-L370 HydrophobicContact CG2-CD1 3.87Å; V360-L398 HydrophobicContact CG1-CD1 4.4Å; V360-I409 HydrophobicContact CB-CD1 4.46Å; V360-I409 HydrophobicContact CG1-CD1 3.88Å; V360-I409 HydrophobicContact CG1-CG1 4.37Å; V360-I409 HydrophobicContact CG1-CG2 4.11Å; V360-I409 HydrophobicContact CG2-CD1 3.75Å; V360-I409 HydrophobicContact CG2-CG1 4.25Å; V360-L423 HydrophobicContact CG2-CD1 4.06Å
361	G	94.4	Very high	91.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	146.8	177.7	0	0	0	0	0	113.6	S348 I368 C369 L398	S348-G361 CarbonylContact O-C 3.58Å; S348-G361 VanDerWaalsContact O-CA 3.28Å; S348-G361 WeakPolarHBondContact O-CA 3.35Å; G361-I368 WeakPolarHBondContact O-CA 3.22Å; G361-C369 PolarHBondContact N-O 3.4Å; G361-C369 PolarHBondContact O-N 3.05Å; G361-L398 VanDerWaalsContact C-CD1 3.41Å
362	G	94.2	Very high	91.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.9	-175.2	0	0	0	0	0	109	L347 S348 L398	L347-G362 PolarHBondContact N-O 2.87Å; S348-G362 PolarHBondContact N-O 3.45Å; S348-G362 PolarHBondContact O-N 3.27Å; G362-L398 VanDerWaalsContact CA-CD1 3.44Å
363	T	93.7	Very high	91.3	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	158.8	-178.5	64.2	0	0	0	0	111.9	R345 S365 G366 Q367 I395	R345-T363 CarbonylContact O-C 3.55Å; R345-T363 WeakPolarHBondContact O-CA 3.45Å; T363-S365 PolarHBondContact O-N 3.2Å; T363-S365 PolarHBondContact OG1-OG 3.01Å; T363-G366 PolarHBondContact O-N 3.49Å; T363-G366 VanDerWaalsContact O-N 3.14Å; T363-Q367 WeakPolarHBondContact CB-O 3.34Å; T363-Q367 PolarHBondContact N-O 3.3Å; T363-Q367 WeakPolarHBondContact OG1-CA 3.42Å; T363-Q367 WeakPolarHBondContact OG1-CB 3.47Å; T363-Q367 PolarHBondContact OG1-N 3.02Å; T363-Q367 VanDerWaalsContact OG1-N 3.15Å; T363-Q367 PolarHBondContact OG1-O 2.91Å; T363-I395 PolarHBondContact O-N 3.37Å
364	Y	93.4	Very high	91.4	Very high	131 Å²	131	29.8 Å²	29.8	51%	0.514	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.8	173.3	-178	-90.5	0	0	0	112.9	R345 L347 G366 P394	R345-Y364 PolarHBondContact O-N 2.77Å; L347-Y364 HydrophobicContact CD1-CD2 4.07Å; Y364-G366 VanDerWaalsContact C-N 3.26Å; Y364-G366 PolarHBondContact O-N 3.39Å; Y364-P394 HydrophobicContact CD2-CB 3.77Å; Y364-P394 HydrophobicContact CD2-CG 4.33Å; Y364-P394 HydrophobicContact CE2-CB 4.07Å; Y364-P394 HydrophobicContact CE2-CG 4.12Å; Y364-P394 HydrophobicContact CG-CB 4.31Å; Y364-P394 VanDerWaalsContact O-CA 3.28Å; Y364-P394 WeakPolarHBondContact O-CA 3.41Å
365	S	91.6	Very high	91.2	Very high	38 Å²	38	30.4 Å²	30.4	27%	0.266	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-2.9	178.8	37.2	0	0	0	0	114.8	S344 T363 Q367 L386	S344-S365 VanDerWaalsContact CB-OG 3.31Å; S344-S365 WeakPolarHBondContact CB-OG 3.44Å; S344-S365 PolarHBondContact OG-N 3.27Å; S344-S365 PolarHBondContact OG-OG 2.81Å; T363-S365 PolarHBondContact O-N 3.2Å; T363-S365 PolarHBondContact OG1-OG 3.01Å; S365-Q367 VanDerWaalsContact C-N 3.35Å; S365-L386 WeakPolarHBondContact O-CD1 3.34Å
366	G	90.8	Very high	90.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	85.2	5.3	-175	0	0	0	0	0	114.6	T363 Y364 H393	T363-G366 PolarHBondContact O-N 3.49Å; T363-G366 VanDerWaalsContact O-N 3.14Å; Y364-G366 VanDerWaalsContact C-N 3.26Å; Y364-G366 PolarHBondContact O-N 3.39Å; G366-H393 VanDerWaalsContact CA-O 3.29Å; G366-H393 WeakPolarHBondContact CA-O 3.36Å
367	Q	92.4	Very high	90.6	Very high	46 Å²	46	36.8 Å²	36.8	22%	0.215	18%	0.177	C	C	.	.			trans	-90.8	142.9	174.3	-64.1	-179.2	-20.2	0	0	110.9	T363 S365	T363-Q367 WeakPolarHBondContact CB-O 3.34Å; T363-Q367 PolarHBondContact N-O 3.3Å; T363-Q367 WeakPolarHBondContact OG1-CA 3.42Å; T363-Q367 WeakPolarHBondContact OG1-CB 3.47Å; T363-Q367 PolarHBondContact OG1-N 3.02Å; T363-Q367 VanDerWaalsContact OG1-N 3.15Å; T363-Q367 PolarHBondContact OG1-O 2.91Å; S365-Q367 VanDerWaalsContact C-N 3.35Å
368	I	93.9	Very high	90.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.7	170.2	-60.4	-179.8	0	0	0	107.7	V360 G361 K383 S384 I395 L398 W421	V360-I368 HydrophobicContact CG1-CG2 3.55Å; G361-I368 WeakPolarHBondContact O-CA 3.22Å; I368-K383 CarbonylContact O-C 3.56Å; I368-K383 VanDerWaalsContact O-CA 3.29Å; I368-K383 WeakPolarHBondContact O-CA 3.2Å; I368-S384 PolarHBondContact N-OG 2.92Å; I368-S384 PolarHBondContact O-N 3.46Å; I368-I395 HydrophobicContact CD1-CD1 4.41Å; I368-I395 HydrophobicContact CG1-CD1 3.63Å; I368-L398 HydrophobicContact CD1-CD2 4.1Å; I368-L398 HydrophobicContact CG1-CD2 4.48Å; I368-W421 HydrophobicContact CD1-CD2 3.83Å; I368-W421 VanDerWaalsContact CD1-CE2 3.45Å; I368-W421 HydrophobicContact CD1-CG 3.77Å; I368-W421 HydrophobicContact CD1-CZ2 4.1Å
369	C	92.7	Very high	90.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141	178.5	-67.8	0	0	0	0	109.8	V360 G361 W371 P380	V360-C369 WeakPolarHBondContact CA-O 3.36Å; G361-C369 PolarHBondContact N-O 3.4Å; G361-C369 PolarHBondContact O-N 3.05Å; C369-W371 HydrophobicContact CB-CH2 3.53Å; C369-W371 HydrophobicContact CB-CZ2 3.54Å; C369-W371 HydrophobicContact CB-CZ3 4.1Å; C369-P380 HydrophobicContact CB-CB 3.94Å; C369-P380 HydrophobicContact CB-CG 4.47Å
370	L	93.4	Very high	90.2	Very high	13 Å²	13	46.3 Å²	46.3	7%	0.068	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131.8	174.4	-174.1	88.4	0	0	0	109.8	L358 L359 V360 P380 I381 Q382 L423 L426	L358-L370 HydrophobicContact CD2-CD2 4.44Å; L359-L370 WeakPolarHBondContact O-CA 3.45Å; V360-L370 HydrophobicContact CG2-CD1 3.87Å; L370-P380 CarbonylContact O-C 3.55Å; L370-P380 WeakPolarHBondContact O-CA 3.45Å; L370-I381 PolarHBondContact O-N 2.95Å; L370-Q382 HydrophobicContact CB-CB 4.24Å; L370-Q382 HydrophobicContact CD2-CB 4.39Å; L370-Q382 PolarHBondContact N-O 2.82Å; L370-L423 HydrophobicContact CD1-CD1 3.56Å; L370-L426 HydrophobicContact CB-CD1 3.79Å
371	W	93.4	Very high	89.9	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144.8	172	-56.3	-90	0	0	0	110.5	V324 F340 V346 L349 L358 L359 C369 P380	V324-W371 HydrophobicContact CG2-CH2 3.94Å; V324-W371 HydrophobicContact CG2-CZ2 4.23Å; V324-W371 HydrophobicContact CG2-CZ3 4.29Å; F340-W371 HydrophobicContact CB-CG 4.1Å; F340-W371 HydrophobicContact CD1-CB 4.15Å; F340-W371 AromaticContact CD1-CD1 3.77Å; F340-W371 HydrophobicContact CD1-CG 4.18Å; F340-W371 HydrophobicContact CD2-CB 4.35Å; F340-W371 HydrophobicContact CD2-CG 4.44Å; F340-W371 HydrophobicContact CE1-CB 4.28Å; F340-W371 HydrophobicContact CE2-CB 4.47Å; F340-W371 HydrophobicContact CG-CB 4.19Å; F340-W371 AromaticContact CG-CD1 3.75Å; F340-W371 AromaticContact CG-CG 4Å; F340-W371 HydrophobicContact CG-CG 4Å; F340-W371 HydrophobicContact CZ-CB 4.44Å; V346-W371 HydrophobicContact CG2-CH2 4.18Å; L349-W371 HydrophobicContact CD1-CZ3 4.05Å; L358-W371 WeakPolarHBondContact CA-O 3.42Å; L359-W371 HydrophobicContact CB-CB 4.4Å; L359-W371 HydrophobicContact CB-CE3 4.4Å; L359-W371 HydrophobicContact CD2-CE3 4.3Å; L359-W371 HydrophobicContact CG-CE3 4.21Å; L359-W371 PolarHBondContact N-O 3.11Å; L359-W371 PolarHBondContact O-N 2.94Å; C369-W371 HydrophobicContact CB-CH2 3.53Å; C369-W371 HydrophobicContact CB-CZ2 3.54Å; C369-W371 HydrophobicContact CB-CZ3 4.1Å; W371-P380 VanDerWaalsContact CD1-CA 3.44Å; W371-P380 HydrophobicContact CZ2-CB 4.5Å
372	D	91.9	Very high	89.7	Confident	17 Å²	17	52.4 Å²	52.4	9%	0.091	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.5	172.9	-169	-24.8	0	0	0	109	N357 L358 R374 Q375 I381	N357-D372 WeakPolarHBondContact CB-OD1 3.48Å; N357-D372 CarbonylContact O-C 3.6Å; N357-D372 WeakPolarHBondContact O-CA 3.24Å; L358-D372 HydrophobicContact CD2-CB 3.68Å; D372-R374 PolarHBondContact O-N 2.78Å; D372-R374 VanDerWaalsContact OD1-CB 3.28Å; D372-R374 WeakPolarHBondContact OD1-CB 3.33Å; D372-R374 WeakPolarHBondContact OD1-CG 3.1Å; D372-R374 IonicContact OD1-CZ 3.29Å; D372-R374 PolarHBondContact OD1-N 3.39Å; D372-R374 IonicContact OD1-NE 3.55Å; D372-R374 PolarHBondContact OD1-NE 3.45Å; D372-R374 IonicContact OD1-NH2 2.75Å; D372-R374 IonicContact OD2-CZ 3.24Å; D372-R374 VanDerWaalsContact OD2-CZ 3.29Å; D372-R374 IonicContact OD2-NE 2.66Å; D372-R374 PolarHBondContact OD2-NE 2.93Å; D372-R374 VanDerWaalsContact OD2-NE 3.07Å; D372-R374 IonicContact OD2-NH2 3.66Å; D372-R374 PolarHBondContact OD2-NH2 3.45Å; D372-Q375 PolarHBondContact O-N 2.91Å; D372-I381 HydrophobicContact CB-CD1 3.12Å; D372-I381 VanDerWaalsContact N-CD1 3.32Å
373	M	87.1	Confident	89.6	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.069	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.8	179.5	-61.6	173.6	71.4	0	0	113.9	L305 I326 Y338 F340 W351 N357 Q375	L305-M373 HydrophobicContact CD1-CE 4.08Å; I326-M373 HydrophobicContact CD1-CE 3.66Å; I326-M373 HydrophobicContact CD1-CG 3.8Å; I326-M373 HydrophobicContact CD1-SD 3.68Å; Y338-M373 HydrophobicContact CD2-CE 3.41Å; Y338-M373 VanDerWaalsContact CD2-CE 3.41Å; Y338-M373 HydrophobicContact CE2-CE 3.2Å; Y338-M373 HydrophobicContact CG-CE 4.31Å; F340-M373 HydrophobicContact CE2-CG 4.47Å; F340-M373 HydrophobicContact CZ-CG 4.19Å; W351-M373 HydrophobicContact CH2-CE 4.19Å; W351-M373 HydrophobicContact CH2-SD 3.31Å; W351-M373 WeakPolarHBondContact CH2-SD 3.35Å; W351-M373 HydrophobicContact CZ3-SD 3.54Å; W351-M373 VanDerWaalsContact CZ3-SD 3.54Å; N357-M373 HydrophobicContact CB-CB 4.24Å; N357-M373 WeakPolarHBondContact O-CG 3.28Å; N357-M373 PolarHBondContact O-N 3.06Å; M373-Q375 VanDerWaalsContact C-N 3.25Å; M373-Q375 PolarHBondContact O-N 2.71Å
374	R	86.1	Confident	89.5	Confident	139 Å²	139	55.8 Å²	55.8	53%	0.525	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-27.1	177.6	-65.6	172	-74.7	-172.7	0.9	111.6	N357 D372	N357-R374 HydrophobicContact CB-CG 3.98Å; N357-R374 WeakPolarHBondContact ND2-CD 3.41Å; D372-R374 PolarHBondContact O-N 2.78Å; D372-R374 VanDerWaalsContact OD1-CB 3.28Å; D372-R374 WeakPolarHBondContact OD1-CB 3.33Å; D372-R374 WeakPolarHBondContact OD1-CG 3.1Å; D372-R374 IonicContact OD1-CZ 3.29Å; D372-R374 PolarHBondContact OD1-N 3.39Å; D372-R374 IonicContact OD1-NE 3.55Å; D372-R374 PolarHBondContact OD1-NE 3.45Å; D372-R374 IonicContact OD1-NH2 2.75Å; D372-R374 IonicContact OD2-CZ 3.24Å; D372-R374 VanDerWaalsContact OD2-CZ 3.29Å; D372-R374 IonicContact OD2-NE 2.66Å; D372-R374 PolarHBondContact OD2-NE 2.93Å; D372-R374 VanDerWaalsContact OD2-NE 3.07Å; D372-R374 IonicContact OD2-NH2 3.66Å; D372-R374 PolarHBondContact OD2-NH2 3.45Å
375	Q	83.6	Confident	89.2	Confident	80 Å²	80	51.9 Å²	51.9	37%	0.374	26%	0.261	S	S	.	.	S	Bend	trans	-91.2	132.7	177.5	-59.3	-170.5	13.4	0	0	109.9	D372 M373 K377 I381	D372-Q375 PolarHBondContact O-N 2.91Å; M373-Q375 VanDerWaalsContact C-N 3.25Å; M373-Q375 PolarHBondContact O-N 2.71Å; Q375-K377 PolarHBondContact O-N 3.35Å; Q375-I381 HydrophobicContact CB-CD1 4.38Å; Q375-I381 HydrophobicContact CG-CD1 4.16Å
376	S	75.7	Confident	88.9	Confident	99 Å²	99	55 Å²	55	69%	0.692	27%	0.274	S	S	*	.			trans	-72.4	-6.2	176.3	54.9	0	0	0	0	113.5	R378	S376-R378 PolarHBondContact O-N 3.02Å
377	K	85.4	Confident	88.6	Confident	137 Å²	137	57.6 Å²	57.6	60%	0.596	29%	0.292	S	S	*	.			trans	-66.9	125	178.8	-68	-175.8	179.8	178.9	0	109.8	Q375	Q375-K377 PolarHBondContact O-N 3.35Å
378	R	86.3	Confident	88.1	Confident	153 Å²	153	60.8 Å²	60.8	58%	0.577	32%	0.315	S	S	*	.			trans	-79.6	-18.2	-179.5	-60.2	166.5	160.9	-137	4.9	113.1	C339 F340 H341 S376	C339-R378 WeakPolarHBondContact O-CG 3.49Å; F340-R378 CarbonylContact C-O 3.58Å; F340-R378 VanDerWaalsContact CA-O 3.29Å; F340-R378 WeakPolarHBondContact CA-O 3.36Å; H341-R378 PolarHBondContact N-O 2.77Å; H341-R378 VanDerWaalsContact ND1-CB 3.3Å; H341-R378 WeakPolarHBondContact ND1-CB 3.21Å; S376-R378 PolarHBondContact O-N 3.02Å
379	T	89.5	Confident	87.6	Confident	86 Å²	86	64 Å²	64	53%	0.528	34%	0.337	S	S	.	.	S	Bend	trans	-82.7	154	176.8	53.7	0	0	0	0	111
380	P	89.9	Confident	87.4	Confident	17 Å²	17	64 Å²	64	11%	0.11	34%	0.337	C	S	.	.			trans	-60.2	143.5	174.8	27.7	-36.7	0	0	0	111	H341 C369 L370 W371 K383	H341-P380 VanDerWaalsContact O-CD 3.23Å; H341-P380 WeakPolarHBondContact O-CD 3.35Å; C369-P380 HydrophobicContact CB-CB 3.94Å; C369-P380 HydrophobicContact CB-CG 4.47Å; L370-P380 CarbonylContact O-C 3.55Å; L370-P380 WeakPolarHBondContact O-CA 3.45Å; W371-P380 VanDerWaalsContact CD1-CA 3.44Å; W371-P380 HydrophobicContact CZ2-CB 4.5Å; P380-K383 HydrophobicContact CB-CG 4.35Å; P380-K383 HydrophobicContact CG-CD 4.24Å; P380-K383 HydrophobicContact CG-CG 4.01Å
381	I	89.2	Confident	87.3	Confident	71 Å²	71	63.4 Å²	63.4	36%	0.364	33%	0.334	S	S	.	.	S	Bend	trans	-76.9	-42.9	-178.6	-66.8	168.9	0	0	0	109.9	L370 D372 Q375	L370-I381 PolarHBondContact O-N 2.95Å; D372-I381 HydrophobicContact CB-CD1 3.12Å; D372-I381 VanDerWaalsContact N-CD1 3.32Å; Q375-I381 HydrophobicContact CB-CD1 4.38Å; Q375-I381 HydrophobicContact CG-CD1 4.16Å
382	Q	89.6	Confident	87.1	Confident	58 Å²	58	66.9 Å²	66.9	27%	0.271	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.9	179.8	-166.5	173.3	4.2	0	0	109.4	L370 L426	L370-Q382 HydrophobicContact CB-CB 4.24Å; L370-Q382 HydrophobicContact CD2-CB 4.39Å; L370-Q382 PolarHBondContact N-O 2.82Å; Q382-L426 HydrophobicContact CB-CD1 4.09Å; Q382-L426 HydrophobicContact CG-CB 4.05Å; Q382-L426 HydrophobicContact CG-CD1 3.92Å; Q382-L426 HydrophobicContact CG-CG 4.46Å
383	K	91	Very high	87.1	Confident	68 Å²	68	70.1 Å²	70.1	30%	0.296	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.1	174.2	-61.2	-177.6	-177.5	175.1	0	108.7	I368 P380	I368-K383 CarbonylContact O-C 3.56Å; I368-K383 VanDerWaalsContact O-CA 3.29Å; I368-K383 WeakPolarHBondContact O-CA 3.2Å; P380-K383 HydrophobicContact CB-CG 4.35Å; P380-K383 HydrophobicContact CG-CD 4.24Å; P380-K383 HydrophobicContact CG-CG 4.01Å
384	S	91.8	Very high	87.4	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.021	37%	0.371	C	S	.	.			trans	-73.1	150.4	169.9	70.2	0	0	0	0	111.9	I368 L426	I368-S384 PolarHBondContact N-OG 2.92Å; I368-S384 PolarHBondContact O-N 3.46Å; S384-L426 WeakPolarHBondContact CA-O 3.41Å; S384-L426 WeakPolarHBondContact CB-O 3.32Å
385	A	87.3	Confident	87.8	Confident	50 Å²	50	63.5 Å²	63.5	41%	0.413	35%	0.346	S	S	.	.			trans	-73.5	138.9	175.9	0	0	0	0	0	110.3	S387 S427	A385-S387 PolarHBondContact O-N 3.24Å; A385-S427 WeakPolarHBondContact CB-O 3.47Å
386	L	86.1	Confident	88.2	Confident	103 Å²	103	63.3 Å²	63.3	54%	0.539	34%	0.343	S	S	.	.			trans	-77.4	106.9	169.9	-168.6	68.9	0	0	0	108	S365 H391	S365-L386 WeakPolarHBondContact O-CD1 3.34Å; L386-H391 WeakPolarHBondContact CD1-O 3.32Å
387	S	84.2	Confident	89	Confident	55 Å²	55	59.6 Å²	59.6	39%	0.385	32%	0.316	S	S	.	.			trans	-140.7	157.4	-178.1	177.1	0	0	0	0	109.3	A385 S389 A390	A385-S387 PolarHBondContact O-N 3.24Å; S387-S389 PolarHBondContact O-N 2.96Å; S387-S389 PolarHBondContact OG-N 2.86Å; S387-A390 CarbonylContact O-C 3.57Å; S387-A390 WeakPolarHBondContact O-CA 3.43Å; S387-A390 WeakPolarHBondContact O-CB 3.29Å; S387-A390 PolarHBondContact O-N 2.8Å
388	T	81.8	Confident	89.4	Confident	112 Å²	112	53.6 Å²	53.6	69%	0.687	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-24.5	174.3	-48	0	0	0	0	112.7	A390 K417	T388-A390 VanDerWaalsContact C-N 3.32Å; T388-K417 PolarHBondContact O-NZ 2.88Å
389	S	84.6	Confident	89.7	Confident	67 Å²	67	47.4 Å²	47.4	47%	0.469	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-26.8	172.4	-54.6	0	0	0	0	112.5	S387 P429 T432	S387-S389 PolarHBondContact O-N 2.96Å; S387-S389 PolarHBondContact OG-N 2.86Å; S389-P429 WeakPolarHBondContact O-CG 3.46Å; S389-T432 WeakPolarHBondContact O-CG2 3.42Å; S389-T432 PolarHBondContact O-OG1 3.36Å
390	A	88.4	Confident	89.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.008	24%	0.243	C	C	.	.	S	Bend	trans	-92.5	-173.1	175.1	0	0	0	0	0	110.7	S387 T388 W421	S387-A390 CarbonylContact O-C 3.57Å; S387-A390 WeakPolarHBondContact O-CA 3.43Å; S387-A390 WeakPolarHBondContact O-CB 3.29Å; S387-A390 PolarHBondContact O-N 2.8Å; T388-A390 VanDerWaalsContact C-N 3.32Å; A390-W421 HydrophobicContact CB-CH2 3.57Å; A390-W421 HydrophobicContact CB-CZ2 3.94Å
391	H	90.8	Very high	89.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.			trans	-73.5	141.1	173.7	-66.1	-58.9	0	0	0	111.9	L386 I395 S411 S413 D415 K417 C419	L386-H391 WeakPolarHBondContact CD1-O 3.32Å; H391-I395 HydrophobicContact CB-CG1 4.24Å; H391-S411 PolarHBondContact CD2-OG 3.36Å; H391-S411 PolarHBondContact NE2-O 3.24Å; H391-S411 PolarHBondContact NE2-OG 2.69Å; H391-S413 VanDerWaalsContact ND1-CB 3.26Å; H391-S413 WeakPolarHBondContact ND1-CB 3.11Å; H391-D415 VanDerWaalsContact CA-OD2 3.31Å; H391-D415 WeakPolarHBondContact CA-OD2 3.43Å; H391-D415 IonicContact CE1-OD1 3.33Å; H391-D415 IonicContact CG-OD2 2.93Å; H391-D415 IonicContact ND1-OD1 3.43Å; H391-D415 PolarHBondContact ND1-OD1 3.03Å; H391-D415 IonicContact ND1-OD2 3.37Å; H391-D415 PolarHBondContact ND1-OD2 3.33Å; H391-D415 VanDerWaalsContact ND1-OD2 3.11Å; H391-K417 PolarHBondContact CE1-O 3.18Å; H391-K417 VanDerWaalsContact CE1-O 3.26Å; H391-C419 VanDerWaalsContact CE1-SG 3.5Å; H391-C419 PolarHBondContact NE2-SG 2.9Å
392	T	89.8	Confident	89.6	Confident	74 Å²	74	40.7 Å²	40.7	45%	0.454	24%	0.235	S	C	.	.			trans	-111	-10.7	172.5	54	0	0	0	0	112.2	D415	T392-D415 PolarHBondContact N-OD2 3.21Å
393	H	91.2	Very high	89.4	Confident	86 Å²	86	41 Å²	41	40%	0.398	24%	0.243	S	C	.	.	S	Bend	trans	-114.7	166.3	-176.2	-77.2	72.1	0	0	0	110.2	G366 I395 S413 K414 D415	G366-H393 VanDerWaalsContact CA-O 3.29Å; G366-H393 WeakPolarHBondContact CA-O 3.36Å; H393-I395 PolarHBondContact O-N 2.94Å; H393-S413 WeakPolarHBondContact CB-OG 3.46Å; H393-S413 PolarHBondContact O-OG 2.67Å; H393-K414 HydrophobicContact CB-CB 4.47Å; H393-D415 HydrophobicContact CB-CB 3.99Å
394	P	92.9	Very high	89.1	Confident	13 Å²	13	40.4 Å²	40.4	8%	0.084	25%	0.251	C	S	.	.			trans	-57.4	134.2	178.6	20.4	-34	0	0	0	113	L347 Y364 Y396 S413	L347-P394 HydrophobicContact CD1-CB 3.4Å; L347-P394 VanDerWaalsContact CD1-CB 3.4Å; Y364-P394 HydrophobicContact CD2-CB 3.77Å; Y364-P394 HydrophobicContact CD2-CG 4.33Å; Y364-P394 HydrophobicContact CE2-CB 4.07Å; Y364-P394 HydrophobicContact CE2-CG 4.12Å; Y364-P394 HydrophobicContact CG-CB 4.31Å; Y364-P394 VanDerWaalsContact O-CA 3.28Å; Y364-P394 WeakPolarHBondContact O-CA 3.41Å; P394-Y396 HydrophobicContact CG-CE2 4.1Å; P394-Y396 PolarHBondContact O-N 3.33Å; P394-S413 PolarHBondContact O-OG 2.71Å
395	I	93.9	Very high	88.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	100.9	177	-55.9	174.1	0	0	0	108.9	L347 S348 T363 I368 H391 H393 C397 L398 V412	L347-I395 WeakPolarHBondContact CB-O 3.32Å; S348-I395 PolarHBondContact OG-O 2.8Å; T363-I395 PolarHBondContact O-N 3.37Å; I368-I395 HydrophobicContact CD1-CD1 4.41Å; I368-I395 HydrophobicContact CG1-CD1 3.63Å; H391-I395 HydrophobicContact CB-CG1 4.24Å; H393-I395 PolarHBondContact O-N 2.94Å; I395-C397 WeakPolarHBondContact CG2-O 3.44Å; I395-L398 HydrophobicContact CG2-CD1 4.48Å; I395-L398 HydrophobicContact CG2-CD2 4Å; I395-L398 HydrophobicContact CG2-CG 3.82Å; I395-V412 WeakPolarHBondContact CA-O 3.43Å
396	Y	92.7	Very high	88.7	Confident	77 Å²	77	48.6 Å²	48.6	30%	0.302	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-30.1	-178.8	-68.2	-68.9	0	0	0	113.4	L347 S348 P394 V412 K414 A445 Y446	L347-Y396 HydrophobicContact CD1-CD1 4.24Å; L347-Y396 HydrophobicContact CD1-CE1 4.27Å; S348-Y396 WeakPolarHBondContact CB-O 3.32Å; P394-Y396 HydrophobicContact CG-CE2 4.1Å; P394-Y396 PolarHBondContact O-N 3.33Å; Y396-V412 PolarHBondContact N-O 3.03Å; Y396-K414 HydrophobicContact CE2-CB 4.08Å; Y396-A445 WeakPolarHBondContact CD2-O 3.43Å; Y396-Y446 WeakPolarHBondContact CB-O 3.44Å; Y396-Y446 HydrophobicContact CD1-CD1 4.25Å; Y396-Y446 AromaticContact CD2-CD1 3.89Å; Y396-Y446 HydrophobicContact CD2-CD1 3.89Å; Y396-Y446 HydrophobicContact CD2-CE1 4.35Å; Y396-Y446 HydrophobicContact CE1-CD1 4.22Å; Y396-Y446 HydrophobicContact CE1-CE1 4.25Å; Y396-Y446 AromaticContact CE2-CD1 3.83Å; Y396-Y446 HydrophobicContact CE2-CD1 3.83Å; Y396-Y446 AromaticContact CE2-CE1 3.81Å; Y396-Y446 HydrophobicContact CE2-CE1 3.81Å; Y396-Y446 HydrophobicContact CG-CD1 4.1Å; Y396-Y446 AromaticContact CZ-CE1 3.77Å
397	C	93.3	Very high	88.8	Confident	21 Å²	21	45 Å²	45	14%	0.142	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	140.7	-177.7	-166.9	0	0	0	0	111.7	I395 V412 M448	I395-C397 WeakPolarHBondContact CG2-O 3.44Å; C397-V412 PolarHBondContact O-N 3.43Å; C397-M448 HydrophobicContact CB-CB 4.36Å; C397-M448 PolarHBondContact SG-O 3.22Å; C397-M448 VanDerWaalsContact SG-O 3.39Å
398	L	93.6	Very high	89.1	Confident	11 Å²	11	43.5 Å²	43.5	6%	0.058	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.9	174.8	-78.7	171.7	0	0	0	108.8	S348 T350 V360 G361 G362 I368 I395 I409 V410	S348-L398 WeakPolarHBondContact OG-CD1 3.23Å; S348-L398 WeakPolarHBondContact OG-CG 3.46Å; T350-L398 HydrophobicContact CG2-CB 3.9Å; V360-L398 HydrophobicContact CG1-CD1 4.4Å; G361-L398 VanDerWaalsContact C-CD1 3.41Å; G362-L398 VanDerWaalsContact CA-CD1 3.44Å; I368-L398 HydrophobicContact CD1-CD2 4.1Å; I368-L398 HydrophobicContact CG1-CD2 4.48Å; I395-L398 HydrophobicContact CG2-CD1 4.48Å; I395-L398 HydrophobicContact CG2-CD2 4Å; I395-L398 HydrophobicContact CG2-CG 3.82Å; L398-I409 HydrophobicContact CD2-CG2 3.83Å; L398-V410 WeakPolarHBondContact CA-O 3.46Å
399	E	92.9	Very high	89.7	Confident	22 Å²	22	38.2 Å²	38.2	10%	0.103	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	137.3	173.4	-168.7	173.4	164.3	0	0	111	K353 V401 V410 M448 F450	K353-E399 IonicContact NZ-OE1 2.7Å; E399-V401 HydrophobicContact CB-CG2 4.41Å; E399-V401 HydrophobicContact CG-CG2 4.21Å; E399-V410 PolarHBondContact N-O 2.78Å; E399-V410 PolarHBondContact O-N 3.41Å; E399-M448 HydrophobicContact CB-CE 3.83Å; E399-F450 HydrophobicContact CB-CD2 4.45Å; E399-F450 HydrophobicContact CG-CD2 4.36Å; E399-F450 WeakPolarHBondContact OE2-CD2 2.96Å; E399-F450 PolarHBondContact OE2-N 2.92Å
400	V	91.9	Very high	90.1	Very high	1 Å²	1	35 Å²	35	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	122.8	172.2	-174.9	0	0	0	0	109.5	T350 K353 H407 I409	T350-V400 HydrophobicContact CG2-CG2 3.76Å; K353-V400 HydrophobicContact CD-CB 4.5Å; K353-V400 WeakPolarHBondContact CD-O 3.35Å; K353-V400 WeakPolarHBondContact CE-O 3.21Å; K353-V400 HydrophobicContact CG-CB 4.36Å; K353-V400 PolarHBondContact NZ-O 3.28Å; V400-H407 HydrophobicContact CG1-CB 4.31Å; V400-I409 HydrophobicContact CG2-CG1 4.17Å
401	V	88.9	Confident	90.3	Very high	7 Å²	7	35 Å²	35	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.2	-172.4	-165.8	0	0	0	0	109.7	E399 H407 N408 V410 F450 V455	E399-V401 HydrophobicContact CB-CG2 4.41Å; E399-V401 HydrophobicContact CG-CG2 4.21Å; V401-H407 WeakPolarHBondContact O-CA 3.46Å; V401-N408 PolarHBondContact N-O 3.31Å; V401-N408 PolarHBondContact O-N 2.91Å; V401-N408 VanDerWaalsContact O-O 3.1Å; V401-V410 HydrophobicContact CB-CG2 4.41Å; V401-V410 HydrophobicContact CG2-CB 4.38Å; V401-V410 HydrophobicContact CG2-CG2 3.89Å; V401-F450 HydrophobicContact CB-CZ 4.49Å; V401-F450 HydrophobicContact CG1-CD1 3.85Å; V401-F450 HydrophobicContact CG1-CD2 4.45Å; V401-F450 HydrophobicContact CG1-CE1 3.97Å; V401-F450 HydrophobicContact CG1-CG 4.11Å; V401-F450 HydrophobicContact CG1-CZ 4.35Å; V401-F450 HydrophobicContact CG2-CD1 4.25Å; V401-F450 HydrophobicContact CG2-CD2 3.46Å; V401-F450 VanDerWaalsContact CG2-CD2 3.46Å; V401-F450 HydrophobicContact CG2-CE1 4.09Å; V401-F450 HydrophobicContact CG2-CE2 3.3Å; V401-F450 HydrophobicContact CG2-CG 3.96Å; V401-F450 HydrophobicContact CG2-CZ 3.65Å; V401-V455 HydrophobicContact CG1-CB 4.03Å; V401-V455 HydrophobicContact CG1-CG1 3.46Å; V401-V455 VanDerWaalsContact CG1-CG1 3.46Å; V401-V455 HydrophobicContact CG1-CG2 4.5Å
402	G	85	Confident	90.4	Very high	25 Å²	25	35 Å²	35	26%	0.258	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	135	-160.4	174.2	0	0	0	0	0	112.9	F354 A406	F354-G402 VanDerWaalsContact CZ-O 3.28Å; F354-G402 WeakPolarHBondContact CZ-O 3.5Å; G402-A406 CarbonylContact C-O 3.47Å; G402-A406 VanDerWaalsContact CA-O 3.32Å; G402-A406 WeakPolarHBondContact CA-O 3.42Å
403	S	85.7	Confident	90.5	Very high	64 Å²	64	31.4 Å²	31.4	45%	0.448	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	171.7	177.9	69.7	0	0	0	0	110.9	F354 N405 A406 H407	F354-S403 VanDerWaalsContact CE2-O 3.25Å; F354-S403 WeakPolarHBondContact CE2-O 3.45Å; S403-N405 PolarHBondContact O-N 3.12Å; S403-N405 VanDerWaalsContact O-N 3.15Å; S403-A406 PolarHBondContact N-O 3.26Å; S403-A406 CarbonylContact O-C 3.4Å; S403-A406 PolarHBondContact O-N 3.32Å; S403-A406 VanDerWaalsContact O-N 3.13Å; S403-A406 PolarHBondContact OG-N 3.08Å; S403-H407 WeakPolarHBondContact O-CB 3.49Å; S403-H407 PolarHBondContact O-N 3.26Å
404	A	84.1	Confident	90.4	Very high	56 Å²	56	31.3 Å²	31.3	46%	0.463	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-39.7	179.4	0	0	0	0	0	113.2	F354 H407	F354-A404 VanDerWaalsContact CD1-CA 3.46Å; F354-A404 HydrophobicContact CD1-CB 3.7Å; F354-A404 HydrophobicContact CE1-CB 4.06Å; F354-A404 HydrophobicContact CG-CB 4.16Å; A404-H407 PolarHBondContact O-ND1 3.36Å
405	N	84.8	Confident	90.2	Very high	161 Å²	161	31.1 Å²	31.1	86%	0.861	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-19	-177.1	-61.7	-19.9	0	0	0	113.7	S403	S403-N405 PolarHBondContact O-N 3.12Å; S403-N405 VanDerWaalsContact O-N 3.15Å
406	A	85.5	Confident	89.8	Confident	64 Å²	64	31.1 Å²	31.1	53%	0.529	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	88.3	-177.5	0	0	0	0	0	108.6	G402 S403	G402-A406 CarbonylContact C-O 3.47Å; G402-A406 VanDerWaalsContact CA-O 3.32Å; G402-A406 WeakPolarHBondContact CA-O 3.42Å; S403-A406 PolarHBondContact N-O 3.26Å; S403-A406 CarbonylContact O-C 3.4Å; S403-A406 PolarHBondContact O-N 3.32Å; S403-A406 VanDerWaalsContact O-N 3.13Å; S403-A406 PolarHBondContact OG-N 3.08Å
407	H	88.1	Confident	89.6	Confident	27 Å²	27	29 Å²	29	13%	0.125	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.3	179	55	-81.9	0	0	0	109.8	F354 H355 V400 V401 S403 A404 L423	F354-H407 HydrophobicContact CD2-CB 3.72Å; F354-H407 AromaticContact CD2-CG 3.84Å; F354-H407 AromaticContact CD2-ND1 3.97Å; F354-H407 HydrophobicContact CE2-CB 3.74Å; H355-H407 AromaticContact CE1-CE1 3.61Å; H355-H407 AromaticContact CE1-NE2 3.74Å; H355-H407 AromaticContact ND1-CE1 3.97Å; H355-H407 AromaticContact ND1-NE2 3.77Å; V400-H407 HydrophobicContact CG1-CB 4.31Å; V401-H407 WeakPolarHBondContact O-CA 3.46Å; S403-H407 WeakPolarHBondContact O-CB 3.49Å; S403-H407 PolarHBondContact O-N 3.26Å; A404-H407 PolarHBondContact O-ND1 3.36Å; H407-L423 VanDerWaalsContact NE2-CD2 3.26Å; H407-L423 WeakPolarHBondContact NE2-CD2 3.5Å
408	N	91.7	Very high	89.5	Confident	24 Å²	24	28.1 Å²	28.1	13%	0.128	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	141.1	177.1	-62.2	-15.2	0	0	0	108.2	V401 W421	V401-N408 PolarHBondContact N-O 3.31Å; V401-N408 PolarHBondContact O-N 2.91Å; V401-N408 VanDerWaalsContact O-O 3.1Å; N408-W421 CarbonylContact C-O 3.46Å; N408-W421 VanDerWaalsContact CA-O 3.22Å; N408-W421 WeakPolarHBondContact CA-O 3.24Å
409	I	93	Very high	89.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	126.3	167.1	-60.6	149.5	0	0	0	106.6	V360 L398 V400 S420 W421 L423 L426	V360-I409 HydrophobicContact CB-CD1 4.46Å; V360-I409 HydrophobicContact CG1-CD1 3.88Å; V360-I409 HydrophobicContact CG1-CG1 4.37Å; V360-I409 HydrophobicContact CG1-CG2 4.11Å; V360-I409 HydrophobicContact CG2-CD1 3.75Å; V360-I409 HydrophobicContact CG2-CG1 4.25Å; L398-I409 HydrophobicContact CD2-CG2 3.83Å; V400-I409 HydrophobicContact CG2-CG1 4.17Å; I409-S420 CarbonylContact O-C 3.59Å; I409-S420 WeakPolarHBondContact O-CA 3.35Å; I409-W421 HydrophobicContact CB-CB 4.23Å; I409-W421 PolarHBondContact N-O 3.21Å; I409-W421 PolarHBondContact O-N 2.77Å; I409-L423 HydrophobicContact CD1-CD1 3.74Å; I409-L426 HydrophobicContact CD1-CD2 4.28Å
410	V	93.5	Very high	89.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.3	174.6	-176.5	0	0	0	0	108.4	L398 E399 V401 L418 C419 M448 F450	L398-V410 WeakPolarHBondContact CA-O 3.46Å; E399-V410 PolarHBondContact N-O 2.78Å; E399-V410 PolarHBondContact O-N 3.41Å; V401-V410 HydrophobicContact CB-CG2 4.41Å; V401-V410 HydrophobicContact CG2-CB 4.38Å; V401-V410 HydrophobicContact CG2-CG2 3.89Å; V410-L418 HydrophobicContact CG1-CD1 3.89Å; V410-L418 HydrophobicContact CG1-CD2 3.56Å; V410-L418 HydrophobicContact CG1-CG 3.59Å; V410-C419 WeakPolarHBondContact CA-O 3.36Å; V410-M448 HydrophobicContact CB-CE 3.98Å; V410-M448 HydrophobicContact CB-SD 4.44Å; V410-M448 HydrophobicContact CG1-CE 3.77Å; V410-M448 HydrophobicContact CG1-SD 3.65Å; V410-F450 HydrophobicContact CB-CE2 4.11Å; V410-F450 HydrophobicContact CB-CZ 4.15Å; V410-F450 HydrophobicContact CG1-CE2 4.25Å; V410-F450 HydrophobicContact CG1-CZ 4.1Å; V410-F450 HydrophobicContact CG2-CE2 4.26Å; V410-F450 HydrophobicContact CG2-CZ 3.91Å
411	S	93.9	Very high	89.4	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	141.2	-179.4	62.4	0	0	0	0	111.2	H391 L418 C419 W421	H391-S411 PolarHBondContact CD2-OG 3.36Å; H391-S411 PolarHBondContact NE2-O 3.24Å; H391-S411 PolarHBondContact NE2-OG 2.69Å; S411-L418 WeakPolarHBondContact O-CA 3.21Å; S411-C419 PolarHBondContact N-O 3.4Å; S411-C419 PolarHBondContact O-N 2.73Å; S411-C419 PolarHBondContact OG-O 2.9Å; S411-W421 PolarHBondContact OG-NE1 3.42Å
412	V	92.7	Very high	89.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.1	-179	173.6	0	0	0	0	110.4	I395 Y396 C397 L418 A445 M448	I395-V412 WeakPolarHBondContact CA-O 3.43Å; Y396-V412 PolarHBondContact N-O 3.03Å; C397-V412 PolarHBondContact O-N 3.43Å; V412-L418 HydrophobicContact CG2-CB 4.34Å; V412-L418 HydrophobicContact CG2-CD1 3.98Å; V412-L418 HydrophobicContact CG2-CG 4.07Å; V412-A445 HydrophobicContact CG1-CB 3.15Å; V412-M448 HydrophobicContact CB-CB 4.32Å; V412-M448 HydrophobicContact CG2-CB 3.89Å; V412-M448 HydrophobicContact CG2-CE 4.04Å; V412-M448 HydrophobicContact CG2-CG 4.06Å; V412-M448 HydrophobicContact CG2-SD 3.31Å; V412-M448 WeakPolarHBondContact CG2-SD 3.38Å
413	S	91.9	Very high	89.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	166.7	-170.4	169.4	0	0	0	0	111.1	H391 H393 P394 D415 G416	H391-S413 VanDerWaalsContact ND1-CB 3.26Å; H391-S413 WeakPolarHBondContact ND1-CB 3.11Å; H393-S413 WeakPolarHBondContact CB-OG 3.46Å; H393-S413 PolarHBondContact O-OG 2.67Å; P394-S413 PolarHBondContact O-OG 2.71Å; S413-D415 VanDerWaalsContact CB-OD1 3.23Å; S413-D415 WeakPolarHBondContact CB-OD1 3.4Å; S413-D415 PolarHBondContact O-N 3.4Å; S413-D415 VanDerWaalsContact OG-CG 3.25Å; S413-D415 PolarHBondContact OG-N 3.3Å; S413-D415 PolarHBondContact OG-OD1 3.44Å; S413-D415 PolarHBondContact OG-OD2 3.15Å; S413-G416 PolarHBondContact O-N 3.15Å
414	K	88.9	Confident	89.4	Confident	83 Å²	83	32.4 Å²	32.4	36%	0.361	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.5	176.1	-162.7	165.4	-179.6	167.3	0	114	H393 Y396 G416 D463	H393-K414 HydrophobicContact CB-CB 4.47Å; Y396-K414 HydrophobicContact CE2-CB 4.08Å; K414-G416 PolarHBondContact O-N 2.92Å; K414-G416 VanDerWaalsContact O-N 3.11Å; K414-D463 IonicContact NZ-OD2 3.47Å
415	D	88.2	Confident	89.4	Confident	9 Å²	9	35.3 Å²	35.3	5%	0.048	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-2.8	175.1	53.1	22.6	0	0	0	113.8	H391 T392 H393 S413 K417	H391-D415 VanDerWaalsContact CA-OD2 3.31Å; H391-D415 WeakPolarHBondContact CA-OD2 3.43Å; H391-D415 IonicContact CE1-OD1 3.33Å; H391-D415 IonicContact CG-OD2 2.93Å; H391-D415 IonicContact ND1-OD1 3.43Å; H391-D415 PolarHBondContact ND1-OD1 3.03Å; H391-D415 IonicContact ND1-OD2 3.37Å; H391-D415 PolarHBondContact ND1-OD2 3.33Å; H391-D415 VanDerWaalsContact ND1-OD2 3.11Å; T392-D415 PolarHBondContact N-OD2 3.21Å; H393-D415 HydrophobicContact CB-CB 3.99Å; S413-D415 VanDerWaalsContact CB-OD1 3.23Å; S413-D415 WeakPolarHBondContact CB-OD1 3.4Å; S413-D415 PolarHBondContact O-N 3.4Å; S413-D415 VanDerWaalsContact OG-CG 3.25Å; S413-D415 PolarHBondContact OG-N 3.3Å; S413-D415 PolarHBondContact OG-OD1 3.44Å; S413-D415 PolarHBondContact OG-OD2 3.15Å; D415-K417 VanDerWaalsContact C-N 3.26Å; D415-K417 PolarHBondContact O-N 3.02Å; D415-K417 WeakPolarHBondContact OD1-CB 3.46Å; D415-K417 PolarHBondContact OD1-N 3.01Å
416	G	85.7	Confident	89.4	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	67.2	31.7	-177.1	0	0	0	0	0	112.2	S413 K414 L435 V443	S413-G416 PolarHBondContact O-N 3.15Å; K414-G416 PolarHBondContact O-N 2.92Å; K414-G416 VanDerWaalsContact O-N 3.11Å; G416-L435 WeakPolarHBondContact O-CA 3.44Å; G416-L435 WeakPolarHBondContact O-CB 3.25Å; G416-L435 PolarHBondContact O-N 3.49Å; G416-V443 WeakPolarHBondContact CA-O 3.45Å
417	K	89	Confident	89.3	Confident	34 Å²	34	27.3 Å²	27.3	15%	0.148	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.9	169.3	-54.2	-166.5	175.7	-168.6	0	110	T388 H391 D415 T432 L433 D434	T388-K417 PolarHBondContact O-NZ 2.88Å; H391-K417 PolarHBondContact CE1-O 3.18Å; H391-K417 VanDerWaalsContact CE1-O 3.26Å; D415-K417 VanDerWaalsContact C-N 3.26Å; D415-K417 PolarHBondContact O-N 3.02Å; D415-K417 WeakPolarHBondContact OD1-CB 3.46Å; D415-K417 PolarHBondContact OD1-N 3.01Å; K417-T432 HydrophobicContact CD-CG2 3.97Å; K417-L433 CarbonylContact C-O 3.53Å; K417-L433 WeakPolarHBondContact CA-O 3.27Å; K417-D434 WeakPolarHBondContact CD-OD1 3.24Å; K417-D434 VanDerWaalsContact CE-OD1 3.28Å; K417-D434 WeakPolarHBondContact CE-OD1 3.26Å; K417-D434 WeakPolarHBondContact CG-OD1 3.19Å; K417-D434 IonicContact NZ-OD1 3.07Å
418	L	91.7	Very high	89.2	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.8	163.8	178.5	154.2	0	0	0	106.8	V410 S411 V412 L433 L435 M448 F458 I460	V410-L418 HydrophobicContact CG1-CD1 3.89Å; V410-L418 HydrophobicContact CG1-CD2 3.56Å; V410-L418 HydrophobicContact CG1-CG 3.59Å; S411-L418 WeakPolarHBondContact O-CA 3.21Å; V412-L418 HydrophobicContact CG2-CB 4.34Å; V412-L418 HydrophobicContact CG2-CD1 3.98Å; V412-L418 HydrophobicContact CG2-CG 4.07Å; L418-L433 HydrophobicContact CB-CB 4.33Å; L418-L433 HydrophobicContact CD2-CB 4.35Å; L418-L433 HydrophobicContact CD2-CD2 4.44Å; L418-L433 PolarHBondContact N-O 3.41Å; L418-L433 PolarHBondContact O-N 2.88Å; L418-L435 HydrophobicContact CB-CD1 4.23Å; L418-L435 HydrophobicContact CB-CD2 4.22Å; L418-L435 HydrophobicContact CB-CG 4.25Å; L418-M448 HydrophobicContact CD1-SD 3.87Å; L418-F458 HydrophobicContact CD1-CD1 4.12Å; L418-F458 HydrophobicContact CD1-CD2 4.16Å; L418-F458 HydrophobicContact CD1-CE1 3.84Å; L418-F458 HydrophobicContact CD1-CE2 3.92Å; L418-F458 HydrophobicContact CD1-CG 4.27Å; L418-F458 HydrophobicContact CD1-CZ 3.74Å; L418-I460 HydrophobicContact CD1-CD1 4.18Å
419	C	91.3	Very high	89.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133	179.7	-60.6	0	0	0	0	109.9	H391 V410 S411 W421 P429 E431	H391-C419 VanDerWaalsContact CE1-SG 3.5Å; H391-C419 PolarHBondContact NE2-SG 2.9Å; V410-C419 WeakPolarHBondContact CA-O 3.36Å; S411-C419 PolarHBondContact N-O 3.4Å; S411-C419 PolarHBondContact O-N 2.73Å; S411-C419 PolarHBondContact OG-O 2.9Å; C419-W421 HydrophobicContact CB-CZ2 4.09Å; C419-W421 VanDerWaalsContact CB-NE1 3.3Å; C419-P429 HydrophobicContact CB-CB 4.15Å; C419-E431 CarbonylContact C-O 3.2Å; C419-E431 WeakPolarHBondContact CA-O 3.45Å
420	S	92	Very high	88.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.1	170.7	-58.7	0	0	0	0	109.9	I409 P429 Q430 E431 R472	I409-S420 CarbonylContact O-C 3.59Å; I409-S420 WeakPolarHBondContact O-CA 3.35Å; S420-P429 CarbonylContact O-C 3.6Å; S420-Q430 PolarHBondContact O-N 2.8Å; S420-E431 PolarHBondContact N-O 2.93Å; S420-E431 PolarHBondContact O-N 2.98Å; S420-R472 VanDerWaalsContact OG-CD 3.25Å; S420-R472 WeakPolarHBondContact OG-CD 3.48Å
421	W	92	Very high	88.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.6	-175.8	-54.1	83.2	0	0	0	110.1	I368 A390 N408 I409 S411 C419 L426 Q428 P429	I368-W421 HydrophobicContact CD1-CD2 3.83Å; I368-W421 VanDerWaalsContact CD1-CE2 3.45Å; I368-W421 HydrophobicContact CD1-CG 3.77Å; I368-W421 HydrophobicContact CD1-CZ2 4.1Å; A390-W421 HydrophobicContact CB-CH2 3.57Å; A390-W421 HydrophobicContact CB-CZ2 3.94Å; N408-W421 CarbonylContact C-O 3.46Å; N408-W421 VanDerWaalsContact CA-O 3.22Å; N408-W421 WeakPolarHBondContact CA-O 3.24Å; I409-W421 HydrophobicContact CB-CB 4.23Å; I409-W421 PolarHBondContact N-O 3.21Å; I409-W421 PolarHBondContact O-N 2.77Å; S411-W421 PolarHBondContact OG-NE1 3.42Å; C419-W421 HydrophobicContact CB-CZ2 4.09Å; C419-W421 VanDerWaalsContact CB-NE1 3.3Å; W421-L426 HydrophobicContact CB-CD2 4.2Å; W421-L426 WeakPolarHBondContact CZ3-O 3.28Å; W421-Q428 VanDerWaalsContact CZ3-C 3.48Å; W421-P429 HydrophobicContact CD2-CB 4.04Å; W421-P429 HydrophobicContact CE3-CB 4.04Å; W421-P429 HydrophobicContact CH2-CB 3.99Å; W421-P429 HydrophobicContact CH2-CG 4.13Å; W421-P429 HydrophobicContact CZ2-CB 3.97Å; W421-P429 HydrophobicContact CZ2-CG 4.39Å; W421-P429 HydrophobicContact CZ3-CB 4.02Å; W421-P429 HydrophobicContact CZ3-CG 4.36Å; W421-P429 VanDerWaalsContact CZ3-N 3.27Å
422	S	90.3	Very high	88.3	Confident	31 Å²	31	44 Å²	44	22%	0.217	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	142.6	166.7	172.4	0	0	0	0	109.5	E424 M425 L426	S422-E424 PolarHBondContact O-N 3.23Å; S422-E424 PolarHBondContact OG-N 3.07Å; S422-M425 CarbonylContact O-C 3.52Å; S422-L426 WeakPolarHBondContact O-CD2 3.33Å
423	L	84.3	Confident	88	Confident	15 Å²	15	45.3 Å²	45.3	8%	0.079	23%	0.228	C	C	.	.	S	Bend	trans	-63.5	-29	178.9	-167.7	69.6	0	0	0	112.3	L358 V360 L370 H407 I409	L358-L423 HydrophobicContact CD1-CD2 3.72Å; L358-L423 HydrophobicContact CD1-CG 4.42Å; V360-L423 HydrophobicContact CG2-CD1 4.06Å; L370-L423 HydrophobicContact CD1-CD1 3.56Å; H407-L423 VanDerWaalsContact NE2-CD2 3.26Å; H407-L423 WeakPolarHBondContact NE2-CD2 3.5Å; I409-L423 HydrophobicContact CD1-CD1 3.74Å
424	E	85	Confident	87.8	Confident	174 Å²	174	49 Å²	49	81%	0.813	25%	0.248	S	C	*	.	S	Bend	trans	-82.6	-39	-177.7	-61.2	-178.4	173.5	0	0	112.3	S422	S422-E424 PolarHBondContact O-N 3.23Å; S422-E424 PolarHBondContact OG-N 3.07Å
425	M	83.3	Confident	87.6	Confident	116 Å²	116	45 Å²	45	57%	0.571	23%	0.231	S	C	*	.			trans	-117.2	87.9	-176.8	-172.9	70	93.4	0	0	110.3	S422 S427	S422-M425 CarbonylContact O-C 3.52Å; M425-S427 PolarHBondContact SD-OG 2.86Å
426	L	84.9	Confident	87.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.			trans	-87.7	-1.4	175.4	-64.3	172.6	0	0	0	113.6	L370 Q382 S384 I409 W421 S422 Q428	L370-L426 HydrophobicContact CB-CD1 3.79Å; Q382-L426 HydrophobicContact CB-CD1 4.09Å; Q382-L426 HydrophobicContact CG-CB 4.05Å; Q382-L426 HydrophobicContact CG-CD1 3.92Å; Q382-L426 HydrophobicContact CG-CG 4.46Å; S384-L426 WeakPolarHBondContact CA-O 3.41Å; S384-L426 WeakPolarHBondContact CB-O 3.32Å; I409-L426 HydrophobicContact CD1-CD2 4.28Å; W421-L426 HydrophobicContact CB-CD2 4.2Å; W421-L426 WeakPolarHBondContact CZ3-O 3.28Å; S422-L426 WeakPolarHBondContact O-CD2 3.33Å; L426-Q428 VanDerWaalsContact C-N 3.33Å; L426-Q428 PolarHBondContact O-N 2.58Å
427	S	84.7	Confident	86.6	Confident	57 Å²	57	51.2 Å²	51.2	40%	0.399	26%	0.261	S	S	.	.	S	Bend	trans	-66	-36.3	-176	65.4	0	0	0	0	112.8	A385 M425	A385-S427 WeakPolarHBondContact CB-O 3.47Å; M425-S427 PolarHBondContact SD-OG 2.86Å
428	Q	86.4	Confident	85.6	Confident	144 Å²	144	58.5 Å²	58.5	67%	0.673	29%	0.293	S	S	*	.	S	Bend	trans	-138.1	147.3	176.9	-67.5	-176.4	-5.8	0	0	109.4	W421 L426	W421-Q428 VanDerWaalsContact CZ3-C 3.48Å; L426-Q428 VanDerWaalsContact C-N 3.33Å; L426-Q428 PolarHBondContact O-N 2.58Å
429	P	88	Confident	84.2	Confident	20 Å²	20	67.2 Å²	67.2	13%	0.13	33%	0.333	C	S	.	.			trans	-66.4	142	171.6	27.9	-31.5	0	0	0	109.6	S389 C419 S420 W421 T432	S389-P429 WeakPolarHBondContact O-CG 3.46Å; C419-P429 HydrophobicContact CB-CB 4.15Å; S420-P429 CarbonylContact O-C 3.6Å; W421-P429 HydrophobicContact CD2-CB 4.04Å; W421-P429 HydrophobicContact CE3-CB 4.04Å; W421-P429 HydrophobicContact CH2-CB 3.99Å; W421-P429 HydrophobicContact CH2-CG 4.13Å; W421-P429 HydrophobicContact CZ2-CB 3.97Å; W421-P429 HydrophobicContact CZ2-CG 4.39Å; W421-P429 HydrophobicContact CZ3-CB 4.02Å; W421-P429 HydrophobicContact CZ3-CG 4.36Å; W421-P429 VanDerWaalsContact CZ3-N 3.27Å; P429-T432 WeakPolarHBondContact CG-OG1 3.3Å
430	Q	86.7	Confident	82.9	Confident	115 Å²	115	72.7 Å²	72.7	54%	0.537	37%	0.372	S	S	.	.	S	Bend	trans	-71.9	-39.7	176	-176.9	176.5	-19.1	0	0	110.7	S420	S420-Q430 PolarHBondContact O-N 2.8Å
431	E	87.3	Confident	82.3	Confident	67 Å²	67	77.8 Å²	77.8	31%	0.313	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.5	176.1	-58.1	-177.9	159	0	0	109.4	C419 S420 H473	C419-E431 CarbonylContact C-O 3.2Å; C419-E431 WeakPolarHBondContact CA-O 3.45Å; S420-E431 PolarHBondContact N-O 2.93Å; S420-E431 PolarHBondContact O-N 2.98Å; E431-H473 IonicContact OE1-CD2 2.97Å; E431-H473 PolarHBondContact OE1-CD2 3.11Å; E431-H473 IonicContact OE1-NE2 3.38Å; E431-H473 PolarHBondContact OE1-NE2 2.9Å; E431-H473 IonicContact OE2-CD2 3.73Å; E431-H473 PolarHBondContact OE2-CD2 2.93Å; E431-H473 IonicContact OE2-NE2 3.78Å; E431-H473 PolarHBondContact OE2-NE2 3.47Å
432	T	89.2	Confident	81.8	Confident	57 Å²	57	83 Å²	83	35%	0.35	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.1	172.1	-58.2	0	0	0	0	107.5	S389 K417 P429	S389-T432 WeakPolarHBondContact O-CG2 3.42Å; S389-T432 PolarHBondContact O-OG1 3.36Å; K417-T432 HydrophobicContact CD-CG2 3.97Å; P429-T432 WeakPolarHBondContact CG-OG1 3.3Å
433	L	87.6	Confident	81.6	Confident	28 Å²	28	81.7 Å²	81.7	15%	0.147	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.8	178.6	-174	79.5	0	0	0	108.7	K417 L418 L435 F458 A477	K417-L433 CarbonylContact C-O 3.53Å; K417-L433 WeakPolarHBondContact CA-O 3.27Å; L418-L433 HydrophobicContact CB-CB 4.33Å; L418-L433 HydrophobicContact CD2-CB 4.35Å; L418-L433 HydrophobicContact CD2-CD2 4.44Å; L418-L433 PolarHBondContact N-O 3.41Å; L418-L433 PolarHBondContact O-N 2.88Å; L433-L435 HydrophobicContact CD2-CD2 4.08Å; L433-L435 PolarHBondContact O-N 3.05Å; L433-F458 HydrophobicContact CD2-CE1 4.2Å; L433-F458 HydrophobicContact CD2-CZ 3.87Å; L433-A477 HydrophobicContact CD1-CB 4.09Å
434	D	87.9	Confident	81.7	Confident	77 Å²	77	81.1 Å²	81.1	41%	0.412	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	117.2	174.2	-70.8	-19.4	0	0	0	109.5	K417 Q436	K417-D434 WeakPolarHBondContact CD-OD1 3.24Å; K417-D434 VanDerWaalsContact CE-OD1 3.28Å; K417-D434 WeakPolarHBondContact CE-OD1 3.26Å; K417-D434 WeakPolarHBondContact CG-OD1 3.19Å; K417-D434 IonicContact NZ-OD1 3.07Å; D434-Q436 HydrophobicContact CB-CG 4.43Å; D434-Q436 PolarHBondContact O-N 3.39Å
435	L	83.2	Confident	81.9	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.368	C	S	.	.			trans	-80.1	84.2	179.5	-59.7	174	0	0	0	109.6	G416 L418 L433 V443 F458 I460 I479	G416-L435 WeakPolarHBondContact O-CA 3.44Å; G416-L435 WeakPolarHBondContact O-CB 3.25Å; G416-L435 PolarHBondContact O-N 3.49Å; L418-L435 HydrophobicContact CB-CD1 4.23Å; L418-L435 HydrophobicContact CB-CD2 4.22Å; L418-L435 HydrophobicContact CB-CG 4.25Å; L433-L435 HydrophobicContact CD2-CD2 4.08Å; L433-L435 PolarHBondContact O-N 3.05Å; L435-V443 PolarHBondContact O-N 2.9Å; L435-V443 VanDerWaalsContact O-N 3.11Å; L435-F458 HydrophobicContact CD2-CE2 4.37Å; L435-F458 HydrophobicContact CD2-CZ 4.33Å; L435-I460 HydrophobicContact CD1-CD1 3.42Å; L435-I460 VanDerWaalsContact CD1-CD1 3.42Å; L435-I460 HydrophobicContact CD2-CD1 3.84Å; L435-I460 HydrophobicContact CG-CD1 4.29Å; L435-I479 HydrophobicContact CB-CD1 3.96Å; L435-I479 HydrophobicContact CD2-CD1 4.34Å; L435-I479 HydrophobicContact CD2-CG1 4.09Å
436	Q	81.7	Confident	82.3	Confident	83 Å²	83	69.7 Å²	69.7	39%	0.388	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.2	178.6	-63.3	-178.8	7.6	0	0	110.5	D434 Q442	D434-Q436 HydrophobicContact CB-CG 4.43Å; D434-Q436 PolarHBondContact O-N 3.39Å; Q436-Q442 HydrophobicContact CG-CG 4.35Å
437	L	71.8	Confident	82.6	Confident	56 Å²	56	70.2 Å²	70.2	29%	0.293	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.8	170.2	-171.9	71.2	0	0	0	109.1	Q439 Y468 I479 V482	L437-Q439 PolarHBondContact O-N 2.82Å; L437-Y468 HydrophobicContact CD2-CE1 4.16Å; L437-I479 HydrophobicContact CD1-CG2 4.18Å; L437-V482 HydrophobicContact CD1-CG2 3.98Å; L437-V482 HydrophobicContact CD2-CG2 4.02Å
438	K	67.8	Low	83	Confident	187 Å²	187	67.5 Å²	67.5	81%	0.813	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	41.1	171.7	-61.7	177.9	-179	172.4	0	114.5	S440	K438-S440 VanDerWaalsContact C-N 3.34Å; K438-S440 PolarHBondContact O-N 2.8Å
439	Q	63.8	Low	83.4	Confident	184 Å²	184	65.2 Å²	65.2	86%	0.86	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	9.1	168.9	-58.9	-179.8	-13.8	0	0	118.3	L437	L437-Q439 PolarHBondContact O-N 2.82Å
440	S	63	Low	83.5	Confident	115 Å²	115	64.9 Å²	64.9	80%	0.804	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	-14.4	-176.8	77	0	0	0	0	117	K438	K438-S440 VanDerWaalsContact C-N 3.34Å; K438-S440 PolarHBondContact O-N 2.8Å
441	K	78.7	Confident	83.6	Confident	107 Å²	107	60.2 Å²	60.2	47%	0.465	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	129.5	-179.6	-163.5	179.8	174.7	-164.8	0	112	D464	K441-D464 IonicContact NZ-OD1 2.79Å; K441-D464 PolarHBondContact NZ-OD1 3.43Å; K441-D464 IonicContact NZ-OD2 3.5Å; K441-D464 PolarHBondContact NZ-OD2 2.95Å
442	Q	82.9	Confident	83.4	Confident	111 Å²	111	58.3 Å²	58.3	52%	0.519	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.7	166.4	-71.5	176.9	-23.2	0	0	108.3	Q436	Q436-Q442 HydrophobicContact CG-CG 4.35Å
443	V	84.9	Confident	83	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.012	31%	0.312	C	S	.	.			trans	-88.1	111.4	-178.4	175.3	0	0	0	0	109	G416 L435 Y468 I479	G416-V443 WeakPolarHBondContact CA-O 3.45Å; L435-V443 PolarHBondContact O-N 2.9Å; L435-V443 VanDerWaalsContact O-N 3.11Å; V443-Y468 HydrophobicContact CB-CE2 4.24Å; V443-Y468 HydrophobicContact CG1-CD2 3.48Å; V443-Y468 VanDerWaalsContact CG1-CD2 3.48Å; V443-Y468 HydrophobicContact CG1-CE2 3.23Å; V443-Y468 HydrophobicContact CG1-CG 4.49Å; V443-Y468 HydrophobicContact CG2-CE2 3.95Å; V443-I479 HydrophobicContact CB-CD1 4.32Å; V443-I479 HydrophobicContact CG2-CD1 4.02Å
444	G	87	Confident	82.9	Confident	4 Å²	4	64 Å²	64	4%	0.041	32%	0.319	C	S	.	.			trans	-71.6	129.8	173	0	0	0	0	0	110.2	S462 D463	G444-S462 CarbonylContact O-C 3.58Å; G444-S462 WeakPolarHBondContact O-CA 3.43Å; G444-S462 WeakPolarHBondContact O-CB 3.45Å; G444-D463 PolarHBondContact O-N 3.09Å
445	A	89.4	Confident	82.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.6	-174.5	0	0	0	0	0	112.2	Y396 V412 I460 G461	Y396-A445 WeakPolarHBondContact CD2-O 3.43Å; V412-A445 HydrophobicContact CG1-CB 3.15Å; A445-I460 HydrophobicContact CB-CG2 3.27Å; A445-G461 WeakPolarHBondContact CA-O 3.34Å
446	Y	91.7	Very high	83	Confident	49 Å²	49	65.7 Å²	65.7	19%	0.192	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-41.5	176.5	-75	-66	0	0	0	112.6	Y396 G461 D463 P489	Y396-Y446 WeakPolarHBondContact CB-O 3.44Å; Y396-Y446 HydrophobicContact CD1-CD1 4.25Å; Y396-Y446 AromaticContact CD2-CD1 3.89Å; Y396-Y446 HydrophobicContact CD2-CD1 3.89Å; Y396-Y446 HydrophobicContact CD2-CE1 4.35Å; Y396-Y446 HydrophobicContact CE1-CD1 4.22Å; Y396-Y446 HydrophobicContact CE1-CE1 4.25Å; Y396-Y446 AromaticContact CE2-CD1 3.83Å; Y396-Y446 HydrophobicContact CE2-CD1 3.83Å; Y396-Y446 AromaticContact CE2-CE1 3.81Å; Y396-Y446 HydrophobicContact CE2-CE1 3.81Å; Y396-Y446 HydrophobicContact CG-CD1 4.1Å; Y396-Y446 AromaticContact CZ-CE1 3.77Å; Y446-G461 PolarHBondContact N-O 2.79Å; Y446-D463 HydrophobicContact CD2-CB 4.15Å; Y446-D463 HydrophobicContact CE2-CB 3.44Å; Y446-D463 VanDerWaalsContact CE2-CB 3.44Å; Y446-P489 HydrophobicContact CD2-CB 4.23Å; Y446-P489 HydrophobicContact CE2-CB 3.91Å
447	C	91.6	Very high	83.5	Confident	11 Å²	11	64.7 Å²	64.7	7%	0.074	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.1	-178.7	61.4	0	0	0	0	111.3	I460 G461 V491	C447-I460 WeakPolarHBondContact O-CA 3.47Å; C447-G461 PolarHBondContact O-N 3.08Å; C447-V491 WeakPolarHBondContact CB-O 3.43Å
448	M	93.2	Very high	84.4	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.3	175.9	177.8	-169.2	62	0	0	108.7	C397 E399 V410 V412 L418 F450 F458 F459 I460	C397-M448 HydrophobicContact CB-CB 4.36Å; C397-M448 PolarHBondContact SG-O 3.22Å; C397-M448 VanDerWaalsContact SG-O 3.39Å; E399-M448 HydrophobicContact CB-CE 3.83Å; V410-M448 HydrophobicContact CB-CE 3.98Å; V410-M448 HydrophobicContact CB-SD 4.44Å; V410-M448 HydrophobicContact CG1-CE 3.77Å; V410-M448 HydrophobicContact CG1-SD 3.65Å; V412-M448 HydrophobicContact CB-CB 4.32Å; V412-M448 HydrophobicContact CG2-CB 3.89Å; V412-M448 HydrophobicContact CG2-CE 4.04Å; V412-M448 HydrophobicContact CG2-CG 4.06Å; V412-M448 HydrophobicContact CG2-SD 3.31Å; V412-M448 WeakPolarHBondContact CG2-SD 3.38Å; L418-M448 HydrophobicContact CD1-SD 3.87Å; M448-F450 HydrophobicContact CE-CD2 4.45Å; M448-F450 HydrophobicContact CE-CE2 3.72Å; M448-F450 HydrophobicContact CG-CE2 4.4Å; M448-F450 HydrophobicContact SD-CE2 3.68Å; M448-F450 HydrophobicContact SD-CZ 4.24Å; M448-F458 HydrophobicContact CG-CB 4.5Å; M448-F459 VanDerWaalsContact CA-O 3.27Å; M448-F459 WeakPolarHBondContact CA-O 3.45Å; M448-I460 HydrophobicContact CB-CG1 4.49Å; M448-I460 HydrophobicContact CG-CG1 4.3Å
449	R	93.5	Very high	85.7	Confident	95 Å²	95	53.9 Å²	53.9	36%	0.358	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	140	169.3	-75.9	-60.8	-162.4	-171.4	2.2	110.6	F458 F459 M493 D494	R449-F458 WeakPolarHBondContact O-CA 3.25Å; R449-F459 PolarHBondContact N-O 2.89Å; R449-F459 PolarHBondContact O-N 2.64Å; R449-M493 HydrophobicContact CB-CE 4.06Å; R449-M493 HydrophobicContact CG-CE 4.46Å; R449-M493 WeakPolarHBondContact CG-O 3.43Å; R449-D494 IonicContact CZ-OD1 3.96Å; R449-D494 IonicContact NE-OD1 3.53Å; R449-D494 PolarHBondContact NE-OD1 2.91Å; R449-D494 IonicContact NH2-OD1 2.9Å
450	F	91.4	Very high	87.1	Confident	13 Å²	13	45.2 Å²	45.2	6%	0.057	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	149.1	169.8	-76.5	-96.7	0	0	0	110.9	E399 V401 V410 M448 V455 N457 F458	E399-F450 HydrophobicContact CB-CD2 4.45Å; E399-F450 HydrophobicContact CG-CD2 4.36Å; E399-F450 WeakPolarHBondContact OE2-CD2 2.96Å; E399-F450 PolarHBondContact OE2-N 2.92Å; V401-F450 HydrophobicContact CB-CZ 4.49Å; V401-F450 HydrophobicContact CG1-CD1 3.85Å; V401-F450 HydrophobicContact CG1-CD2 4.45Å; V401-F450 HydrophobicContact CG1-CE1 3.97Å; V401-F450 HydrophobicContact CG1-CG 4.11Å; V401-F450 HydrophobicContact CG1-CZ 4.35Å; V401-F450 HydrophobicContact CG2-CD1 4.25Å; V401-F450 HydrophobicContact CG2-CD2 3.46Å; V401-F450 VanDerWaalsContact CG2-CD2 3.46Å; V401-F450 HydrophobicContact CG2-CE1 4.09Å; V401-F450 HydrophobicContact CG2-CE2 3.3Å; V401-F450 HydrophobicContact CG2-CG 3.96Å; V401-F450 HydrophobicContact CG2-CZ 3.65Å; V410-F450 HydrophobicContact CB-CE2 4.11Å; V410-F450 HydrophobicContact CB-CZ 4.15Å; V410-F450 HydrophobicContact CG1-CE2 4.25Å; V410-F450 HydrophobicContact CG1-CZ 4.1Å; V410-F450 HydrophobicContact CG2-CE2 4.26Å; V410-F450 HydrophobicContact CG2-CZ 3.91Å; M448-F450 HydrophobicContact CE-CD2 4.45Å; M448-F450 HydrophobicContact CE-CE2 3.72Å; M448-F450 HydrophobicContact CG-CE2 4.4Å; M448-F450 HydrophobicContact SD-CE2 3.68Å; M448-F450 HydrophobicContact SD-CZ 4.24Å; F450-V455 WeakPolarHBondContact CE1-O 3.38Å; F450-N457 WeakPolarHBondContact CD1-O 3.41Å; F450-F458 HydrophobicContact CD1-CB 3.97Å; F450-F458 HydrophobicContact CD2-CB 4.45Å; F450-F458 HydrophobicContact CE1-CB 3.78Å; F450-F458 HydrophobicContact CE1-CD1 4.21Å; F450-F458 HydrophobicContact CE1-CG 4.46Å; F450-F458 HydrophobicContact CE2-CB 4.25Å; F450-F458 HydrophobicContact CG-CB 4.31Å; F450-F458 HydrophobicContact CZ-CB 3.91Å; F450-F458 HydrophobicContact CZ-CD1 4.35Å; F450-F458 HydrophobicContact CZ-CG 4.48Å
451	A	88.4	Confident	88.5	Confident	17 Å²	17	39.7 Å²	39.7	14%	0.14	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-63.7	141.2	169.5	0	0	0	0	0	109.4	N453 D454 N457 F459	A451-N453 PolarHBondContact O-N 3.29Å; A451-D454 HydrophobicContact CB-CB 4.18Å; A451-D454 PolarHBondContact O-N 2.8Å; A451-D454 VanDerWaalsContact O-O 3.06Å; A451-N457 HydrophobicContact CB-CB 4.33Å; A451-N457 PolarHBondContact N-O 2.78Å; A451-N457 VanDerWaalsContact N-O 3.08Å; A451-F459 HydrophobicContact CB-CE2 3.97Å
452	P	82.7	Confident	89.2	Confident	28 Å²	28	34.6 Å²	34.6	18%	0.182	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	139.4	176.9	29.8	-38.2	0	0	0	109.6	D454 H496	P452-D454 PolarHBondContact O-N 3.42Å; P452-D454 VanDerWaalsContact O-N 3.1Å; P452-H496 VanDerWaalsContact CG-O 3.3Å; P452-H496 WeakPolarHBondContact CG-O 3.38Å
453	N	81.3	Confident	89.5	Confident	148 Å²	148	31.5 Å²	31.5	79%	0.791	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	-3.5	-176.7	-52.2	-36	0	0	0	116.6	A451	A451-N453 PolarHBondContact O-N 3.29Å
454	D	85	Confident	89.7	Confident	55 Å²	55	34.5 Å²	34.5	29%	0.294	18%	0.18	S	C	.	.			trans	-112.4	139.2	174.4	-159.4	-21	0	0	0	111.1	A451 P452 N456 N457	A451-D454 HydrophobicContact CB-CB 4.18Å; A451-D454 PolarHBondContact O-N 2.8Å; A451-D454 VanDerWaalsContact O-O 3.06Å; P452-D454 PolarHBondContact O-N 3.42Å; P452-D454 VanDerWaalsContact O-N 3.1Å; D454-N456 PolarHBondContact OD1-N 3.18Å; D454-N457 HydrophobicContact CB-CB 4.35Å; D454-N457 WeakPolarHBondContact OD2-CB 3.16Å; D454-N457 PolarHBondContact OD2-ND2 3Å
455	V	85.1	Confident	89.8	Confident	54 Å²	54	34.3 Å²	34.3	33%	0.327	18%	0.178	S	C	.	.	S	Bend	trans	-102.4	-14.5	-177.2	-178.7	0	0	0	0	110.3	V401 F450 R472	V401-V455 HydrophobicContact CG1-CB 4.03Å; V401-V455 HydrophobicContact CG1-CG1 3.46Å; V401-V455 VanDerWaalsContact CG1-CG1 3.46Å; V401-V455 HydrophobicContact CG1-CG2 4.5Å; F450-V455 WeakPolarHBondContact CE1-O 3.38Å; V455-R472 PolarHBondContact O-NH2 3.47Å
456	N	88.2	Confident	90	Very high	59 Å²	59	35.2 Å²	35.2	32%	0.316	18%	0.184	S	C	.	.	S	Bend	trans	-106	-36.8	-173.8	-65.6	-39.4	0	0	0	112.8	D454 C471 R472 H473	D454-N456 PolarHBondContact OD1-N 3.18Å; N456-C471 CarbonylContact O-C 3.56Å; N456-C471 WeakPolarHBondContact O-CA 3.42Å; N456-R472 PolarHBondContact O-N 3.09Å; N456-H473 PolarHBondContact OD1-ND1 3.1Å
457	N	91.2	Very high	90	Very high	63 Å²	63	32.9 Å²	32.9	34%	0.337	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	124.8	-178.8	-68.8	-20.2	0	0	0	110.6	F450 A451 D454 G470 C471	F450-N457 WeakPolarHBondContact CD1-O 3.41Å; A451-N457 HydrophobicContact CB-CB 4.33Å; A451-N457 PolarHBondContact N-O 2.78Å; A451-N457 VanDerWaalsContact N-O 3.08Å; D454-N457 HydrophobicContact CB-CB 4.35Å; D454-N457 WeakPolarHBondContact OD2-CB 3.16Å; D454-N457 PolarHBondContact OD2-ND2 3Å; N457-G470 WeakPolarHBondContact CA-O 3.48Å; N457-C471 PolarHBondContact OD1-SG 3.21Å
458	F	92.3	Very high	90.1	Very high	1 Å²	1	33 Å²	33	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.8	179	61.5	-103.2	0	0	0	110.4	L418 L433 L435 M448 R449 F450 I460 A469 G470 C471 R472	L418-F458 HydrophobicContact CD1-CD1 4.12Å; L418-F458 HydrophobicContact CD1-CD2 4.16Å; L418-F458 HydrophobicContact CD1-CE1 3.84Å; L418-F458 HydrophobicContact CD1-CE2 3.92Å; L418-F458 HydrophobicContact CD1-CG 4.27Å; L418-F458 HydrophobicContact CD1-CZ 3.74Å; L433-F458 HydrophobicContact CD2-CE1 4.2Å; L433-F458 HydrophobicContact CD2-CZ 3.87Å; L435-F458 HydrophobicContact CD2-CE2 4.37Å; L435-F458 HydrophobicContact CD2-CZ 4.33Å; M448-F458 HydrophobicContact CG-CB 4.5Å; R449-F458 WeakPolarHBondContact O-CA 3.25Å; F450-F458 HydrophobicContact CD1-CB 3.97Å; F450-F458 HydrophobicContact CD2-CB 4.45Å; F450-F458 HydrophobicContact CE1-CB 3.78Å; F450-F458 HydrophobicContact CE1-CD1 4.21Å; F450-F458 HydrophobicContact CE1-CG 4.46Å; F450-F458 HydrophobicContact CE2-CB 4.25Å; F450-F458 HydrophobicContact CG-CB 4.31Å; F450-F458 HydrophobicContact CZ-CB 3.91Å; F450-F458 HydrophobicContact CZ-CD1 4.35Å; F450-F458 HydrophobicContact CZ-CG 4.48Å; F458-I460 HydrophobicContact CD2-CD1 3.75Å; F458-I460 HydrophobicContact CD2-CG1 3.68Å; F458-I460 HydrophobicContact CE2-CD1 3.42Å; F458-I460 VanDerWaalsContact CE2-CD1 3.42Å; F458-I460 HydrophobicContact CE2-CG1 3.86Å; F458-I460 HydrophobicContact CZ-CD1 4.44Å; F458-A469 WeakPolarHBondContact O-CA 3.34Å; F458-G470 PolarHBondContact N-O 3.07Å; F458-G470 PolarHBondContact O-N 3.39Å; F458-C471 VanDerWaalsContact CE1-C 3.46Å; F458-R472 HydrophobicContact CD1-CB 4.32Å; F458-R472 HydrophobicContact CE1-CB 4.13Å
459	F	93.5	Very high	90	Very high	15 Å²	15	33.2 Å²	33.2	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	146.9	170.3	-56.7	-81.7	0	0	0	108.7	M448 R449 A451 V467 Y468 A469 Y483 M493 M508 T522	M448-F459 VanDerWaalsContact CA-O 3.27Å; M448-F459 WeakPolarHBondContact CA-O 3.45Å; R449-F459 PolarHBondContact N-O 2.89Å; R449-F459 PolarHBondContact O-N 2.64Å; A451-F459 HydrophobicContact CB-CE2 3.97Å; F459-V467 HydrophobicContact CB-CG1 4.35Å; F459-Y468 CarbonylContact C-O 3.53Å; F459-Y468 VanDerWaalsContact CA-O 3.32Å; F459-Y468 WeakPolarHBondContact CA-O 3.1Å; F459-A469 HydrophobicContact CD1-CB 3.7Å; F459-A469 HydrophobicContact CE1-CB 3.67Å; F459-Y483 HydrophobicContact CD1-CE2 4.38Å; F459-Y483 HydrophobicContact CE1-CE2 4.24Å; F459-M493 HydrophobicContact CB-CE 3.49Å; F459-M493 VanDerWaalsContact CB-CE 3.49Å; F459-M493 HydrophobicContact CB-SD 3.54Å; F459-M493 VanDerWaalsContact CB-SD 3.54Å; F459-M493 WeakPolarHBondContact O-CE 3.43Å; F459-M508 HydrophobicContact CB-SD 3.9Å; F459-M508 HydrophobicContact CD1-SD 3.92Å; F459-M508 HydrophobicContact CD2-SD 4.18Å; F459-M508 HydrophobicContact CG-SD 3.72Å; F459-T522 HydrophobicContact CE1-CG2 3.73Å; F459-T522 HydrophobicContact CE2-CG2 4.11Å; F459-T522 HydrophobicContact CZ-CG2 3.3Å
460	I	93.7	Very high	89.8	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127.5	179.2	-64.1	-178.4	0	0	0	109.4	L418 L435 A445 C447 M448 F458 V467 Y468	L418-I460 HydrophobicContact CD1-CD1 4.18Å; L435-I460 HydrophobicContact CD1-CD1 3.42Å; L435-I460 VanDerWaalsContact CD1-CD1 3.42Å; L435-I460 HydrophobicContact CD2-CD1 3.84Å; L435-I460 HydrophobicContact CG-CD1 4.29Å; A445-I460 HydrophobicContact CB-CG2 3.27Å; C447-I460 WeakPolarHBondContact O-CA 3.47Å; M448-I460 HydrophobicContact CB-CG1 4.49Å; M448-I460 HydrophobicContact CG-CG1 4.3Å; F458-I460 HydrophobicContact CD2-CD1 3.75Å; F458-I460 HydrophobicContact CD2-CG1 3.68Å; F458-I460 HydrophobicContact CE2-CD1 3.42Å; F458-I460 VanDerWaalsContact CE2-CD1 3.42Å; F458-I460 HydrophobicContact CE2-CG1 3.86Å; F458-I460 HydrophobicContact CZ-CD1 4.44Å; I460-V467 CarbonylContact O-C 3.52Å; I460-V467 WeakPolarHBondContact O-CA 2.93Å; I460-Y468 PolarHBondContact N-O 3.07Å; I460-Y468 PolarHBondContact O-N 3.29Å
461	G	93.3	Very high	89.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.6	168.9	0	0	0	0	0	110.9	A445 Y446 C447	A445-G461 WeakPolarHBondContact CA-O 3.34Å; Y446-G461 PolarHBondContact N-O 2.79Å; C447-G461 PolarHBondContact O-N 3.08Å
462	S	92.3	Very high	89.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	167	-177.9	74.1	0	0	0	0	114.2	G444 D464 G465 C466 Y468 T490	G444-S462 CarbonylContact O-C 3.58Å; G444-S462 WeakPolarHBondContact O-CA 3.43Å; G444-S462 WeakPolarHBondContact O-CB 3.45Å; S462-D464 PolarHBondContact O-N 3.02Å; S462-D464 PolarHBondContact OG-N 3.07Å; S462-G465 PolarHBondContact O-N 3.28Å; S462-C466 PolarHBondContact N-O 2.9Å; S462-C466 PolarHBondContact OG-N 3.39Å; S462-C466 PolarHBondContact OG-O 3.2Å; S462-Y468 VanDerWaalsContact CB-CE2 3.49Å; S462-Y468 WeakPolarHBondContact OG-CE2 3.39Å; S462-T490 PolarHBondContact O-N 2.85Å
463	D	90.2	Very high	89.5	Confident	46 Å²	46	31.5 Å²	31.5	25%	0.246	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.1	170.4	65	-26.6	0	0	0	114.1	K414 G444 Y446 G465 P489	K414-D463 IonicContact NZ-OD2 3.47Å; G444-D463 PolarHBondContact O-N 3.09Å; Y446-D463 HydrophobicContact CD2-CB 4.15Å; Y446-D463 HydrophobicContact CE2-CB 3.44Å; Y446-D463 VanDerWaalsContact CE2-CB 3.44Å; D463-G465 PolarHBondContact O-N 3.09Å; D463-P489 WeakPolarHBondContact O-CG 3.18Å
464	D	89.2	Confident	89.4	Confident	64 Å²	64	27 Å²	27	34%	0.342	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-5.1	175.6	-63.5	-19.2	0	0	0	113.1	K441 S462 C466	K441-D464 IonicContact NZ-OD1 2.79Å; K441-D464 PolarHBondContact NZ-OD1 3.43Å; K441-D464 IonicContact NZ-OD2 3.5Å; K441-D464 PolarHBondContact NZ-OD2 2.95Å; S462-D464 PolarHBondContact O-N 3.02Å; S462-D464 PolarHBondContact OG-N 3.07Å; D464-C466 VanDerWaalsContact C-N 3.27Å; D464-C466 PolarHBondContact O-N 3.2Å
465	G	89	Confident	88.8	Confident	1 Å²	1	33 Å²	33	1%	0.01	19%	0.19	C	C	.	.	S	Bend	trans	78.5	8.4	-174.5	0	0	0	0	0	114.6	S462 D463 H486 G488	S462-G465 PolarHBondContact O-N 3.28Å; D463-G465 PolarHBondContact O-N 3.09Å; G465-H486 WeakPolarHBondContact O-CB 3.27Å; G465-G488 WeakPolarHBondContact CA-O 3.44Å
466	C	92.3	Very high	88.4	Confident	18 Å²	18	38 Å²	38	12%	0.122	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	152.3	171.4	-60.5	0	0	0	0	109.9	S462 D464 Y468 V482	S462-C466 PolarHBondContact N-O 2.9Å; S462-C466 PolarHBondContact OG-N 3.39Å; S462-C466 PolarHBondContact OG-O 3.2Å; D464-C466 VanDerWaalsContact C-N 3.27Å; D464-C466 PolarHBondContact O-N 3.2Å; C466-Y468 HydrophobicContact CB-CD2 4.49Å; C466-Y468 HydrophobicContact CB-CE1 4.43Å; C466-Y468 HydrophobicContact CB-CE2 3.87Å; C466-V482 HydrophobicContact CB-CG1 4.04Å
467	V	93.3	Very high	88	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.5	165.7	-178.2	0	0	0	0	108	F459 I460 Y483 T490 M493 M508 T510	F459-V467 HydrophobicContact CB-CG1 4.35Å; I460-V467 CarbonylContact O-C 3.52Å; I460-V467 WeakPolarHBondContact O-CA 2.93Å; V467-Y483 HydrophobicContact CB-CD2 4.49Å; V467-Y483 HydrophobicContact CG1-CD2 4.5Å; V467-Y483 PolarHBondContact N-O 2.93Å; V467-Y483 WeakPolarHBondContact O-CD2 3.06Å; V467-Y483 PolarHBondContact O-N 2.94Å; V467-T490 HydrophobicContact CG2-CG2 4.01Å; V467-M493 HydrophobicContact CG1-SD 3.79Å; V467-M508 HydrophobicContact CG1-CE 3.84Å; V467-M508 HydrophobicContact CG1-SD 4.17Å; V467-T510 HydrophobicContact CG2-CG2 3.79Å
468	Y	92.5	Very high	87.7	Confident	12 Å²	12	35 Å²	35	5%	0.047	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.5	-179.3	-67.3	-73.4	0	0	0	109.4	L437 V443 F459 I460 S462 C466 I479 E481 V482	L437-Y468 HydrophobicContact CD2-CE1 4.16Å; V443-Y468 HydrophobicContact CB-CE2 4.24Å; V443-Y468 HydrophobicContact CG1-CD2 3.48Å; V443-Y468 VanDerWaalsContact CG1-CD2 3.48Å; V443-Y468 HydrophobicContact CG1-CE2 3.23Å; V443-Y468 HydrophobicContact CG1-CG 4.49Å; V443-Y468 HydrophobicContact CG2-CE2 3.95Å; F459-Y468 CarbonylContact C-O 3.53Å; F459-Y468 VanDerWaalsContact CA-O 3.32Å; F459-Y468 WeakPolarHBondContact CA-O 3.1Å; I460-Y468 PolarHBondContact N-O 3.07Å; I460-Y468 PolarHBondContact O-N 3.29Å; S462-Y468 VanDerWaalsContact CB-CE2 3.49Å; S462-Y468 WeakPolarHBondContact OG-CE2 3.39Å; C466-Y468 HydrophobicContact CB-CD2 4.49Å; C466-Y468 HydrophobicContact CB-CE1 4.43Å; C466-Y468 HydrophobicContact CB-CE2 3.87Å; Y468-I479 HydrophobicContact CD1-CD1 4.16Å; Y468-I479 HydrophobicContact CD1-CG2 3.52Å; Y468-I479 HydrophobicContact CE1-CG2 4.4Å; Y468-I479 HydrophobicContact CG-CD1 4.04Å; Y468-I479 HydrophobicContact CG-CG2 4.09Å; Y468-E481 WeakPolarHBondContact CA-O 3.46Å; Y468-V482 HydrophobicContact CD1-CB 4.23Å; Y468-V482 HydrophobicContact CD1-CG1 3.98Å; Y468-V482 HydrophobicContact CD1-CG2 3.76Å; Y468-V482 HydrophobicContact CE1-CB 4.12Å; Y468-V482 HydrophobicContact CE1-CG1 3.55Å; Y468-V482 HydrophobicContact CE1-CG2 3.61Å
469	A	92	Very high	87.3	Confident	7 Å²	7	36.1 Å²	36.1	6%	0.058	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	141.4	165.8	0	0	0	0	0	109.7	F458 F459 T480 E481 Y483	F458-A469 WeakPolarHBondContact O-CA 3.34Å; F459-A469 HydrophobicContact CD1-CB 3.7Å; F459-A469 HydrophobicContact CE1-CB 3.67Å; A469-T480 PolarHBondContact O-N 3.42Å; A469-T480 PolarHBondContact O-OG1 3.32Å; A469-E481 HydrophobicContact CB-CB 4.08Å; A469-E481 PolarHBondContact N-O 3.24Å; A469-E481 PolarHBondContact O-N 2.92Å; A469-Y483 HydrophobicContact CB-CE2 3.77Å
470	G	89.9	Confident	87	Confident	2 Å²	2	38.3 Å²	38.3	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	166.9	179.6	0	0	0	0	0	113.1	N457 F458 G478	N457-G470 WeakPolarHBondContact CA-O 3.48Å; F458-G470 PolarHBondContact N-O 3.07Å; F458-G470 PolarHBondContact O-N 3.39Å; G470-G478 CarbonylContact C-O 3.54Å; G470-G478 WeakPolarHBondContact CA-O 3.32Å
471	C	89.8	Confident	86.7	Confident	26 Å²	26	42 Å²	42	18%	0.176	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137	175.9	-57.3	0	0	0	0	109	N456 N457 F458 A477 G478	N456-C471 CarbonylContact O-C 3.56Å; N456-C471 WeakPolarHBondContact O-CA 3.42Å; N457-C471 PolarHBondContact OD1-SG 3.21Å; F458-C471 VanDerWaalsContact CE1-C 3.46Å; C471-A477 WeakPolarHBondContact O-CA 3.21Å; C471-G478 PolarHBondContact N-O 3.26Å; C471-G478 PolarHBondContact O-N 2.91Å
472	R	83.8	Confident	86.7	Confident	15 Å²	15	43.6 Å²	43.6	6%	0.057	25%	0.248	C	C	.	.	S	Bend	trans	-74.2	-44.3	176.8	-177.3	176.6	60.3	-172.2	2.3	112.2	S420 V455 N456 F458	S420-R472 VanDerWaalsContact OG-CD 3.25Å; S420-R472 WeakPolarHBondContact OG-CD 3.48Å; V455-R472 PolarHBondContact O-NH2 3.47Å; N456-R472 PolarHBondContact O-N 3.09Å; F458-R472 HydrophobicContact CD1-CB 4.32Å; F458-R472 HydrophobicContact CE1-CB 4.13Å
473	H	82.1	Confident	86.7	Confident	73 Å²	73	43.7 Å²	43.7	34%	0.338	25%	0.248	S	C	.	.	S	Bend	trans	-117.2	151.9	-177.1	-54.6	111.6	0	0	0	111.4	E431 N456	E431-H473 IonicContact OE1-CD2 2.97Å; E431-H473 PolarHBondContact OE1-CD2 3.11Å; E431-H473 IonicContact OE1-NE2 3.38Å; E431-H473 PolarHBondContact OE1-NE2 2.9Å; E431-H473 IonicContact OE2-CD2 3.73Å; E431-H473 PolarHBondContact OE2-CD2 2.93Å; E431-H473 IonicContact OE2-NE2 3.78Å; E431-H473 PolarHBondContact OE2-NE2 3.47Å; N456-H473 PolarHBondContact OD1-ND1 3.1Å
474	G	78.1	Confident	86.7	Confident	53 Å²	53	48.4 Å²	48.4	55%	0.546	27%	0.269	S	S	.	.	S	Bend	trans	112.7	-178.7	171.9	0	0	0	0	0	113.9	K476 A477	G474-K476 PolarHBondContact O-N 2.9Å; G474-K476 VanDerWaalsContact O-N 3.16Å; G474-A477 VanDerWaalsContact O-CB 3.25Å; G474-A477 WeakPolarHBondContact O-CB 3.25Å; G474-A477 PolarHBondContact O-N 3.33Å
475	N	73.3	Confident	86.5	Confident	181 Å²	181	46.6 Å²	46.6	97%	0.968	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.5	-176.3	-63.2	-4.3	0	0	0	113.2
476	K	76.7	Confident	86.7	Confident	161 Å²	161	47.3 Å²	47.3	70%	0.7	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	29.4	173.9	-61.3	-175.2	179.2	-178.2	0	111.5	G474 G478 T480	G474-K476 PolarHBondContact O-N 2.9Å; G474-K476 VanDerWaalsContact O-N 3.16Å; K476-G478 PolarHBondContact O-N 3.02Å; K476-T480 HydrophobicContact CB-CG2 3.99Å
477	A	80.1	Confident	86.6	Confident	49 Å²	49	51.9 Å²	51.9	41%	0.405	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-59.5	129	174.9	0	0	0	0	0	109.9	L433 C471 G474	L433-A477 HydrophobicContact CD1-CB 4.09Å; C471-A477 WeakPolarHBondContact O-CA 3.21Å; G474-A477 VanDerWaalsContact O-CB 3.25Å; G474-A477 WeakPolarHBondContact O-CB 3.25Å; G474-A477 PolarHBondContact O-N 3.33Å
478	G	83.7	Confident	86.5	Confident	9 Å²	9	52.4 Å²	52.4	9%	0.093	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.3	-168.3	-170.4	0	0	0	0	0	112.3	G470 C471 K476	G470-G478 CarbonylContact C-O 3.54Å; G470-G478 WeakPolarHBondContact CA-O 3.32Å; C471-G478 PolarHBondContact N-O 3.26Å; C471-G478 PolarHBondContact O-N 2.91Å; K476-G478 PolarHBondContact O-N 3.02Å
479	I	85.3	Confident	86.5	Confident	25 Å²	25	53.4 Å²	53.4	13%	0.128	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.3	176.7	-64.2	170.1	0	0	0	108.7	L435 L437 V443 Y468	L435-I479 HydrophobicContact CB-CD1 3.96Å; L435-I479 HydrophobicContact CD2-CD1 4.34Å; L435-I479 HydrophobicContact CD2-CG1 4.09Å; L437-I479 HydrophobicContact CD1-CG2 4.18Å; V443-I479 HydrophobicContact CB-CD1 4.32Å; V443-I479 HydrophobicContact CG2-CD1 4.02Å; Y468-I479 HydrophobicContact CD1-CD1 4.16Å; Y468-I479 HydrophobicContact CD1-CG2 3.52Å; Y468-I479 HydrophobicContact CE1-CG2 4.4Å; Y468-I479 HydrophobicContact CG-CD1 4.04Å; Y468-I479 HydrophobicContact CG-CG2 4.09Å
480	T	86.3	Confident	86.6	Confident	60 Å²	60	53.1 Å²	53.1	37%	0.368	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-42	178.8	51.4	0	0	0	0	112.1	A469 K476	A469-T480 PolarHBondContact O-N 3.42Å; A469-T480 PolarHBondContact O-OG1 3.32Å; K476-T480 HydrophobicContact CB-CG2 3.99Å
481	E	88.7	Confident	86.8	Confident	78 Å²	78	54.6 Å²	54.6	36%	0.364	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150.3	-167.7	-73.3	174.1	-174.4	0	0	110.5	Y468 A469 Y483 F525	Y468-E481 WeakPolarHBondContact CA-O 3.46Å; A469-E481 HydrophobicContact CB-CB 4.08Å; A469-E481 PolarHBondContact N-O 3.24Å; A469-E481 PolarHBondContact O-N 2.92Å; E481-Y483 PolarHBondContact OE2-OH 3.23Å; E481-F525 HydrophobicContact CB-CE1 4.08Å; E481-F525 HydrophobicContact CG-CE1 3.99Å; E481-F525 HydrophobicContact CG-CZ 4.34Å
482	V	91.5	Very high	86.9	Confident	34 Å²	34	53.5 Å²	53.5	21%	0.206	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.1	-178.6	-169.7	0	0	0	0	107.8	L437 C466 Y468 E484	L437-V482 HydrophobicContact CD1-CG2 3.98Å; L437-V482 HydrophobicContact CD2-CG2 4.02Å; C466-V482 HydrophobicContact CB-CG1 4.04Å; Y468-V482 HydrophobicContact CD1-CB 4.23Å; Y468-V482 HydrophobicContact CD1-CG1 3.98Å; Y468-V482 HydrophobicContact CD1-CG2 3.76Å; Y468-V482 HydrophobicContact CE1-CB 4.12Å; Y468-V482 HydrophobicContact CE1-CG1 3.55Å; Y468-V482 HydrophobicContact CE1-CG2 3.61Å; V482-E484 HydrophobicContact CG1-CG 3.9Å
483	Y	92.2	Very high	87.4	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	110.2	171.6	-57.3	-91.9	0	0	0	107.7	F459 V467 A469 E481 W520 T522 E524 F525	F459-Y483 HydrophobicContact CD1-CE2 4.38Å; F459-Y483 HydrophobicContact CE1-CE2 4.24Å; V467-Y483 HydrophobicContact CB-CD2 4.49Å; V467-Y483 HydrophobicContact CG1-CD2 4.5Å; V467-Y483 PolarHBondContact N-O 2.93Å; V467-Y483 WeakPolarHBondContact O-CD2 3.06Å; V467-Y483 PolarHBondContact O-N 2.94Å; A469-Y483 HydrophobicContact CB-CE2 3.77Å; E481-Y483 PolarHBondContact OE2-OH 3.23Å; Y483-W520 HydrophobicContact CD1-CE3 4.12Å; Y483-W520 HydrophobicContact CD1-CZ3 4.39Å; Y483-T522 PolarHBondContact OH-O 3.39Å; Y483-E524 WeakPolarHBondContact CD1-O 3.3Å; Y483-E524 VanDerWaalsContact CE1-O 3.24Å; Y483-E524 WeakPolarHBondContact CE1-O 3.25Å; Y483-F525 HydrophobicContact CD1-CD1 4.27Å; Y483-F525 HydrophobicContact CE1-CD1 4.17Å
484	E	91.3	Very high	88	Confident	145 Å²	145	50.3 Å²	50.3	68%	0.678	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	125	178.6	-62.2	-175.7	176.4	0	0	108.5	V482	V482-E484 HydrophobicContact CG1-CG 3.9Å
485	G	85.5	Confident	88.7	Confident	27 Å²	27	48 Å²	48	28%	0.278	28%	0.275	S	S	.	.			trans	-174.3	-29.2	174.4	0	0	0	0	0	115.4	K518	G485-K518 PolarHBondContact O-NZ 3.28Å
486	H	91.7	Very high	89.6	Confident	15 Å²	15	39.5 Å²	39.5	7%	0.069	23%	0.23	C	C	.	.			trans	-78.5	147.1	173.9	-73.9	-74.9	0	0	0	111.6	G465 T510 S512 D514 T516 K518	G465-H486 WeakPolarHBondContact O-CB 3.27Å; H486-T510 PolarHBondContact NE2-OG1 2.77Å; H486-S512 WeakPolarHBondContact ND1-CB 3.44Å; H486-D514 VanDerWaalsContact CA-OD2 3.29Å; H486-D514 WeakPolarHBondContact CA-OD2 3.38Å; H486-D514 WeakPolarHBondContact CB-OD2 3.43Å; H486-D514 IonicContact CG-OD2 3.09Å; H486-D514 IonicContact ND1-OD1 2.64Å; H486-D514 PolarHBondContact ND1-OD1 3.32Å; H486-D514 IonicContact ND1-OD2 3.78Å; H486-D514 PolarHBondContact ND1-OD2 3.29Å; H486-T516 PolarHBondContact CE1-OG1 3.29Å; H486-T516 PolarHBondContact ND1-OG1 3.21Å; H486-K518 WeakPolarHBondContact CE1-CG 3.47Å
487	S	91	Very high	90	Very high	115 Å²	115	34.1 Å²	34.1	80%	0.804	21%	0.211	S	C	*	.	S	Bend	trans	-91.9	-10.9	176.9	-61.9	0	0	0	0	112.9	D514	S487-D514 PolarHBondContact N-OD2 3.14Å
488	G	91.1	Very high	90	Very high	11 Å²	11	32 Å²	32	11%	0.113	19%	0.193	C	C	.	.	S	Bend	trans	-134.2	173.1	178.8	0	0	0	0	0	112.2	G465 T490 S512	G465-G488 WeakPolarHBondContact CA-O 3.44Å; G488-T490 PolarHBondContact O-N 3.29Å; G488-S512 PolarHBondContact O-OG 3.49Å
489	P	93.5	Very high	89.9	Confident	34 Å²	34	37.3 Å²	37.3	22%	0.221	22%	0.224	C	C	.	.			trans	-51.3	132.1	179.4	-27.4	33	0	0	0	113.2	Y446 D463 V491 S512 F513	Y446-P489 HydrophobicContact CD2-CB 4.23Å; Y446-P489 HydrophobicContact CE2-CB 3.91Å; D463-P489 WeakPolarHBondContact O-CG 3.18Å; P489-V491 HydrophobicContact CB-CG2 4.41Å; P489-V491 PolarHBondContact O-N 3.21Å; P489-S512 VanDerWaalsContact O-CA 3.27Å; P489-S512 WeakPolarHBondContact O-CA 3.39Å; P489-S512 WeakPolarHBondContact O-CB 3.45Å; P489-S512 PolarHBondContact O-OG 2.78Å; P489-F513 HydrophobicContact CB-CD2 3.92Å; P489-F513 HydrophobicContact CB-CE2 4.39Å; P489-F513 HydrophobicContact CG-CD2 3.9Å; P489-F513 PolarHBondContact O-N 3.38Å; P489-F513 VanDerWaalsContact O-N 3.17Å
490	T	94.3	Very high	89.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	112.3	175.6	-54.7	0	0	0	0	108.8	S462 V467 G488 T510 C511	S462-T490 PolarHBondContact O-N 2.85Å; V467-T490 HydrophobicContact CG2-CG2 4.01Å; G488-T490 PolarHBondContact O-N 3.29Å; T490-T510 HydrophobicContact CG2-CG2 4.45Å; T490-C511 WeakPolarHBondContact CA-O 3.3Å; T490-C511 WeakPolarHBondContact CG2-O 3.01Å
491	V	92.5	Very high	89.3	Confident	33 Å²	33	40.3 Å²	40.3	20%	0.2	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-30.5	-167.3	175.8	0	0	0	0	111.8	C447 P489 C511 F513	C447-V491 WeakPolarHBondContact CB-O 3.43Å; P489-V491 HydrophobicContact CB-CG2 4.41Å; P489-V491 PolarHBondContact O-N 3.21Å; V491-C511 PolarHBondContact N-O 2.79Å; V491-F513 HydrophobicContact CB-CE1 4.17Å; V491-F513 HydrophobicContact CB-CZ 4.4Å; V491-F513 HydrophobicContact CG1-CE1 4.19Å; V491-F513 HydrophobicContact CG1-CZ 4.31Å; V491-F513 HydrophobicContact CG2-CD1 3.68Å; V491-F513 HydrophobicContact CG2-CD2 3.92Å; V491-F513 HydrophobicContact CG2-CE1 3.35Å; V491-F513 HydrophobicContact CG2-CE2 3.62Å; V491-F513 HydrophobicContact CG2-CG 3.96Å; V491-F513 HydrophobicContact CG2-CZ 3.33Å
492	G	93.1	Very high	89.1	Confident	4 Å²	4	39.3 Å²	39.3	4%	0.041	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.4	177.9	0	0	0	0	0	111.3	T510 C511	G492-T510 WeakPolarHBondContact O-CA 3.42Å; G492-C511 WeakPolarHBondContact CA-SG 3.06Å; G492-C511 PolarHBondContact N-O 2.7Å; G492-C511 PolarHBondContact N-SG 2.83Å; G492-C511 PolarHBondContact O-N 3.47Å
493	M	94.5	Very high	88.7	Confident	7 Å²	7	42.4 Å²	42.4	3%	0.034	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	141.3	-177.2	178.3	171	64.9	0	0	109.2	R449 F459 V467 M508 L509 T510	R449-M493 HydrophobicContact CB-CE 4.06Å; R449-M493 HydrophobicContact CG-CE 4.46Å; R449-M493 WeakPolarHBondContact CG-O 3.43Å; F459-M493 HydrophobicContact CB-CE 3.49Å; F459-M493 VanDerWaalsContact CB-CE 3.49Å; F459-M493 HydrophobicContact CB-SD 3.54Å; F459-M493 VanDerWaalsContact CB-SD 3.54Å; F459-M493 WeakPolarHBondContact O-CE 3.43Å; V467-M493 HydrophobicContact CG1-SD 3.79Å; M493-M508 HydrophobicContact CG-CG 3.89Å; M493-M508 HydrophobicContact CG-SD 3.86Å; M493-M508 HydrophobicContact SD-CG 4.29Å; M493-M508 HydrophobicContact SD-SD 3.44Å; M493-L509 CarbonylContact C-O 3.6Å; M493-L509 VanDerWaalsContact CA-O 3.24Å; M493-L509 WeakPolarHBondContact CA-O 3.49Å; M493-T510 HydrophobicContact CB-CG2 4.49Å; M493-T510 HydrophobicContact CG-CG2 4.07Å; M493-T510 HydrophobicContact SD-CG2 4.3Å
494	D	94.7	Very high	88.4	Confident	13 Å²	13	43.2 Å²	43.2	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	135	175.6	-155.7	40.2	0	0	0	111.6	R449 M508 L509 A542 W543	R449-D494 IonicContact CZ-OD1 3.96Å; R449-D494 IonicContact NE-OD1 3.53Å; R449-D494 PolarHBondContact NE-OD1 2.91Å; R449-D494 IonicContact NH2-OD1 2.9Å; D494-M508 WeakPolarHBondContact O-CA 3.39Å; D494-L509 PolarHBondContact N-O 2.77Å; D494-L509 PolarHBondContact O-N 3.44Å; D494-A542 WeakPolarHBondContact OD2-CA 3.46Å; D494-W543 PolarHBondContact O-NE1 3.06Å; D494-W543 PolarHBondContact OD2-N 3.26Å
495	C	92.7	Very high	88	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.034	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	151.7	175.9	-58.8	0	0	0	0	109.3	T497	C495-T497 WeakPolarHBondContact O-CG2 3.48Å; C495-T497 PolarHBondContact O-N 2.85Å
496	H	91.6	Very high	88.2	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.009	24%	0.242	C	C	.	.			trans	-65.9	120.6	175.9	-170.5	-79.8	0	0	0	110.8	P452 L507 W543 P548	P452-H496 VanDerWaalsContact CG-O 3.3Å; P452-H496 WeakPolarHBondContact CG-O 3.38Å; H496-L507 HydrophobicContact CB-CB 3.98Å; H496-L507 PolarHBondContact N-O 3.36Å; H496-W543 AromaticContact CD2-CE3 3.97Å; H496-P548 PolarHBondContact CD2-O 2.82Å; H496-P548 VanDerWaalsContact NE2-CA 3.32Å; H496-P548 WeakPolarHBondContact NE2-CA 3.32Å; H496-P548 PolarHBondContact NE2-O 2.87Å
497	T	85.6	Confident	88.3	Confident	49 Å²	49	38.1 Å²	38.1	30%	0.301	24%	0.241	S	C	.	.			trans	-112	-3.8	-175.5	62.3	0	0	0	0	114.3	C495 T499	C495-T497 WeakPolarHBondContact O-CG2 3.48Å; C495-T497 PolarHBondContact O-N 2.85Å; T497-T499 PolarHBondContact O-N 2.85Å
498	A	79.4	Confident	88.4	Confident	4 Å²	4	32.6 Å²	32.6	3%	0.033	20%	0.203	C	C	.	.			trans	-75.1	119.5	-175.2	0	0	0	0	0	110	P545 W622	A498-P545 WeakPolarHBondContact CA-O 3.27Å; A498-W622 HydrophobicContact CB-CH2 3.98Å
499	T	80.6	Confident	88.6	Confident	120 Å²	120	32.1 Å²	32.1	74%	0.736	20%	0.197	S	C	*	.			trans	-84.7	121.1	177.6	53.4	0	0	0	0	109.7	T497	T497-T499 PolarHBondContact O-N 2.85Å
500	G	78.3	Confident	88.7	Confident	34 Å²	34	30.5 Å²	30.5	35%	0.351	19%	0.187	S	C	.	.			trans	-145.3	-172.7	177.1	0	0	0	0	0	113	I502	G500-I502 PolarHBondContact O-N 3.05Å
501	P	82.3	Confident	88.8	Confident	115 Å²	115	30.5 Å²	30.5	75%	0.747	19%	0.187	S	C	*	.	S	Bend	trans	-63.9	-25.3	179.2	26.8	-35.3	0	0	0	112.7	W622	P501-W622 HydrophobicContact CG-CB 4.27Å; P501-W622 HydrophobicContact CG-CD2 4.27Å; P501-W622 HydrophobicContact CG-CG 3.95Å
502	I	84.1	Confident	88.9	Confident	56 Å²	56	28.9 Å²	28.9	29%	0.287	18%	0.177	S	C	.	.	S	Bend	trans	-114.5	125.2	175.8	-56.1	175.5	0	0	0	107.3	G500 F504 W622	G500-I502 PolarHBondContact O-N 3.05Å; I502-F504 HydrophobicContact CB-CE2 4.14Å; I502-F504 HydrophobicContact CB-CZ 4.16Å; I502-F504 HydrophobicContact CG2-CD1 4.43Å; I502-F504 HydrophobicContact CG2-CE1 3.87Å; I502-F504 HydrophobicContact CG2-CE2 4.04Å; I502-F504 HydrophobicContact CG2-CZ 3.65Å; I502-W622 HydrophobicContact CD1-CB 4.15Å; I502-W622 HydrophobicContact CG1-CB 4.48Å; I502-W622 WeakPolarHBondContact O-CZ3 3.26Å
503	D	83	Confident	88.9	Confident	99 Å²	99	32.2 Å²	32.2	53%	0.529	19%	0.19	S	C	.	.			trans	-83.7	120.7	178.3	-175	20.1	0	0	0	111	S505	D503-S505 WeakPolarHBondContact OD1-CB 3.47Å; D503-S505 PolarHBondContact OD1-N 2.89Å; D503-S505 PolarHBondContact OD1-OG 2.84Å; D503-S505 WeakPolarHBondContact OD2-CB 3.36Å; D503-S505 PolarHBondContact OD2-OG 2.83Å
504	F	85.4	Confident	88.9	Confident	19 Å²	19	33.2 Å²	33.2	8%	0.083	20%	0.196	C	C	.	.			trans	-108.8	22	176	-65.2	-64.2	0	0	0	112.4	I502 N506 L507 P548 W622 L625 L629	I502-F504 HydrophobicContact CB-CE2 4.14Å; I502-F504 HydrophobicContact CB-CZ 4.16Å; I502-F504 HydrophobicContact CG2-CD1 4.43Å; I502-F504 HydrophobicContact CG2-CE1 3.87Å; I502-F504 HydrophobicContact CG2-CE2 4.04Å; I502-F504 HydrophobicContact CG2-CZ 3.65Å; F504-N506 PolarHBondContact O-N 2.91Å; F504-L507 HydrophobicContact CB-CD1 3.82Å; F504-L507 HydrophobicContact CB-CG 4.29Å; F504-L507 HydrophobicContact CD1-CD1 4.1Å; F504-L507 HydrophobicContact CG-CD1 4.16Å; F504-L507 WeakPolarHBondContact O-CB 3.27Å; F504-L507 PolarHBondContact O-N 2.86Å; F504-P548 HydrophobicContact CD2-CB 4.38Å; F504-W622 AromaticContact CD2-CE3 3.87Å; F504-W622 HydrophobicContact CD2-CE3 3.87Å; F504-W622 AromaticContact CD2-CZ3 3.95Å; F504-W622 HydrophobicContact CD2-CZ3 3.95Å; F504-W622 AromaticContact CE2-CE3 3.64Å; F504-W622 HydrophobicContact CE2-CE3 3.64Å; F504-W622 HydrophobicContact CE2-CZ3 4.2Å; F504-W622 WeakPolarHBondContact CZ-O 3.46Å; F504-L625 HydrophobicContact CD2-CD2 3.96Å; F504-L625 HydrophobicContact CE2-CB 4.39Å; F504-L625 HydrophobicContact CE2-CD2 3.76Å; F504-L625 HydrophobicContact CE2-CG 4.32Å; F504-L625 HydrophobicContact CG-CD2 4.46Å; F504-L625 HydrophobicContact CZ-CB 4.23Å; F504-L625 HydrophobicContact CZ-CD2 4.1Å; F504-L625 HydrophobicContact CZ-CG 4.18Å; F504-L629 HydrophobicContact CD1-CD1 4.03Å; F504-L629 HydrophobicContact CE1-CD1 3.88Å
505	S	83.9	Confident	88.8	Confident	23 Å²	23	38.7 Å²	38.7	16%	0.161	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-20.9	177.9	52.4	0	0	0	0	116.2	D503 L507	D503-S505 WeakPolarHBondContact OD1-CB 3.47Å; D503-S505 PolarHBondContact OD1-N 2.89Å; D503-S505 PolarHBondContact OD1-OG 2.84Å; D503-S505 WeakPolarHBondContact OD2-CB 3.36Å; D503-S505 PolarHBondContact OD2-OG 2.83Å; S505-L507 VanDerWaalsContact C-N 3.33Å
506	N	88.8	Confident	88.9	Confident	48 Å²	48	39 Å²	39	26%	0.257	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-6.6	177.8	-54.5	-61.6	0	0	0	113.6	F504 N521 T522	F504-N506 PolarHBondContact O-N 2.91Å; N506-N521 WeakPolarHBondContact CB-OD1 3.43Å; N506-N521 CarbonylContact O-C 3.57Å; N506-N521 WeakPolarHBondContact O-CA 3.4Å; N506-T522 WeakPolarHBondContact CA-OG1 3.45Å; N506-T522 VanDerWaalsContact CB-OG1 3.28Å; N506-T522 WeakPolarHBondContact CB-OG1 3.02Å; N506-T522 WeakPolarHBondContact O-CG2 3.46Å; N506-T522 PolarHBondContact O-N 3.44Å; N506-T522 PolarHBondContact O-OG1 2.9Å; N506-T522 PolarHBondContact OD1-OG1 3.45Å
507	L	93	Very high	89.1	Confident	9 Å²	9	39 Å²	39	5%	0.047	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	136	-180	-64.3	177.3	0	0	0	111.1	H496 F504 S505 L519 W520 L528 L629	H496-L507 HydrophobicContact CB-CB 3.98Å; H496-L507 PolarHBondContact N-O 3.36Å; F504-L507 HydrophobicContact CB-CD1 3.82Å; F504-L507 HydrophobicContact CB-CG 4.29Å; F504-L507 HydrophobicContact CD1-CD1 4.1Å; F504-L507 HydrophobicContact CG-CD1 4.16Å; F504-L507 WeakPolarHBondContact O-CB 3.27Å; F504-L507 PolarHBondContact O-N 2.86Å; S505-L507 VanDerWaalsContact C-N 3.33Å; L507-L519 HydrophobicContact CD2-CD1 4.46Å; L507-W520 WeakPolarHBondContact CA-O 3.28Å; L507-L528 HydrophobicContact CD2-CD1 4.09Å; L507-L629 HydrophobicContact CD1-CD1 3.61Å; L507-L629 HydrophobicContact CD1-CD2 4.26Å; L507-L629 HydrophobicContact CD2-CD1 4.27Å; L507-L629 HydrophobicContact CD2-CD2 4.15Å; L507-L629 HydrophobicContact CG-CD1 4.48Å
508	M	94.6	Very high	89.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	135.8	179.1	178	-175.2	66.7	0	0	109.5	F459 V467 M493 D494 T510 W520	F459-M508 HydrophobicContact CB-SD 3.9Å; F459-M508 HydrophobicContact CD1-SD 3.92Å; F459-M508 HydrophobicContact CD2-SD 4.18Å; F459-M508 HydrophobicContact CG-SD 3.72Å; V467-M508 HydrophobicContact CG1-CE 3.84Å; V467-M508 HydrophobicContact CG1-SD 4.17Å; M493-M508 HydrophobicContact CG-CG 3.89Å; M493-M508 HydrophobicContact CG-SD 3.86Å; M493-M508 HydrophobicContact SD-CG 4.29Å; M493-M508 HydrophobicContact SD-SD 3.44Å; D494-M508 WeakPolarHBondContact O-CA 3.39Å; M508-T510 HydrophobicContact CE-CG2 3.84Å; M508-T510 HydrophobicContact CG-CG2 4.25Å; M508-T510 HydrophobicContact SD-CG2 4.26Å; M508-W520 HydrophobicContact CB-CB 4.33Å; M508-W520 HydrophobicContact CE-CB 3.76Å; M508-W520 HydrophobicContact CE-CG 3.79Å; M508-W520 PolarHBondContact N-O 3.09Å; M508-W520 PolarHBondContact O-N 2.7Å
509	L	95.2	Very high	90.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.1	169.4	-75.6	170.9	0	0	0	109.5	M493 D494 V517 K518 L519 F531 V541 W543 F551	M493-L509 CarbonylContact C-O 3.6Å; M493-L509 VanDerWaalsContact CA-O 3.24Å; M493-L509 WeakPolarHBondContact CA-O 3.49Å; D494-L509 PolarHBondContact N-O 2.77Å; D494-L509 PolarHBondContact O-N 3.44Å; L509-V517 HydrophobicContact CD2-CG1 4.08Å; L509-K518 WeakPolarHBondContact CA-O 3.48Å; L509-L519 HydrophobicContact CD2-CB 4.06Å; L509-L519 HydrophobicContact CD2-CD1 3.79Å; L509-L519 HydrophobicContact CG-CD1 4.26Å; L509-F531 HydrophobicContact CD2-CE2 4.17Å; L509-V541 HydrophobicContact CB-CG1 4.15Å; L509-V541 HydrophobicContact CB-CG2 3.93Å; L509-V541 HydrophobicContact CD1-CG2 3.86Å; L509-V541 HydrophobicContact CG-CG2 4.44Å; L509-W543 HydrophobicContact CD1-CD2 3.67Å; L509-W543 HydrophobicContact CD1-CE3 4.34Å; L509-W543 HydrophobicContact CD1-CG 4.04Å; L509-W543 HydrophobicContact CD1-CH2 4.21Å; L509-W543 HydrophobicContact CD1-CZ2 3.53Å; L509-W543 VanDerWaalsContact CD1-NE1 3.31Å; L509-W543 HydrophobicContact CD2-CZ2 4.12Å; L509-W543 HydrophobicContact CG-CD2 4.36Å; L509-W543 VanDerWaalsContact CG-CE2 3.41Å; L509-W543 HydrophobicContact CG-CH2 4.49Å; L509-W543 HydrophobicContact CG-CZ2 3.5Å; L509-W543 VanDerWaalsContact CG-NE1 3.26Å; L509-F551 HydrophobicContact CD1-CB 3.49Å; L509-F551 VanDerWaalsContact CD1-CB 3.49Å; L509-F551 HydrophobicContact CD1-CD1 3.91Å; L509-F551 HydrophobicContact CD1-CD2 3.68Å; L509-F551 HydrophobicContact CD1-CE2 4.35Å; L509-F551 HydrophobicContact CD1-CG 3.41Å; L509-F551 VanDerWaalsContact CD1-CG 3.41Å
510	T	95.8	Very high	90.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.8	175.3	60.8	0	0	0	0	109.1	V467 H486 T490 G492 M493 M508 V517 K518 W520	V467-T510 HydrophobicContact CG2-CG2 3.79Å; H486-T510 PolarHBondContact NE2-OG1 2.77Å; T490-T510 HydrophobicContact CG2-CG2 4.45Å; G492-T510 WeakPolarHBondContact O-CA 3.42Å; M493-T510 HydrophobicContact CB-CG2 4.49Å; M493-T510 HydrophobicContact CG-CG2 4.07Å; M493-T510 HydrophobicContact SD-CG2 4.3Å; M508-T510 HydrophobicContact CE-CG2 3.84Å; M508-T510 HydrophobicContact CG-CG2 4.25Å; M508-T510 HydrophobicContact SD-CG2 4.26Å; T510-V517 CarbonylContact O-C 3.53Å; T510-V517 VanDerWaalsContact O-CA 3.28Å; T510-V517 WeakPolarHBondContact O-CA 3.4Å; T510-V517 WeakPolarHBondContact O-CG1 3.09Å; T510-K518 PolarHBondContact N-O 3.35Å; T510-K518 PolarHBondContact O-N 2.78Å; T510-K518 PolarHBondContact OG1-O 2.86Å; T510-W520 PolarHBondContact OG1-NE1 3.32Å
511	C	95	Very high	91.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.3	172.1	67.4	0	0	0	0	110.7	T490 V491 G492 V517 V538 V541	T490-C511 WeakPolarHBondContact CA-O 3.3Å; T490-C511 WeakPolarHBondContact CG2-O 3.01Å; V491-C511 PolarHBondContact N-O 2.79Å; G492-C511 WeakPolarHBondContact CA-SG 3.06Å; G492-C511 PolarHBondContact N-O 2.7Å; G492-C511 PolarHBondContact N-SG 2.83Å; G492-C511 PolarHBondContact O-N 3.47Å; C511-V517 HydrophobicContact CB-CG2 4.02Å; C511-V538 HydrophobicContact CB-CB 4Å; C511-V538 HydrophobicContact CB-CG1 3.55Å; C511-V541 HydrophobicContact CB-CB 4.15Å; C511-V541 HydrophobicContact CB-CG1 3.97Å
512	S	95	Very high	91.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	162.6	-173.9	172.5	0	0	0	0	111.7	H486 G488 P489 D514 W515 T516	H486-S512 WeakPolarHBondContact ND1-CB 3.44Å; G488-S512 PolarHBondContact O-OG 3.49Å; P489-S512 VanDerWaalsContact O-CA 3.27Å; P489-S512 WeakPolarHBondContact O-CA 3.39Å; P489-S512 WeakPolarHBondContact O-CB 3.45Å; P489-S512 PolarHBondContact O-OG 2.78Å; S512-D514 VanDerWaalsContact CB-OD1 3.29Å; S512-D514 WeakPolarHBondContact CB-OD1 3.08Å; S512-D514 PolarHBondContact O-N 2.89Å; S512-D514 PolarHBondContact OG-N 3.46Å; S512-D514 PolarHBondContact OG-OD1 3.49Å; S512-W515 PolarHBondContact O-N 3.41Å; S512-T516 PolarHBondContact N-O 3.11Å
513	F	94.2	Very high	92	Very high	73 Å²	73	31.7 Å²	31.7	32%	0.32	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	3.3	167.2	-65.7	-25.4	0	0	0	113.9	P489 V491 W515 Y537 L539	P489-F513 HydrophobicContact CB-CD2 3.92Å; P489-F513 HydrophobicContact CB-CE2 4.39Å; P489-F513 HydrophobicContact CG-CD2 3.9Å; P489-F513 PolarHBondContact O-N 3.38Å; P489-F513 VanDerWaalsContact O-N 3.17Å; V491-F513 HydrophobicContact CB-CE1 4.17Å; V491-F513 HydrophobicContact CB-CZ 4.4Å; V491-F513 HydrophobicContact CG1-CE1 4.19Å; V491-F513 HydrophobicContact CG1-CZ 4.31Å; V491-F513 HydrophobicContact CG2-CD1 3.68Å; V491-F513 HydrophobicContact CG2-CD2 3.92Å; V491-F513 HydrophobicContact CG2-CE1 3.35Å; V491-F513 HydrophobicContact CG2-CE2 3.62Å; V491-F513 HydrophobicContact CG2-CG 3.96Å; V491-F513 HydrophobicContact CG2-CZ 3.33Å; F513-W515 PolarHBondContact O-N 3.35Å; F513-Y537 HydrophobicContact CB-CD1 3.75Å; F513-Y537 HydrophobicContact CB-CE1 4.14Å; F513-Y537 HydrophobicContact CD1-CD1 4.2Å; F513-Y537 HydrophobicContact CD1-CG 4.13Å; F513-Y537 HydrophobicContact CG-CD1 4.23Å; F513-Y537 WeakPolarHBondContact O-CD1 3.11Å; F513-Y537 WeakPolarHBondContact O-CE1 3.15Å; F513-L539 HydrophobicContact CD1-CD2 4.25Å; F513-L539 HydrophobicContact CE1-CD2 3.52Å; F513-L539 HydrophobicContact CZ-CD2 4.48Å
514	D	93.1	Very high	92.3	Very high	29 Å²	29	28.9 Å²	28.9	16%	0.155	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	10.3	169.1	67.2	10.5	0	0	0	113.9	H486 S487 S512 T516	H486-D514 VanDerWaalsContact CA-OD2 3.29Å; H486-D514 WeakPolarHBondContact CA-OD2 3.38Å; H486-D514 WeakPolarHBondContact CB-OD2 3.43Å; H486-D514 IonicContact CG-OD2 3.09Å; H486-D514 IonicContact ND1-OD1 2.64Å; H486-D514 PolarHBondContact ND1-OD1 3.32Å; H486-D514 IonicContact ND1-OD2 3.78Å; H486-D514 PolarHBondContact ND1-OD2 3.29Å; S487-D514 PolarHBondContact N-OD2 3.14Å; S512-D514 VanDerWaalsContact CB-OD1 3.29Å; S512-D514 WeakPolarHBondContact CB-OD1 3.08Å; S512-D514 PolarHBondContact O-N 2.89Å; S512-D514 PolarHBondContact OG-N 3.46Å; S512-D514 PolarHBondContact OG-OD1 3.49Å; D514-T516 VanDerWaalsContact CG-OG1 3.24Å; D514-T516 PolarHBondContact O-N 3.03Å; D514-T516 WeakPolarHBondContact OD1-CB 3.34Å; D514-T516 PolarHBondContact OD1-N 3.14Å; D514-T516 PolarHBondContact OD1-OG1 3.01Å; D514-T516 PolarHBondContact OD2-OG1 3.44Å
515	W	93.6	Very high	92.4	Very high	127 Å²	127	33.4 Å²	33.4	48%	0.481	15%	0.154	S	C	.	.	S	Bend	trans	68.1	14	-178.6	-42.3	-31.6	0	0	0	113.9	S512 F513 Y534 D536 Y537	S512-W515 PolarHBondContact O-N 3.41Å; F513-W515 PolarHBondContact O-N 3.35Å; W515-Y534 WeakPolarHBondContact O-CB 3.47Å; W515-Y534 WeakPolarHBondContact O-CD2 3.31Å; W515-D536 VanDerWaalsContact CD1-O 3.22Å; W515-Y537 AromaticContact CD1-CD1 3.58Å; W515-Y537 AromaticContact NE1-CD1 3.35Å; W515-Y537 AromaticContact NE1-CE1 3.37Å
516	T	94.3	Very high	92.7	Very high	13 Å²	13	37.2 Å²	37.2	8%	0.08	17%	0.168	C	C	.	.			trans	-113.5	147.6	179.5	74.8	0	0	0	0	112	H486 S512 D514 K518 F531 E532	H486-T516 PolarHBondContact CE1-OG1 3.29Å; H486-T516 PolarHBondContact ND1-OG1 3.21Å; S512-T516 PolarHBondContact N-O 3.11Å; D514-T516 VanDerWaalsContact CG-OG1 3.24Å; D514-T516 PolarHBondContact O-N 3.03Å; D514-T516 WeakPolarHBondContact OD1-CB 3.34Å; D514-T516 PolarHBondContact OD1-N 3.14Å; D514-T516 PolarHBondContact OD1-OG1 3.01Å; D514-T516 PolarHBondContact OD2-OG1 3.44Å; T516-K518 WeakPolarHBondContact OG1-CE 3.35Å; T516-F531 WeakPolarHBondContact CA-O 3.31Å; T516-E532 HydrophobicContact CG2-CG 4.12Å
517	V	95.3	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.2	160.9	177.4	0	0	0	0	106.9	L509 T510 C511 F531 Y534 V538 V541 F551	L509-V517 HydrophobicContact CD2-CG1 4.08Å; T510-V517 CarbonylContact O-C 3.53Å; T510-V517 VanDerWaalsContact O-CA 3.28Å; T510-V517 WeakPolarHBondContact O-CA 3.4Å; T510-V517 WeakPolarHBondContact O-CG1 3.09Å; C511-V517 HydrophobicContact CB-CG2 4.02Å; V517-F531 HydrophobicContact CB-CB 4.22Å; V517-F531 HydrophobicContact CB-CD2 4.05Å; V517-F531 HydrophobicContact CG1-CD2 3.97Å; V517-F531 PolarHBondContact N-O 3.47Å; V517-F531 VanDerWaalsContact N-O 3.17Å; V517-F531 WeakPolarHBondContact O-CD2 3.34Å; V517-F531 PolarHBondContact O-N 3.21Å; V517-Y534 HydrophobicContact CB-CE2 4.14Å; V517-Y534 HydrophobicContact CG2-CD2 4.35Å; V517-Y534 HydrophobicContact CG2-CE2 3.54Å; V517-V538 HydrophobicContact CG2-CB 4.47Å; V517-V538 HydrophobicContact CG2-CG1 3.82Å; V517-V538 HydrophobicContact CG2-CG2 4.33Å; V517-V541 HydrophobicContact CG1-CG2 3.97Å; V517-F551 HydrophobicContact CG1-CE2 4.46Å
518	K	94.9	Very high	92.7	Very high	25 Å²	25	35.9 Å²	35.9	11%	0.109	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.2	179.2	-65.9	-173.9	-175.8	-149.6	0	110.7	G485 H486 L509 T510 T516 W520 P527 Y529	G485-K518 PolarHBondContact O-NZ 3.28Å; H486-K518 WeakPolarHBondContact CE1-CG 3.47Å; L509-K518 WeakPolarHBondContact CA-O 3.48Å; T510-K518 PolarHBondContact N-O 3.35Å; T510-K518 PolarHBondContact O-N 2.78Å; T510-K518 PolarHBondContact OG1-O 2.86Å; T516-K518 WeakPolarHBondContact OG1-CE 3.35Å; K518-W520 HydrophobicContact CB-CZ2 4.26Å; K518-W520 HydrophobicContact CD-CZ2 4.05Å; K518-P527 HydrophobicContact CB-CB 4.1Å; K518-P527 HydrophobicContact CD-CB 4.08Å; K518-P527 HydrophobicContact CD-CG 4.15Å; K518-P527 HydrophobicContact CG-CB 4.43Å; K518-Y529 WeakPolarHBondContact CA-O 3.43Å
519	L	95.1	Very high	92.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.4	171.3	179.5	63.7	0	0	0	108.7	L507 L509 P527 L528 Y529 F531 W543 L565 L629	L507-L519 HydrophobicContact CD2-CD1 4.46Å; L509-L519 HydrophobicContact CD2-CB 4.06Å; L509-L519 HydrophobicContact CD2-CD1 3.79Å; L509-L519 HydrophobicContact CG-CD1 4.26Å; L519-P527 CarbonylContact O-C 3.56Å; L519-P527 WeakPolarHBondContact O-CA 3.45Å; L519-L528 HydrophobicContact CG-CB 4.4Å; L519-L528 HydrophobicContact CG-CD1 4.48Å; L519-L528 PolarHBondContact O-N 3.33Å; L519-Y529 PolarHBondContact N-O 3.07Å; L519-Y529 PolarHBondContact O-N 3.48Å; L519-F531 HydrophobicContact CB-CE2 4.12Å; L519-W543 HydrophobicContact CD1-CH2 4.26Å; L519-W543 HydrophobicContact CD1-CZ2 3.69Å; L519-L565 HydrophobicContact CD2-CD1 4.32Å; L519-L629 HydrophobicContact CD2-CD2 3.89Å
520	W	94	Very high	92.5	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.2	-179.4	-58.9	87	0	0	0	110.3	Y483 L507 M508 T510 K518 K526 P527	Y483-W520 HydrophobicContact CD1-CE3 4.12Å; Y483-W520 HydrophobicContact CD1-CZ3 4.39Å; L507-W520 WeakPolarHBondContact CA-O 3.28Å; M508-W520 HydrophobicContact CB-CB 4.33Å; M508-W520 HydrophobicContact CE-CB 3.76Å; M508-W520 HydrophobicContact CE-CG 3.79Å; M508-W520 PolarHBondContact N-O 3.09Å; M508-W520 PolarHBondContact O-N 2.7Å; T510-W520 PolarHBondContact OG1-NE1 3.32Å; K518-W520 HydrophobicContact CB-CZ2 4.26Å; K518-W520 HydrophobicContact CD-CZ2 4.05Å; W520-K526 VanDerWaalsContact CZ3-C 3.46Å; W520-P527 HydrophobicContact CD2-CB 3.94Å; W520-P527 HydrophobicContact CE3-CB 3.91Å; W520-P527 HydrophobicContact CH2-CB 3.85Å; W520-P527 HydrophobicContact CH2-CG 3.94Å; W520-P527 HydrophobicContact CZ2-CB 3.86Å; W520-P527 HydrophobicContact CZ2-CG 4.28Å; W520-P527 HydrophobicContact CZ3-CB 3.86Å; W520-P527 VanDerWaalsContact CZ3-CD 3.46Å; W520-P527 HydrophobicContact CZ3-CG 4.12Å; W520-P527 VanDerWaalsContact CZ3-N 3.27Å
521	N	92.3	Very high	92.4	Very high	26 Å²	26	40.7 Å²	40.7	14%	0.139	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.7	161.2	177.5	2.7	0	0	0	107.2	N506 K523 E524 L528	N506-N521 WeakPolarHBondContact CB-OD1 3.43Å; N506-N521 CarbonylContact O-C 3.57Å; N506-N521 WeakPolarHBondContact O-CA 3.4Å; N521-K523 PolarHBondContact O-N 3.24Å; N521-K523 PolarHBondContact OD1-N 3.22Å; N521-E524 HydrophobicContact CB-CB 4.47Å; N521-E524 PolarHBondContact ND2-OE1 3.22Å; N521-E524 PolarHBondContact O-N 3.45Å; N521-L528 HydrophobicContact CB-CD1 3.67Å; N521-L528 HydrophobicContact CB-CD2 4.26Å; N521-L528 HydrophobicContact CB-CG 3.91Å
522	T	88.3	Confident	92.2	Very high	23 Å²	23	47.6 Å²	47.6	14%	0.141	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.4	-176.7	56.6	0	0	0	0	113	F459 Y483 N506 E524	F459-T522 HydrophobicContact CE1-CG2 3.73Å; F459-T522 HydrophobicContact CE2-CG2 4.11Å; F459-T522 HydrophobicContact CZ-CG2 3.3Å; Y483-T522 PolarHBondContact OH-O 3.39Å; N506-T522 WeakPolarHBondContact CA-OG1 3.45Å; N506-T522 VanDerWaalsContact CB-OG1 3.28Å; N506-T522 WeakPolarHBondContact CB-OG1 3.02Å; N506-T522 WeakPolarHBondContact O-CG2 3.46Å; N506-T522 PolarHBondContact O-N 3.44Å; N506-T522 PolarHBondContact O-OG1 2.9Å; N506-T522 PolarHBondContact OD1-OG1 3.45Å; T522-E524 VanDerWaalsContact C-N 3.29Å
523	K	88	Confident	91.7	Very high	150 Å²	150	50.8 Å²	50.8	65%	0.652	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-15.5	175.4	-62.4	180	179.9	173.6	0	113.8	N521	N521-K523 PolarHBondContact O-N 3.24Å; N521-K523 PolarHBondContact OD1-N 3.22Å
524	E	88.2	Confident	91.4	Very high	40 Å²	40	48 Å²	48	19%	0.187	22%	0.223	C	C	.	.			trans	-122.7	134.8	-173	-67.9	172.8	-152.9	0	0	109.9	Y483 N521 T522 K526 L528 K633	Y483-E524 WeakPolarHBondContact CD1-O 3.3Å; Y483-E524 VanDerWaalsContact CE1-O 3.24Å; Y483-E524 WeakPolarHBondContact CE1-O 3.25Å; N521-E524 HydrophobicContact CB-CB 4.47Å; N521-E524 PolarHBondContact ND2-OE1 3.22Å; N521-E524 PolarHBondContact O-N 3.45Å; T522-E524 VanDerWaalsContact C-N 3.29Å; E524-K526 PolarHBondContact O-N 3.05Å; E524-L528 WeakPolarHBondContact OE2-CD2 3.39Å; E524-K633 WeakPolarHBondContact OE1-CE 3.14Å; E524-K633 IonicContact OE1-NZ 2.9Å; E524-K633 PolarHBondContact OE1-NZ 3.14Å
525	F	87.8	Confident	91.2	Very high	115 Å²	115	49.7 Å²	49.7	50%	0.504	24%	0.237	S	C	.	.	S	Bend	trans	-80.1	-3.8	-177.6	-65.1	-72	0	0	0	113.9	E481 Y483	E481-F525 HydrophobicContact CB-CE1 4.08Å; E481-F525 HydrophobicContact CG-CE1 3.99Å; E481-F525 HydrophobicContact CG-CZ 4.34Å; Y483-F525 HydrophobicContact CD1-CD1 4.27Å; Y483-F525 HydrophobicContact CE1-CD1 4.17Å
526	K	89.2	Confident	91.1	Very high	103 Å²	103	46 Å²	46	45%	0.448	23%	0.227	S	C	.	.	S	Bend	trans	-111.8	152	-180	-68.6	-174.3	-179.6	178.6	0	110.7	W520 E524 L528 E636 E640	W520-K526 VanDerWaalsContact CZ3-C 3.46Å; E524-K526 PolarHBondContact O-N 3.05Å; K526-L528 PolarHBondContact O-N 2.75Å; K526-E636 WeakPolarHBondContact CB-OE1 3.47Å; K526-E640 WeakPolarHBondContact CD-OE1 3.35Å; K526-E640 WeakPolarHBondContact CE-OE1 3.37Å; K526-E640 IonicContact NZ-OE1 2.71Å; K526-E640 PolarHBondContact NZ-OE1 2.87Å; K526-E640 IonicContact NZ-OE2 3Å; K526-E640 PolarHBondContact NZ-OE2 3.29Å
527	P	91.4	Very high	91.1	Very high	21 Å²	21	50.7 Å²	50.7	14%	0.136	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	121.6	179.6	29.7	-31.3	0	0	0	110.7	K518 L519 W520 Y529 E636	K518-P527 HydrophobicContact CB-CB 4.1Å; K518-P527 HydrophobicContact CD-CB 4.08Å; K518-P527 HydrophobicContact CD-CG 4.15Å; K518-P527 HydrophobicContact CG-CB 4.43Å; L519-P527 CarbonylContact O-C 3.56Å; L519-P527 WeakPolarHBondContact O-CA 3.45Å; W520-P527 HydrophobicContact CD2-CB 3.94Å; W520-P527 HydrophobicContact CE3-CB 3.91Å; W520-P527 HydrophobicContact CH2-CB 3.85Å; W520-P527 HydrophobicContact CH2-CG 3.94Å; W520-P527 HydrophobicContact CZ2-CB 3.86Å; W520-P527 HydrophobicContact CZ2-CG 4.28Å; W520-P527 HydrophobicContact CZ3-CB 3.86Å; W520-P527 VanDerWaalsContact CZ3-CD 3.46Å; W520-P527 HydrophobicContact CZ3-CG 4.12Å; W520-P527 VanDerWaalsContact CZ3-N 3.27Å; P527-Y529 PolarHBondContact O-N 3.47Å; P527-Y529 VanDerWaalsContact O-N 3.16Å; P527-E636 VanDerWaalsContact O-CD 3.3Å; P527-E636 VanDerWaalsContact O-OE1 3.06Å
528	L	91.5	Very high	91.1	Very high	8 Å²	8	50.7 Å²	50.7	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	-36.6	176.2	-69.8	-178.5	0	0	0	113.5	L507 L519 N521 E524 K526 L629 K633 E636	L507-L528 HydrophobicContact CD2-CD1 4.09Å; L519-L528 HydrophobicContact CG-CB 4.4Å; L519-L528 HydrophobicContact CG-CD1 4.48Å; L519-L528 PolarHBondContact O-N 3.33Å; N521-L528 HydrophobicContact CB-CD1 3.67Å; N521-L528 HydrophobicContact CB-CD2 4.26Å; N521-L528 HydrophobicContact CB-CG 3.91Å; E524-L528 WeakPolarHBondContact OE2-CD2 3.39Å; K526-L528 PolarHBondContact O-N 2.75Å; L528-L629 HydrophobicContact CD1-CD2 4.34Å; L528-K633 HydrophobicContact CD2-CB 4.26Å; L528-K633 HydrophobicContact CD2-CG 4.46Å; L528-E636 WeakPolarHBondContact CA-OE2 3.32Å
529	Y	92.3	Very high	91	Very high	60 Å²	60	51 Å²	51	24%	0.235	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	147.5	179.9	-163.4	-107.6	0	0	0	111.4	K518 L519 P527 F531 T569 L632	K518-Y529 WeakPolarHBondContact CA-O 3.43Å; L519-Y529 PolarHBondContact N-O 3.07Å; L519-Y529 PolarHBondContact O-N 3.48Å; P527-Y529 PolarHBondContact O-N 3.47Å; P527-Y529 VanDerWaalsContact O-N 3.16Å; Y529-F531 AromaticContact CD1-CD1 3.64Å; Y529-F531 HydrophobicContact CD1-CD1 3.64Å; Y529-F531 HydrophobicContact CD1-CD2 4.22Å; Y529-F531 AromaticContact CD1-CE1 3.35Å; Y529-F531 HydrophobicContact CD1-CE1 3.35Å; Y529-F531 AromaticContact CD1-CE2 3.98Å; Y529-F531 HydrophobicContact CD1-CE2 3.98Å; Y529-F531 HydrophobicContact CD1-CG 4.04Å; Y529-F531 AromaticContact CD1-CZ 3.5Å; Y529-F531 HydrophobicContact CD1-CZ 3.5Å; Y529-F531 VanDerWaalsContact CD1-CZ 3.5Å; Y529-F531 AromaticContact CE1-CD1 3.48Å; Y529-F531 HydrophobicContact CE1-CD1 3.48Å; Y529-F531 VanDerWaalsContact CE1-CD1 3.48Å; Y529-F531 AromaticContact CE1-CE1 3.43Å; Y529-F531 HydrophobicContact CE1-CE1 3.43Å; Y529-F531 VanDerWaalsContact CE1-CE1 3.43Å; Y529-F531 HydrophobicContact CE1-CG 4.17Å; Y529-F531 HydrophobicContact CE1-CZ 4.09Å; Y529-T569 WeakPolarHBondContact CE1-O 3.45Å; Y529-T569 PolarHBondContact OH-O 2.95Å; Y529-L632 HydrophobicContact CD2-CD2 3.58Å; Y529-L632 HydrophobicContact CE2-CD2 3.9Å; Y529-L632 HydrophobicContact CG-CD2 4.16Å
530	S	92.7	Very high	91	Very high	37 Å²	37	53 Å²	53	26%	0.259	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.1	174.9	-61.3	0	0	0	0	109.5
531	F	93.4	Very high	91.1	Very high	3 Å²	3	53 Å²	53	1%	0.013	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112	175.1	-53.9	-83.1	0	0	0	109.5	L509 T516 V517 L519 Y529 Y534 F551 W563 L565	L509-F531 HydrophobicContact CD2-CE2 4.17Å; T516-F531 WeakPolarHBondContact CA-O 3.31Å; V517-F531 HydrophobicContact CB-CB 4.22Å; V517-F531 HydrophobicContact CB-CD2 4.05Å; V517-F531 HydrophobicContact CG1-CD2 3.97Å; V517-F531 PolarHBondContact N-O 3.47Å; V517-F531 VanDerWaalsContact N-O 3.17Å; V517-F531 WeakPolarHBondContact O-CD2 3.34Å; V517-F531 PolarHBondContact O-N 3.21Å; L519-F531 HydrophobicContact CB-CE2 4.12Å; Y529-F531 AromaticContact CD1-CD1 3.64Å; Y529-F531 HydrophobicContact CD1-CD1 3.64Å; Y529-F531 HydrophobicContact CD1-CD2 4.22Å; Y529-F531 AromaticContact CD1-CE1 3.35Å; Y529-F531 HydrophobicContact CD1-CE1 3.35Å; Y529-F531 AromaticContact CD1-CE2 3.98Å; Y529-F531 HydrophobicContact CD1-CE2 3.98Å; Y529-F531 HydrophobicContact CD1-CG 4.04Å; Y529-F531 AromaticContact CD1-CZ 3.5Å; Y529-F531 HydrophobicContact CD1-CZ 3.5Å; Y529-F531 VanDerWaalsContact CD1-CZ 3.5Å; Y529-F531 AromaticContact CE1-CD1 3.48Å; Y529-F531 HydrophobicContact CE1-CD1 3.48Å; Y529-F531 VanDerWaalsContact CE1-CD1 3.48Å; Y529-F531 AromaticContact CE1-CE1 3.43Å; Y529-F531 HydrophobicContact CE1-CE1 3.43Å; Y529-F531 VanDerWaalsContact CE1-CE1 3.43Å; Y529-F531 HydrophobicContact CE1-CG 4.17Å; Y529-F531 HydrophobicContact CE1-CZ 4.09Å; F531-Y534 HydrophobicContact CB-CE2 4.39Å; F531-F551 HydrophobicContact CD1-CZ 4.3Å; F531-F551 HydrophobicContact CD2-CZ 4.04Å; F531-F551 HydrophobicContact CE1-CE1 4.37Å; F531-F551 AromaticContact CE1-CZ 3.99Å; F531-F551 HydrophobicContact CE1-CZ 3.99Å; F531-F551 HydrophobicContact CE2-CE1 4.2Å; F531-F551 AromaticContact CE2-CZ 3.71Å; F531-F551 HydrophobicContact CE2-CZ 3.71Å; F531-F551 HydrophobicContact CG-CZ 4.36Å; F531-F551 AromaticContact CZ-CE1 3.93Å; F531-F551 HydrophobicContact CZ-CE1 3.93Å; F531-F551 AromaticContact CZ-CZ 3.72Å; F531-F551 HydrophobicContact CZ-CZ 3.72Å; F531-W563 HydrophobicContact CB-CH2 4.26Å; F531-W563 HydrophobicContact CB-CZ2 4.38Å; F531-W563 HydrophobicContact CD1-CD2 4.47Å; F531-W563 HydrophobicContact CD1-CE3 4Å; F531-W563 AromaticContact CD1-CH2 3.84Å; F531-W563 HydrophobicContact CD1-CH2 3.84Å; F531-W563 HydrophobicContact CD1-CZ2 4.43Å; F531-W563 AromaticContact CD1-CZ3 3.67Å; F531-W563 HydrophobicContact CD1-CZ3 3.67Å; F531-W563 HydrophobicContact CE1-CE3 4.22Å; F531-W563 HydrophobicContact CE1-CZ3 4.21Å; F531-W563 HydrophobicContact CG-CH2 4.45Å; F531-L565 HydrophobicContact CE1-CD2 3.89Å; F531-L565 HydrophobicContact CZ-CD2 3.58Å
532	E	90.6	Very high	91.2	Very high	146 Å²	146	52 Å²	52	68%	0.682	25%	0.253	S	S	*	.			trans	-110.2	28.5	-174.2	-60.2	-172	162.2	0	0	113.5	T516	T516-E532 HydrophobicContact CG2-CG 4.12Å
533	N	85.7	Confident	91.5	Very high	66 Å²	66	51 Å²	51	35%	0.353	25%	0.246	S	C	.	.			trans	-83	-10.5	-176.4	-79.6	-5.9	0	0	0	114.9	W563 E570 P572	N533-W563 HydrophobicContact CB-CH2 4.05Å; N533-W563 HydrophobicContact CB-CZ2 3.96Å; N533-W563 WeakPolarHBondContact ND2-CH2 3.39Å; N533-E570 PolarHBondContact ND2-O 2.77Å; N533-P572 WeakPolarHBondContact ND2-CD 3.43Å
534	Y	88.5	Confident	91.8	Very high	15 Å²	15	43.9 Å²	43.9	6%	0.059	22%	0.215	C	C	.	.			trans	-82.3	144.3	-173.5	-50.2	-85.7	0	0	0	111.5	W515 V517 F531 V538 S553 D555 E561 W563	W515-Y534 WeakPolarHBondContact O-CB 3.47Å; W515-Y534 WeakPolarHBondContact O-CD2 3.31Å; V517-Y534 HydrophobicContact CB-CE2 4.14Å; V517-Y534 HydrophobicContact CG2-CD2 4.35Å; V517-Y534 HydrophobicContact CG2-CE2 3.54Å; F531-Y534 HydrophobicContact CB-CE2 4.39Å; Y534-V538 HydrophobicContact CD1-CG2 3.78Å; Y534-V538 HydrophobicContact CD2-CG2 3.58Å; Y534-V538 HydrophobicContact CE1-CG2 4.31Å; Y534-V538 HydrophobicContact CE2-CG2 4.15Å; Y534-V538 HydrophobicContact CG-CG2 3.39Å; Y534-S553 WeakPolarHBondContact CE1-OG 3.16Å; Y534-S553 VanDerWaalsContact CZ-OG 3.3Å; Y534-S553 WeakPolarHBondContact OH-CB 3.4Å; Y534-S553 PolarHBondContact OH-OG 2.89Å; Y534-D555 HydrophobicContact CD1-CB 4.31Å; Y534-E561 HydrophobicContact CE1-CB 4.35Å; Y534-E561 HydrophobicContact CE1-CG 4.18Å; Y534-E561 WeakPolarHBondContact CE1-OE2 3.47Å; Y534-W563 PolarHBondContact OH-NE1 3.2Å
535	S	88.4	Confident	91.9	Very high	64 Å²	64	42.8 Å²	42.8	45%	0.448	21%	0.211	S	C	.	.	S	Bend	trans	-93.5	-12.8	178.8	44.7	0	0	0	0	113.4	K559	S535-K559 PolarHBondContact OG-NZ 2.8Å
536	D	92.2	Very high	92.1	Very high	50 Å²	50	38.8 Å²	38.8	27%	0.267	20%	0.2	S	C	.	.	S	Bend	trans	-154.7	-172.7	-174.1	-151.6	-18.9	0	0	0	110.5	W515 V538 D555 C556 T557	W515-D536 VanDerWaalsContact CD1-O 3.22Å; D536-V538 PolarHBondContact O-N 3.18Å; D536-D555 WeakPolarHBondContact CB-OD1 3.47Å; D536-C556 WeakPolarHBondContact CB-SG 3.45Å; D536-C556 PolarHBondContact OD1-SG 3.44Å; D536-C556 PolarHBondContact OD2-SG 2.83Å; D536-T557 HydrophobicContact CB-CG2 3.58Å
537	Y	93.7	Very high	92.2	Very high	112 Å²	112	34 Å²	34	44%	0.439	18%	0.179	S	C	.	.			trans	-61	118.6	-173.4	-57.3	-49.8	0	0	0	113.5	F513 W515 L539 D555 C556	F513-Y537 HydrophobicContact CB-CD1 3.75Å; F513-Y537 HydrophobicContact CB-CE1 4.14Å; F513-Y537 HydrophobicContact CD1-CD1 4.2Å; F513-Y537 HydrophobicContact CD1-CG 4.13Å; F513-Y537 HydrophobicContact CG-CD1 4.23Å; F513-Y537 WeakPolarHBondContact O-CD1 3.11Å; F513-Y537 WeakPolarHBondContact O-CE1 3.15Å; W515-Y537 AromaticContact CD1-CD1 3.58Å; W515-Y537 AromaticContact NE1-CD1 3.35Å; W515-Y537 AromaticContact NE1-CE1 3.37Å; Y537-L539 PolarHBondContact O-N 3.48Å; Y537-D555 PolarHBondContact N-OD1 2.84Å; Y537-C556 PolarHBondContact N-SG 3.16Å; Y537-C556 VanDerWaalsContact N-SG 3.4Å; Y537-C556 PolarHBondContact O-N 2.91Å
538	V	94.5	Very high	92.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	116	172.9	-170.8	0	0	0	0	109.1	C511 V517 Y534 D536 V554	C511-V538 HydrophobicContact CB-CB 4Å; C511-V538 HydrophobicContact CB-CG1 3.55Å; V517-V538 HydrophobicContact CG2-CB 4.47Å; V517-V538 HydrophobicContact CG2-CG1 3.82Å; V517-V538 HydrophobicContact CG2-CG2 4.33Å; Y534-V538 HydrophobicContact CD1-CG2 3.78Å; Y534-V538 HydrophobicContact CD2-CG2 3.58Å; Y534-V538 HydrophobicContact CE1-CG2 4.31Å; Y534-V538 HydrophobicContact CE2-CG2 4.15Å; Y534-V538 HydrophobicContact CG-CG2 3.39Å; D536-V538 PolarHBondContact O-N 3.18Å; V538-V554 CarbonylContact C-O 3.39Å; V538-V554 WeakPolarHBondContact CA-O 3.26Å; V538-V554 WeakPolarHBondContact CG1-O 3.33Å
539	L	94.1	Very high	92.2	Very high	32 Å²	32	32.6 Å²	32.6	17%	0.168	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-26.5	-173	-59.9	-167.1	0	0	0	112.9	F513 Y537 V554 C556 L584 K585	F513-L539 HydrophobicContact CD1-CD2 4.25Å; F513-L539 HydrophobicContact CE1-CD2 3.52Å; F513-L539 HydrophobicContact CZ-CD2 4.48Å; Y537-L539 PolarHBondContact O-N 3.48Å; L539-V554 PolarHBondContact N-O 2.84Å; L539-C556 HydrophobicContact CD1-CB 4.1Å; L539-C556 HydrophobicContact CG-CB 4.26Å; L539-L584 WeakPolarHBondContact CD1-O 3.44Å; L539-K585 HydrophobicContact CD1-CB 4.05Å; L539-K585 HydrophobicContact CD1-CG 4.24Å
540	N	94.5	Very high	92.3	Very high	40 Å²	40	29.8 Å²	29.8	21%	0.214	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	153.8	-178.1	-144.9	-36.5	0	0	0	112.5	V554 L587	N540-V554 PolarHBondContact O-N 2.8Å; N540-L587 HydrophobicContact CB-CB 3.92Å; N540-L587 PolarHBondContact ND2-N 2.82Å
541	V	95.2	Very high	92.4	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	139.8	176.6	65.2	0	0	0	0	108.6	L509 C511 V517 F551 A552	L509-V541 HydrophobicContact CB-CG1 4.15Å; L509-V541 HydrophobicContact CB-CG2 3.93Å; L509-V541 HydrophobicContact CD1-CG2 3.86Å; L509-V541 HydrophobicContact CG-CG2 4.44Å; C511-V541 HydrophobicContact CB-CB 4.15Å; C511-V541 HydrophobicContact CB-CG1 3.97Å; V517-V541 HydrophobicContact CG1-CG2 3.97Å; V541-F551 HydrophobicContact CG2-CD2 4.13Å; V541-A552 WeakPolarHBondContact CA-O 3.46Å
542	A	95.5	Very high	92.5	Very high	6 Å²	6	27.9 Å²	27.9	5%	0.05	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	135.8	178.5	0	0	0	0	0	111.4	D494 F551 A552 L587 W589	D494-A542 WeakPolarHBondContact OD2-CA 3.46Å; A542-F551 WeakPolarHBondContact O-CA 3.29Å; A542-F551 WeakPolarHBondContact O-CB 3.23Å; A542-A552 PolarHBondContact N-O 3.16Å; A542-A552 PolarHBondContact O-N 3Å; A542-L587 HydrophobicContact CB-CD2 3.76Å; A542-L587 HydrophobicContact CB-CG 4.21Å; A542-W589 PolarHBondContact O-NE1 3.49Å
543	W	95	Very high	92.7	Very high	3 Å²	3	20.9 Å²	20.9	1%	0.011	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	148	171.9	-77.4	103.1	0	0	0	111.1	D494 H496 L509 L519 P548 F551 L565	D494-W543 PolarHBondContact O-NE1 3.06Å; D494-W543 PolarHBondContact OD2-N 3.26Å; H496-W543 AromaticContact CD2-CE3 3.97Å; L509-W543 HydrophobicContact CD1-CD2 3.67Å; L509-W543 HydrophobicContact CD1-CE3 4.34Å; L509-W543 HydrophobicContact CD1-CG 4.04Å; L509-W543 HydrophobicContact CD1-CH2 4.21Å; L509-W543 HydrophobicContact CD1-CZ2 3.53Å; L509-W543 VanDerWaalsContact CD1-NE1 3.31Å; L509-W543 HydrophobicContact CD2-CZ2 4.12Å; L509-W543 HydrophobicContact CG-CD2 4.36Å; L509-W543 VanDerWaalsContact CG-CE2 3.41Å; L509-W543 HydrophobicContact CG-CH2 4.49Å; L509-W543 HydrophobicContact CG-CZ2 3.5Å; L509-W543 VanDerWaalsContact CG-NE1 3.26Å; L519-W543 HydrophobicContact CD1-CH2 4.26Å; L519-W543 HydrophobicContact CD1-CZ2 3.69Å; W543-P548 VanDerWaalsContact CZ3-O 3.3Å; W543-P548 WeakPolarHBondContact CZ3-O 3.28Å; W543-F551 HydrophobicContact CD2-CB 4.15Å; W543-F551 HydrophobicContact CE3-CB 3.9Å; W543-F551 HydrophobicContact CH2-CD1 4.38Å; W543-F551 HydrophobicContact CZ3-CB 4.31Å; W543-F551 HydrophobicContact CZ3-CD1 4.17Å; W543-L565 HydrophobicContact CH2-CD1 3.69Å; W543-L565 HydrophobicContact CZ3-CD1 4.19Å
544	S	93.6	Very high	93.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.097	C	C	.	.			trans	-67	132.2	164.9	-179.5	0	0	0	0	109.5	A546 H547 L550	S544-A546 PolarHBondContact O-N 3.35Å; S544-A546 PolarHBondContact OG-N 2.86Å; S544-H547 PolarHBondContact OG-N 2.8Å; S544-L550 WeakPolarHBondContact CB-O 3.4Å; S544-L550 PolarHBondContact N-O 2.82Å
545	P	91.1	Very high	93.3	Very high	16 Å²	16	17 Å²	17	10%	0.104	9%	0.094	C	C	.	.	S	Bend	trans	-73.9	-15.2	175	28.1	-33.4	0	0	0	113.4	A498 W589 A590	A498-P545 WeakPolarHBondContact CA-O 3.27Å; P545-W589 HydrophobicContact CG-CB 4.23Å; P545-A590 VanDerWaalsContact CG-O 3.25Å; P545-A590 WeakPolarHBondContact CG-O 3.25Å
546	A	90.3	Very high	93.4	Very high	32 Å²	32	15.2 Å²	15.2	26%	0.264	8%	0.081	S	C	.	.	S	Bend	trans	-102.3	-47.2	-177.2	0	0	0	0	0	112.1	S544	S544-A546 PolarHBondContact O-N 3.35Å; S544-A546 PolarHBondContact OG-N 2.86Å
547	H	91	Very high	93.4	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.009	8%	0.081	C	C	.	.			trans	-99.1	126.3	-174.9	-167.1	-75.2	0	0	0	111.3	S544 A549 L550 H564 L614 P617	S544-H547 PolarHBondContact OG-N 2.8Å; H547-A549 PolarHBondContact ND1-N 3Å; H547-A549 VanDerWaalsContact ND1-N 3.15Å; H547-A549 PolarHBondContact O-N 2.96Å; H547-L550 HydrophobicContact CB-CB 3.71Å; H547-L550 HydrophobicContact CB-CD2 4.26Å; H547-L550 PolarHBondContact ND1-N 2.86Å; H547-L550 PolarHBondContact O-N 3.33Å; H547-H564 AromaticContact CE1-CD2 3.91Å; H547-H564 AromaticContact CE1-CE1 3.66Å; H547-H564 AromaticContact CE1-NE2 3.17Å; H547-H564 PolarHBondContact CE1-NE2 3.08Å; H547-H564 AromaticContact ND1-NE2 3.99Å; H547-H564 AromaticContact NE2-NE2 3.41Å; H547-H564 PolarHBondContact NE2-NE2 3.11Å; H547-L614 PolarHBondContact CD2-O 3.21Å; H547-L614 VanDerWaalsContact CD2-O 3.25Å; H547-P617 VanDerWaalsContact CD2-CA 3.48Å; H547-P617 WeakPolarHBondContact CD2-CA 3.29Å
548	P	91.8	Very high	93.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-28	-171.6	28.8	-36.4	0	0	0	114.2	H496 F504 W543 W622 L625	H496-P548 PolarHBondContact CD2-O 2.82Å; H496-P548 VanDerWaalsContact NE2-CA 3.32Å; H496-P548 WeakPolarHBondContact NE2-CA 3.32Å; H496-P548 PolarHBondContact NE2-O 2.87Å; F504-P548 HydrophobicContact CD2-CB 4.38Å; W543-P548 VanDerWaalsContact CZ3-O 3.3Å; W543-P548 WeakPolarHBondContact CZ3-O 3.28Å; P548-W622 HydrophobicContact CB-CD2 4.2Å; P548-W622 HydrophobicContact CB-CE3 3.85Å; P548-W622 HydrophobicContact CB-CH2 3.72Å; P548-W622 HydrophobicContact CB-CZ2 4.11Å; P548-W622 HydrophobicContact CB-CZ3 3.6Å; P548-W622 HydrophobicContact CG-CD2 3.81Å; P548-W622 HydrophobicContact CG-CE3 4Å; P548-W622 HydrophobicContact CG-CG 4.38Å; P548-W622 HydrophobicContact CG-CH2 4.02Å; P548-W622 HydrophobicContact CG-CZ2 3.88Å; P548-W622 HydrophobicContact CG-CZ3 4.1Å; P548-L625 HydrophobicContact CB-CD2 3.83Å; P548-L625 HydrophobicContact CG-CD2 4.49Å; P548-L625 WeakPolarHBondContact O-CD2 3.4Å
549	A	92.2	Very high	93	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	4.1	-176.2	0	0	0	0	0	113.9	H547 H564 L565 N566 L625	H547-A549 PolarHBondContact ND1-N 3Å; H547-A549 VanDerWaalsContact ND1-N 3.15Å; H547-A549 PolarHBondContact O-N 2.96Å; A549-H564 WeakPolarHBondContact O-CA 3.43Å; A549-L565 HydrophobicContact CB-CB 4.2Å; A549-L565 PolarHBondContact O-N 3Å; A549-N566 HydrophobicContact CB-CB 4.37Å; A549-L625 HydrophobicContact CB-CD1 3.89Å; A549-L625 HydrophobicContact CB-CD2 4.21Å; A549-L625 HydrophobicContact CB-CG 4.44Å
550	L	93.5	Very high	93	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.1	-171.7	-167.4	77.3	0	0	0	110.3	S544 H547 L562 W563 H564 W589 V610	S544-L550 WeakPolarHBondContact CB-O 3.4Å; S544-L550 PolarHBondContact N-O 2.82Å; H547-L550 HydrophobicContact CB-CB 3.71Å; H547-L550 HydrophobicContact CB-CD2 4.26Å; H547-L550 PolarHBondContact ND1-N 2.86Å; H547-L550 PolarHBondContact O-N 3.33Å; L550-L562 HydrophobicContact CD1-CD1 3.87Å; L550-L562 HydrophobicContact CD1-CD2 4.17Å; L550-L562 HydrophobicContact CD1-CG 3.93Å; L550-L562 HydrophobicContact CD2-CD1 4.23Å; L550-L562 HydrophobicContact CG-CD1 3.93Å; L550-W563 WeakPolarHBondContact CA-O 3.45Å; L550-W563 WeakPolarHBondContact CD1-O 3.18Å; L550-H564 HydrophobicContact CD1-CB 4.14Å; L550-W589 HydrophobicContact CD2-CH2 3.49Å; L550-W589 VanDerWaalsContact CD2-CH2 3.49Å; L550-W589 HydrophobicContact CD2-CZ2 4.29Å; L550-W589 HydrophobicContact CD2-CZ3 4.06Å; L550-W589 HydrophobicContact CG-CH2 4.07Å; L550-W589 HydrophobicContact CG-CZ2 4.42Å; L550-V610 HydrophobicContact CD2-CG1 4.38Å
551	F	95	Very high	93	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	159.9	170.8	69.5	-88.2	0	0	0	110.6	L509 V517 F531 V541 A542 W543 W563 L565	L509-F551 HydrophobicContact CD1-CB 3.49Å; L509-F551 VanDerWaalsContact CD1-CB 3.49Å; L509-F551 HydrophobicContact CD1-CD1 3.91Å; L509-F551 HydrophobicContact CD1-CD2 3.68Å; L509-F551 HydrophobicContact CD1-CE2 4.35Å; L509-F551 HydrophobicContact CD1-CG 3.41Å; L509-F551 VanDerWaalsContact CD1-CG 3.41Å; V517-F551 HydrophobicContact CG1-CE2 4.46Å; F531-F551 HydrophobicContact CD1-CZ 4.3Å; F531-F551 HydrophobicContact CD2-CZ 4.04Å; F531-F551 HydrophobicContact CE1-CE1 4.37Å; F531-F551 AromaticContact CE1-CZ 3.99Å; F531-F551 HydrophobicContact CE1-CZ 3.99Å; F531-F551 HydrophobicContact CE2-CE1 4.2Å; F531-F551 AromaticContact CE2-CZ 3.71Å; F531-F551 HydrophobicContact CE2-CZ 3.71Å; F531-F551 HydrophobicContact CG-CZ 4.36Å; F531-F551 AromaticContact CZ-CE1 3.93Å; F531-F551 HydrophobicContact CZ-CE1 3.93Å; F531-F551 AromaticContact CZ-CZ 3.72Å; F531-F551 HydrophobicContact CZ-CZ 3.72Å; V541-F551 HydrophobicContact CG2-CD2 4.13Å; A542-F551 WeakPolarHBondContact O-CA 3.29Å; A542-F551 WeakPolarHBondContact O-CB 3.23Å; W543-F551 HydrophobicContact CD2-CB 4.15Å; W543-F551 HydrophobicContact CE3-CB 3.9Å; W543-F551 HydrophobicContact CH2-CD1 4.38Å; W543-F551 HydrophobicContact CZ3-CB 4.31Å; W543-F551 HydrophobicContact CZ3-CD1 4.17Å; F551-W563 HydrophobicContact CD1-CB 3.72Å; F551-W563 HydrophobicContact CD2-CB 3.99Å; F551-W563 HydrophobicContact CD2-CG 4.23Å; F551-W563 HydrophobicContact CE1-CB 3.27Å; F551-W563 AromaticContact CE1-CG 3.96Å; F551-W563 HydrophobicContact CE1-CG 3.96Å; F551-W563 HydrophobicContact CE2-CB 3.58Å; F551-W563 AromaticContact CE2-CD1 3.43Å; F551-W563 VanDerWaalsContact CE2-CD1 3.43Å; F551-W563 HydrophobicContact CE2-CD2 4.29Å; F551-W563 AromaticContact CE2-CG 3.49Å; F551-W563 HydrophobicContact CE2-CG 3.49Å; F551-W563 VanDerWaalsContact CE2-CG 3.49Å; F551-W563 HydrophobicContact CG-CB 4.06Å; F551-W563 HydrophobicContact CZ-CB 3.21Å; F551-W563 AromaticContact CZ-CD1 3.79Å; F551-W563 AromaticContact CZ-CD2 3.9Å; F551-W563 HydrophobicContact CZ-CD2 3.9Å; F551-W563 HydrophobicContact CZ-CE3 4.47Å; F551-W563 AromaticContact CZ-CG 3.34Å; F551-W563 HydrophobicContact CZ-CG 3.34Å; F551-W563 PolarHBondContact N-O 2.99Å; F551-W563 PolarHBondContact O-N 2.84Å; F551-L565 HydrophobicContact CD1-CG 4.45Å; F551-L565 HydrophobicContact CE1-CD2 3.77Å; F551-L565 HydrophobicContact CE1-CG 4.09Å
552	A	95.1	Very high	92.9	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.4	173.8	0	0	0	0	0	110.2	V541 A542 L560 E561 L562 L587 W589 V596	V541-A552 WeakPolarHBondContact CA-O 3.46Å; A542-A552 PolarHBondContact N-O 3.16Å; A542-A552 PolarHBondContact O-N 3Å; A552-L560 HydrophobicContact CB-CD1 4.23Å; A552-E561 CarbonylContact C-O 3.52Å; A552-E561 VanDerWaalsContact CA-O 3.27Å; A552-E561 WeakPolarHBondContact CA-O 3.44Å; A552-L562 HydrophobicContact CB-CD1 4.26Å; A552-L587 VanDerWaalsContact C-CD2 3.43Å; A552-L587 HydrophobicContact CB-CD1 4.05Å; A552-L587 HydrophobicContact CB-CD2 3.83Å; A552-L587 WeakPolarHBondContact O-CD2 3.37Å; A552-W589 HydrophobicContact CB-CZ2 3.68Å; A552-V596 HydrophobicContact CB-CG1 4.48Å
553	S	95.2	Very high	92.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	155.7	-179.6	57.5	0	0	0	0	110.2	Y534 E561	Y534-S553 WeakPolarHBondContact CE1-OG 3.16Å; Y534-S553 VanDerWaalsContact CZ-OG 3.3Å; Y534-S553 WeakPolarHBondContact OH-CB 3.4Å; Y534-S553 PolarHBondContact OH-OG 2.89Å; S553-E561 PolarHBondContact N-O 2.76Å; S553-E561 PolarHBondContact O-N 3.06Å; S553-E561 PolarHBondContact OG-O 2.95Å
554	V	94.3	Very high	92.7	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.5	-169.8	173.9	0	0	0	0	110.9	V538 L539 N540 L560 L584 L587 V598	V538-V554 CarbonylContact C-O 3.39Å; V538-V554 WeakPolarHBondContact CA-O 3.26Å; V538-V554 WeakPolarHBondContact CG1-O 3.33Å; L539-V554 PolarHBondContact N-O 2.84Å; N540-V554 PolarHBondContact O-N 2.8Å; V554-L560 HydrophobicContact CG2-CD1 3.68Å; V554-L584 HydrophobicContact CG1-CB 3.05Å; V554-L584 HydrophobicContact CG1-CD1 4.09Å; V554-L584 HydrophobicContact CG1-CG 4.2Å; V554-L584 WeakPolarHBondContact CG1-O 3.46Å; V554-L587 HydrophobicContact CG2-CB 3.81Å; V554-L587 HydrophobicContact CG2-CD1 3.72Å; V554-L587 HydrophobicContact CG2-CD2 4.19Å; V554-L587 HydrophobicContact CG2-CG 4.1Å; V554-V598 HydrophobicContact CG1-CG1 4.15Å; V554-V598 HydrophobicContact CG2-CG1 3.88Å
555	D	92.8	Very high	92.6	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	151.3	178.2	-175.7	13.9	0	0	0	111.5	Y534 D536 Y537 T557 G558 K559	Y534-D555 HydrophobicContact CD1-CB 4.31Å; D536-D555 WeakPolarHBondContact CB-OD1 3.47Å; Y537-D555 PolarHBondContact N-OD1 2.84Å; D555-T557 PolarHBondContact O-N 3.19Å; D555-T557 WeakPolarHBondContact OD2-CG2 3.44Å; D555-T557 PolarHBondContact OD2-OG1 2.92Å; D555-G558 PolarHBondContact O-N 3.11Å; D555-K559 HydrophobicContact CB-CB 4.29Å; D555-K559 PolarHBondContact N-O 3.35Å
556	C	91	Very high	92.6	Very high	25 Å²	25	9.8 Å²	9.8	17%	0.169	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.2	173.3	68.6	0	0	0	0	114.2	D536 Y537 L539 G558 A583	D536-C556 WeakPolarHBondContact CB-SG 3.45Å; D536-C556 PolarHBondContact OD1-SG 3.44Å; D536-C556 PolarHBondContact OD2-SG 2.83Å; Y537-C556 PolarHBondContact N-SG 3.16Å; Y537-C556 VanDerWaalsContact N-SG 3.4Å; Y537-C556 PolarHBondContact O-N 2.91Å; L539-C556 HydrophobicContact CD1-CB 4.1Å; L539-C556 HydrophobicContact CG-CB 4.26Å; C556-G558 PolarHBondContact O-N 2.91Å; C556-A583 HydrophobicContact CB-CB 4.43Å; C556-A583 VanDerWaalsContact O-CA 3.24Å; C556-A583 WeakPolarHBondContact O-CA 3.22Å; C556-A583 WeakPolarHBondContact O-CB 3.45Å
557	T	91.1	Very high	92.4	Very high	44 Å²	44	13.5 Å²	13.5	27%	0.27	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4	168.2	62.6	0	0	0	0	114	D536 D555	D536-T557 HydrophobicContact CB-CG2 3.58Å; D555-T557 PolarHBondContact O-N 3.19Å; D555-T557 WeakPolarHBondContact OD2-CG2 3.44Å; D555-T557 PolarHBondContact OD2-OG1 2.92Å
558	G	89.4	Confident	92.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	87.6	13.5	-177.2	0	0	0	0	0	114.4	D555 C556 I577 A578 A582 L584	D555-G558 PolarHBondContact O-N 3.11Å; C556-G558 PolarHBondContact O-N 2.91Å; G558-I577 WeakPolarHBondContact O-CA 3.29Å; G558-A578 PolarHBondContact O-N 3.45Å; G558-A582 WeakPolarHBondContact CA-O 3.35Å; G558-L584 VanDerWaalsContact C-CD1 3.43Å; G558-L584 VanDerWaalsContact O-CD1 3.26Å; G558-L584 WeakPolarHBondContact O-CD1 3.21Å
559	K	91.9	Very high	91.9	Very high	57 Å²	57	17.9 Å²	17.9	25%	0.248	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.6	174.2	-68.7	172	-174.6	170.5	0	110.8	S535 D555 L576 I577	S535-K559 PolarHBondContact OG-NZ 2.8Å; D555-K559 HydrophobicContact CB-CB 4.29Å; D555-K559 PolarHBondContact N-O 3.35Å; K559-L576 CarbonylContact C-O 3.55Å; K559-L576 WeakPolarHBondContact CA-O 3.5Å; K559-I577 HydrophobicContact CG-CG1 3.87Å
560	L	93.4	Very high	91.6	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.016	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.2	163.1	173.1	67.5	0	0	0	107.9	L276 A552 V554 S575 L576 L584 L587 V596 V598 Y608	L276-L560 HydrophobicContact CD1-CD2 4.49Å; A552-L560 HydrophobicContact CB-CD1 4.23Å; V554-L560 HydrophobicContact CG2-CD1 3.68Å; L560-S575 WeakPolarHBondContact O-CA 3.35Å; L560-L576 PolarHBondContact N-O 3.42Å; L560-L576 PolarHBondContact O-N 2.86Å; L560-L584 HydrophobicContact CB-CD1 4.47Å; L560-L587 HydrophobicContact CD1-CD1 3.76Å; L560-V596 HydrophobicContact CD1-CG1 4.36Å; L560-V596 HydrophobicContact CD2-CG1 4.42Å; L560-V598 HydrophobicContact CD1-CG2 3.88Å; L560-V598 HydrophobicContact CD2-CG2 3.89Å; L560-V598 HydrophobicContact CG-CG2 4.38Å; L560-Y608 HydrophobicContact CD2-CD2 3.39Å; L560-Y608 HydrophobicContact CD2-CE2 3.67Å; L560-Y608 HydrophobicContact CD2-CG 4.1Å
561	E	94	Very high	91.5	Very high	11 Å²	11	29 Å²	29	5%	0.051	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134	175.9	-59.8	-168.6	158.6	0	0	110.4	Y534 A552 S553 W563 P572 A574	Y534-E561 HydrophobicContact CE1-CB 4.35Å; Y534-E561 HydrophobicContact CE1-CG 4.18Å; Y534-E561 WeakPolarHBondContact CE1-OE2 3.47Å; A552-E561 CarbonylContact C-O 3.52Å; A552-E561 VanDerWaalsContact CA-O 3.27Å; A552-E561 WeakPolarHBondContact CA-O 3.44Å; S553-E561 PolarHBondContact N-O 2.76Å; S553-E561 PolarHBondContact O-N 3.06Å; S553-E561 PolarHBondContact OG-O 2.95Å; E561-W563 PolarHBondContact OE2-NE1 2.85Å; E561-P572 HydrophobicContact CB-CB 4.08Å; E561-P572 HydrophobicContact CG-CB 4.48Å; E561-A574 WeakPolarHBondContact CA-O 3.32Å
562	L	94.1	Very high	91.2	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.2	175	-176.6	74	0	0	0	108.8	L276 L550 A552 P572 V573 A574 W589 V610	L276-L562 HydrophobicContact CD1-CB 4.03Å; L276-L562 HydrophobicContact CD1-CD2 4.38Å; L276-L562 HydrophobicContact CD2-CD2 3.99Å; L276-L562 HydrophobicContact CG-CD2 4.11Å; L550-L562 HydrophobicContact CD1-CD1 3.87Å; L550-L562 HydrophobicContact CD1-CD2 4.17Å; L550-L562 HydrophobicContact CD1-CG 3.93Å; L550-L562 HydrophobicContact CD2-CD1 4.23Å; L550-L562 HydrophobicContact CG-CD1 3.93Å; A552-L562 HydrophobicContact CB-CD1 4.26Å; L562-P572 CarbonylContact O-C 3.55Å; L562-V573 WeakPolarHBondContact O-CB 3.5Å; L562-V573 PolarHBondContact O-N 2.95Å; L562-A574 HydrophobicContact CB-CB 4.21Å; L562-A574 PolarHBondContact N-O 3.11Å; L562-A574 PolarHBondContact O-N 3.17Å; L562-W589 HydrophobicContact CD1-CH2 3.6Å; L562-W589 HydrophobicContact CD1-CZ2 3.67Å; L562-V610 HydrophobicContact CD2-CG1 4.11Å
563	W	94	Very high	91	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.008	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.5	-172.9	-69.3	87.7	0	0	0	110.9	F531 N533 Y534 L550 F551 E561 P572	F531-W563 HydrophobicContact CB-CH2 4.26Å; F531-W563 HydrophobicContact CB-CZ2 4.38Å; F531-W563 HydrophobicContact CD1-CD2 4.47Å; F531-W563 HydrophobicContact CD1-CE3 4Å; F531-W563 AromaticContact CD1-CH2 3.84Å; F531-W563 HydrophobicContact CD1-CH2 3.84Å; F531-W563 HydrophobicContact CD1-CZ2 4.43Å; F531-W563 AromaticContact CD1-CZ3 3.67Å; F531-W563 HydrophobicContact CD1-CZ3 3.67Å; F531-W563 HydrophobicContact CE1-CE3 4.22Å; F531-W563 HydrophobicContact CE1-CZ3 4.21Å; F531-W563 HydrophobicContact CG-CH2 4.45Å; N533-W563 HydrophobicContact CB-CH2 4.05Å; N533-W563 HydrophobicContact CB-CZ2 3.96Å; N533-W563 WeakPolarHBondContact ND2-CH2 3.39Å; Y534-W563 PolarHBondContact OH-NE1 3.2Å; L550-W563 WeakPolarHBondContact CA-O 3.45Å; L550-W563 WeakPolarHBondContact CD1-O 3.18Å; F551-W563 HydrophobicContact CD1-CB 3.72Å; F551-W563 HydrophobicContact CD2-CB 3.99Å; F551-W563 HydrophobicContact CD2-CG 4.23Å; F551-W563 HydrophobicContact CE1-CB 3.27Å; F551-W563 AromaticContact CE1-CG 3.96Å; F551-W563 HydrophobicContact CE1-CG 3.96Å; F551-W563 HydrophobicContact CE2-CB 3.58Å; F551-W563 AromaticContact CE2-CD1 3.43Å; F551-W563 VanDerWaalsContact CE2-CD1 3.43Å; F551-W563 HydrophobicContact CE2-CD2 4.29Å; F551-W563 AromaticContact CE2-CG 3.49Å; F551-W563 HydrophobicContact CE2-CG 3.49Å; F551-W563 VanDerWaalsContact CE2-CG 3.49Å; F551-W563 HydrophobicContact CG-CB 4.06Å; F551-W563 HydrophobicContact CZ-CB 3.21Å; F551-W563 AromaticContact CZ-CD1 3.79Å; F551-W563 AromaticContact CZ-CD2 3.9Å; F551-W563 HydrophobicContact CZ-CD2 3.9Å; F551-W563 HydrophobicContact CZ-CE3 4.47Å; F551-W563 AromaticContact CZ-CG 3.34Å; F551-W563 HydrophobicContact CZ-CG 3.34Å; F551-W563 PolarHBondContact N-O 2.99Å; F551-W563 PolarHBondContact O-N 2.84Å; E561-W563 PolarHBondContact OE2-NE1 2.85Å; W563-P572 HydrophobicContact CD2-CB 4.1Å; W563-P572 HydrophobicContact CE3-CB 4.49Å; W563-P572 HydrophobicContact CZ2-CB 4.2Å
564	H	92.3	Very high	90.7	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.019	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	101.3	176.9	-166.6	-70.5	0	0	0	109.4	H547 A549 L550 N566 Q567 D568 V573 E621	H547-H564 AromaticContact CE1-CD2 3.91Å; H547-H564 AromaticContact CE1-CE1 3.66Å; H547-H564 AromaticContact CE1-NE2 3.17Å; H547-H564 PolarHBondContact CE1-NE2 3.08Å; H547-H564 AromaticContact ND1-NE2 3.99Å; H547-H564 AromaticContact NE2-NE2 3.41Å; H547-H564 PolarHBondContact NE2-NE2 3.11Å; A549-H564 WeakPolarHBondContact O-CA 3.43Å; L550-H564 HydrophobicContact CD1-CB 4.14Å; H564-N566 PolarHBondContact ND1-N 3.32Å; H564-N566 PolarHBondContact O-N 3.44Å; H564-Q567 HydrophobicContact CB-CB 4.41Å; H564-Q567 HydrophobicContact CB-CG 4.49Å; H564-Q567 PolarHBondContact O-N 2.7Å; H564-D568 PolarHBondContact O-N 2.79Å; H564-V573 HydrophobicContact CB-CB 4.42Å; H564-V573 HydrophobicContact CB-CG2 3.46Å; H564-V573 VanDerWaalsContact CB-CG2 3.46Å; H564-E621 IonicContact CE1-OE2 2.67Å; H564-E621 PolarHBondContact CE1-OE2 3.44Å
565	L	91.2	Very high	90.5	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.8	-171	-62.8	176.8	0	0	0	113.9	L519 F531 W543 A549 F551 L625	L519-L565 HydrophobicContact CD2-CD1 4.32Å; F531-L565 HydrophobicContact CE1-CD2 3.89Å; F531-L565 HydrophobicContact CZ-CD2 3.58Å; W543-L565 HydrophobicContact CH2-CD1 3.69Å; W543-L565 HydrophobicContact CZ3-CD1 4.19Å; A549-L565 HydrophobicContact CB-CB 4.2Å; A549-L565 PolarHBondContact O-N 3Å; F551-L565 HydrophobicContact CD1-CG 4.45Å; F551-L565 HydrophobicContact CE1-CD2 3.77Å; F551-L565 HydrophobicContact CE1-CG 4.09Å; L565-L625 HydrophobicContact CB-CD1 4.06Å; L565-L625 HydrophobicContact CD1-CD1 4.03Å
566	N	90.3	Very high	90.4	Very high	21 Å²	21	38 Å²	38	11%	0.112	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-16.3	-179.8	-67.1	-12.7	0	0	0	114.1	A549 H564 E621 L624 L625 T628	A549-N566 HydrophobicContact CB-CB 4.37Å; H564-N566 PolarHBondContact ND1-N 3.32Å; H564-N566 PolarHBondContact O-N 3.44Å; N566-E621 PolarHBondContact ND2-O 3.01Å; N566-E621 PolarHBondContact ND2-OE2 2.86Å; N566-L624 HydrophobicContact CB-CD2 3.68Å; N566-L624 HydrophobicContact CB-CG 3.95Å; N566-L625 WeakPolarHBondContact OD1-CA 3.41Å; N566-L625 PolarHBondContact OD1-N 3.04Å; N566-T628 PolarHBondContact OD1-OG1 2.87Å
567	Q	85.9	Confident	90.3	Very high	110 Å²	110	41.8 Å²	41.8	51%	0.514	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-57.2	-179.6	-73.4	-178.7	13	0	0	110.8	H564 V573	H564-Q567 HydrophobicContact CB-CB 4.41Å; H564-Q567 HydrophobicContact CB-CG 4.49Å; H564-Q567 PolarHBondContact O-N 2.7Å; Q567-V573 HydrophobicContact CB-CG2 4.49Å
568	D	86.7	Confident	89.9	Confident	60 Å²	60	39.8 Å²	39.8	32%	0.321	21%	0.211	S	C	.	.			trans	-148.4	130.4	-179.3	-162.6	-19.8	0	0	0	108.5	H564 E570 L571	H564-D568 PolarHBondContact O-N 2.79Å; D568-E570 PolarHBondContact OD1-N 3.46Å; D568-L571 PolarHBondContact OD1-N 3.14Å
569	T	87.2	Confident	89.1	Confident	35 Å²	35	45.6 Å²	45.6	22%	0.215	24%	0.238	C	C	.	.	S	Bend	trans	-93.1	-21.1	177.4	53.5	0	0	0	0	112	Y529 L632	Y529-T569 WeakPolarHBondContact CE1-O 3.45Å; Y529-T569 PolarHBondContact OH-O 2.95Å; T569-L632 HydrophobicContact CG2-CD2 4.28Å
570	E	86.2	Confident	88.4	Confident	132 Å²	132	48.2 Å²	48.2	62%	0.617	26%	0.255	S	S	*	.	S	Bend	trans	-94.3	-29.5	-174.6	-65.6	-177.2	-179.6	0	0	112.6	N533 D568	N533-E570 PolarHBondContact ND2-O 2.77Å; D568-E570 PolarHBondContact OD1-N 3.46Å
571	L	89.8	Confident	87.7	Confident	101 Å²	101	50.3 Å²	50.3	53%	0.529	28%	0.278	S	S	.	.	S	Bend	trans	-121.4	142.1	-177.2	-62.8	174.4	0	0	0	111.9	D568	D568-L571 PolarHBondContact OD1-N 3.14Å
572	P	90.4	Very high	87.3	Confident	32 Å²	32	50 Å²	50	21%	0.208	28%	0.277	C	S	.	.			trans	-66.9	141.3	172.8	29.7	-35.3	0	0	0	109.9	N533 E561 L562 W563 A574	N533-P572 WeakPolarHBondContact ND2-CD 3.43Å; E561-P572 HydrophobicContact CB-CB 4.08Å; E561-P572 HydrophobicContact CG-CB 4.48Å; L562-P572 CarbonylContact O-C 3.55Å; W563-P572 HydrophobicContact CD2-CB 4.1Å; W563-P572 HydrophobicContact CE3-CB 4.49Å; W563-P572 HydrophobicContact CZ2-CB 4.2Å; P572-A574 VanDerWaalsContact C-N 3.31Å; P572-A574 PolarHBondContact O-N 3.35Å
573	V	90.3	Very high	87.1	Confident	16 Å²	16	51.2 Å²	51.2	10%	0.097	29%	0.287	C	S	.	.	S	Bend	trans	-66.3	-37.2	178	163.9	0	0	0	0	111.3	K275 L562 H564 Q567 L614	K275-V573 HydrophobicContact CD-CG1 3.36Å; K275-V573 WeakPolarHBondContact CD-O 3.34Å; K275-V573 PolarHBondContact NZ-O 3.14Å; L562-V573 WeakPolarHBondContact O-CB 3.5Å; L562-V573 PolarHBondContact O-N 2.95Å; H564-V573 HydrophobicContact CB-CB 4.42Å; H564-V573 HydrophobicContact CB-CG2 3.46Å; H564-V573 VanDerWaalsContact CB-CG2 3.46Å; Q567-V573 HydrophobicContact CB-CG2 4.49Å; V573-L614 HydrophobicContact CG1-CD1 4.15Å; V573-L614 HydrophobicContact CG1-CD2 4.35Å
574	A	88.9	Confident	87	Confident	17 Å²	17	51.1 Å²	51.1	14%	0.14	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	139.6	172	0	0	0	0	0	109.6	K275 L276 E561 L562 P572	K275-A574 HydrophobicContact CB-CB 4.16Å; L276-A574 HydrophobicContact CD1-CB 3.69Å; L276-A574 HydrophobicContact CG-CB 4Å; E561-A574 WeakPolarHBondContact CA-O 3.32Å; L562-A574 HydrophobicContact CB-CB 4.21Å; L562-A574 PolarHBondContact N-O 3.11Å; L562-A574 PolarHBondContact O-N 3.17Å; P572-A574 VanDerWaalsContact C-N 3.31Å; P572-A574 PolarHBondContact O-N 3.35Å
575	S	90.2	Very high	87	Confident	67 Å²	67	54.7 Å²	54.7	47%	0.469	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.7	171.6	-176.6	0	0	0	0	107.1	L560	L560-S575 WeakPolarHBondContact O-CA 3.35Å
576	L	89.9	Confident	87	Confident	57 Å²	57	54.7 Å²	54.7	30%	0.298	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.1	-178.5	-178.2	66.2	0	0	0	109.1	K559 L560 Y608	K559-L576 CarbonylContact C-O 3.55Å; K559-L576 WeakPolarHBondContact CA-O 3.5Å; L560-L576 PolarHBondContact N-O 3.42Å; L560-L576 PolarHBondContact O-N 2.86Å; L576-Y608 HydrophobicContact CD2-CD1 3.55Å; L576-Y608 HydrophobicContact CD2-CE1 3.05Å; L576-Y608 HydrophobicContact CD2-CE2 4.27Å; L576-Y608 HydrophobicContact CD2-CG 4.35Å; L576-Y608 VanDerWaalsContact CD2-CZ 3.44Å; L576-Y608 HydrophobicContact CG-CE1 4.38Å
577	I	89.7	Confident	87.2	Confident	104 Å²	104	53.9 Å²	53.9	53%	0.533	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.2	172.9	-61.3	166.8	0	0	0	106.9	G558 K559	G558-I577 WeakPolarHBondContact O-CA 3.29Å; K559-I577 HydrophobicContact CG-CG1 3.87Å
578	A	82.3	Confident	87.6	Confident	3 Å²	3	50 Å²	50	3%	0.025	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-58.9	141.7	176.2	0	0	0	0	0	110.7	G558 D580 G581 L584 W606	G558-A578 PolarHBondContact O-N 3.45Å; A578-D580 PolarHBondContact O-N 2.69Å; A578-G581 PolarHBondContact O-N 3.12Å; A578-G581 VanDerWaalsContact O-N 3.07Å; A578-L584 HydrophobicContact CB-CD1 4.04Å; A578-L584 HydrophobicContact CB-CD2 3.89Å; A578-L584 HydrophobicContact CB-CG 4.25Å; A578-W606 HydrophobicContact CB-CD2 4.36Å; A578-W606 HydrophobicContact CB-CE3 4.44Å; A578-W606 HydrophobicContact CB-CH2 4.26Å; A578-W606 HydrophobicContact CB-CZ2 4.16Å; A578-W606 HydrophobicContact CB-CZ3 4.4Å
579	E	73.5	Confident	88	Confident	121 Å²	121	48 Å²	48	57%	0.565	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	132.5	174.6	-62.3	-178.7	168.3	0	0	109	W606	E579-W606 WeakPolarHBondContact O-CZ2 3.44Å
580	D	75.4	Confident	88.2	Confident	112 Å²	112	46.6 Å²	46.6	60%	0.599	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-3	-173.4	-48.5	-36.2	0	0	0	117.3	A578 A582 K604	A578-D580 PolarHBondContact O-N 2.69Å; D580-A582 PolarHBondContact O-N 3.47Å; D580-K604 IonicContact OD2-NZ 3.47Å; D580-K604 PolarHBondContact OD2-NZ 3.15Å
581	G	79.7	Confident	88.2	Confident	48 Å²	48	47.9 Å²	47.9	50%	0.495	26%	0.261	S	S	.	.			trans	62.1	25.7	-180	0	0	0	0	0	113.3	A578	A578-G581 PolarHBondContact O-N 3.12Å; A578-G581 VanDerWaalsContact O-N 3.07Å
582	A	85.4	Confident	88.1	Confident	3 Å²	3	46.6 Å²	46.6	3%	0.025	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-62.3	140.2	177.6	0	0	0	0	0	111.3	G558 D580 L584 D601 W606	G558-A582 WeakPolarHBondContact CA-O 3.35Å; D580-A582 PolarHBondContact O-N 3.47Å; A582-L584 PolarHBondContact O-N 2.71Å; A582-D601 WeakPolarHBondContact CA-OD1 3.38Å; A582-D601 WeakPolarHBondContact CB-OD1 3.31Å; A582-W606 HydrophobicContact CB-CH2 3.71Å; A582-W606 HydrophobicContact CB-CZ2 4.49Å
583	A	89.5	Confident	88	Confident	27 Å²	27	45.1 Å²	45.1	22%	0.223	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-69.5	120.1	175.5	0	0	0	0	0	109.9	C556 G600 D601	C556-A583 HydrophobicContact CB-CB 4.43Å; C556-A583 VanDerWaalsContact O-CA 3.24Å; C556-A583 WeakPolarHBondContact O-CA 3.22Å; C556-A583 WeakPolarHBondContact O-CB 3.45Å; A583-G600 CarbonylContact O-C 3.58Å; A583-G600 WeakPolarHBondContact O-CA 3.16Å; A583-D601 HydrophobicContact CB-CB 4.41Å; A583-D601 WeakPolarHBondContact CB-OD2 3.43Å; A583-D601 PolarHBondContact N-OD1 3.43Å; A583-D601 PolarHBondContact N-OD2 3.33Å; A583-D601 VanDerWaalsContact N-OD2 3.16Å; A583-D601 PolarHBondContact O-N 3.01Å
584	L	92.6	Very high	88	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.1	-178	-63	170.2	0	0	0	109.2	L539 V554 G558 L560 A578 A582 V598 W606	L539-L584 WeakPolarHBondContact CD1-O 3.44Å; V554-L584 HydrophobicContact CG1-CB 3.05Å; V554-L584 HydrophobicContact CG1-CD1 4.09Å; V554-L584 HydrophobicContact CG1-CG 4.2Å; V554-L584 WeakPolarHBondContact CG1-O 3.46Å; G558-L584 VanDerWaalsContact C-CD1 3.43Å; G558-L584 VanDerWaalsContact O-CD1 3.26Å; G558-L584 WeakPolarHBondContact O-CD1 3.21Å; L560-L584 HydrophobicContact CB-CD1 4.47Å; A578-L584 HydrophobicContact CB-CD1 4.04Å; A578-L584 HydrophobicContact CB-CD2 3.89Å; A578-L584 HydrophobicContact CB-CG 4.25Å; A582-L584 PolarHBondContact O-N 2.71Å; L584-V598 HydrophobicContact CB-CG1 3.82Å; L584-V598 HydrophobicContact CD1-CG1 3.97Å; L584-V598 HydrophobicContact CD2-CB 4.36Å; L584-V598 HydrophobicContact CD2-CG1 3.68Å; L584-V598 HydrophobicContact CG-CG1 4Å; L584-W606 HydrophobicContact CD2-CE3 3.61Å; L584-W606 HydrophobicContact CD2-CH2 4.17Å; L584-W606 HydrophobicContact CD2-CZ3 3.3Å
585	K	91.9	Very high	88.1	Confident	80 Å²	80	48.9 Å²	48.9	35%	0.348	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-35.9	-171.6	179.7	175.9	176.9	178	0	113.9	V292 N294 L539 G599	V292-K585 HydrophobicContact CG1-CD 3.87Å; N294-K585 PolarHBondContact OD1-NZ 3.12Å; L539-K585 HydrophobicContact CD1-CB 4.05Å; L539-K585 HydrophobicContact CD1-CG 4.24Å; K585-G599 PolarHBondContact N-O 3.22Å
586	S	91.8	Very high	88.3	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.2	-174.4	53.3	0	0	0	0	110.6	V293 I296 V598 G599	V293-S586 WeakPolarHBondContact CG1-OG 3.21Å; I296-S586 WeakPolarHBondContact CD1-OG 3.26Å; S586-V598 CarbonylContact O-C 3.5Å; S586-V598 VanDerWaalsContact O-CA 3.27Å; S586-V598 WeakPolarHBondContact O-CA 3.32Å; S586-V598 WeakPolarHBondContact O-CG1 3.33Å; S586-G599 PolarHBondContact N-O 2.79Å; S586-G599 PolarHBondContact O-N 2.85Å; S586-G599 WeakPolarHBondContact OG-CA 3.31Å; S586-G599 PolarHBondContact OG-N 2.84Å
587	L	94.7	Very high	88.5	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	129.8	179.4	175.6	75.8	0	0	0	108.2	N540 A542 A552 V554 L560 V596 V597 V598	N540-L587 HydrophobicContact CB-CB 3.92Å; N540-L587 PolarHBondContact ND2-N 2.82Å; A542-L587 HydrophobicContact CB-CD2 3.76Å; A542-L587 HydrophobicContact CB-CG 4.21Å; A552-L587 VanDerWaalsContact C-CD2 3.43Å; A552-L587 HydrophobicContact CB-CD1 4.05Å; A552-L587 HydrophobicContact CB-CD2 3.83Å; A552-L587 WeakPolarHBondContact O-CD2 3.37Å; V554-L587 HydrophobicContact CG2-CB 3.81Å; V554-L587 HydrophobicContact CG2-CD1 3.72Å; V554-L587 HydrophobicContact CG2-CD2 4.19Å; V554-L587 HydrophobicContact CG2-CG 4.1Å; L560-L587 HydrophobicContact CD1-CD1 3.76Å; L587-V596 HydrophobicContact CD1-CG1 3.38Å; L587-V597 WeakPolarHBondContact CA-O 3.37Å; L587-V598 HydrophobicContact CD1-CG2 3.91Å
588	V	94.5	Very high	88.7	Confident	29 Å²	29	38.2 Å²	38.2	18%	0.176	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	136.1	173.8	-175.1	0	0	0	0	110.1	I296 F298 V597	I296-V588 HydrophobicContact CB-CG2 3.8Å; I296-V588 HydrophobicContact CG2-CB 4.37Å; I296-V588 HydrophobicContact CG2-CG2 4.11Å; I296-V588 VanDerWaalsContact O-CG2 3.24Å; I296-V588 WeakPolarHBondContact O-CG2 3.38Å; F298-V588 HydrophobicContact CD2-CB 4.42Å; F298-V588 HydrophobicContact CD2-CG1 3.58Å; F298-V588 HydrophobicContact CE2-CB 4.29Å; F298-V588 HydrophobicContact CE2-CG1 3.89Å; V588-V597 PolarHBondContact N-O 3.36Å; V588-V597 PolarHBondContact O-N 3.3Å
589	W	93.9	Very high	89.2	Confident	17 Å²	17	38 Å²	38	6%	0.064	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	136.8	169	-74	87.2	0	0	0	111	A542 P545 L550 A552 L562 G593 V596 V610	A542-W589 PolarHBondContact O-NE1 3.49Å; P545-W589 HydrophobicContact CG-CB 4.23Å; L550-W589 HydrophobicContact CD2-CH2 3.49Å; L550-W589 VanDerWaalsContact CD2-CH2 3.49Å; L550-W589 HydrophobicContact CD2-CZ2 4.29Å; L550-W589 HydrophobicContact CD2-CZ3 4.06Å; L550-W589 HydrophobicContact CG-CH2 4.07Å; L550-W589 HydrophobicContact CG-CZ2 4.42Å; A552-W589 HydrophobicContact CB-CZ2 3.68Å; L562-W589 HydrophobicContact CD1-CH2 3.6Å; L562-W589 HydrophobicContact CD1-CZ2 3.67Å; W589-G593 WeakPolarHBondContact CZ3-O 3.28Å; W589-V596 HydrophobicContact CD2-CG2 3.62Å; W589-V596 HydrophobicContact CE3-CG2 3.45Å; W589-V596 VanDerWaalsContact CE3-CG2 3.45Å; W589-V596 HydrophobicContact CH2-CG2 3.35Å; W589-V596 HydrophobicContact CZ2-CG2 3.54Å; W589-V596 HydrophobicContact CZ3-CG2 3.32Å; W589-V610 HydrophobicContact CH2-CG2 3.86Å; W589-V610 HydrophobicContact CZ3-CG2 3.69Å
590	A	91.7	Very high	90.1	Very high	6 Å²	6	32.3 Å²	32.3	5%	0.05	18%	0.176	C	C	.	.			trans	-61.6	146.8	164.4	0	0	0	0	0	109.4	F298 P545 S592 G593 Q595	F298-A590 HydrophobicContact CE2-CB 4.29Å; F298-A590 HydrophobicContact CZ-CB 4.21Å; P545-A590 VanDerWaalsContact CG-O 3.25Å; P545-A590 WeakPolarHBondContact CG-O 3.25Å; A590-S592 PolarHBondContact O-N 2.85Å; A590-S592 VanDerWaalsContact O-N 3.12Å; A590-G593 PolarHBondContact O-N 2.89Å; A590-Q595 HydrophobicContact CB-CB 3.85Å; A590-Q595 WeakPolarHBondContact CB-O 3.17Å; A590-Q595 PolarHBondContact N-O 2.8Å
591	R	87.1	Confident	90.8	Very high	158 Å²	158	29.5 Å²	29.5	60%	0.596	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.2	-176.5	-168	56.5	176.6	148.5	4.9	113.5	G593	R591-G593 PolarHBondContact O-N 2.81Å
592	S	87.3	Confident	91.1	Very high	75 Å²	75	30.4 Å²	30.4	52%	0.524	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.3	171.5	58.6	0	0	0	0	113.6	A590 M594	A590-S592 PolarHBondContact O-N 2.85Å; A590-S592 VanDerWaalsContact O-N 3.12Å; S592-M594 PolarHBondContact O-N 3.29Å
593	G	88.1	Confident	91.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	74.1	-0.6	-176	0	0	0	0	0	115	W589 A590 R591	W589-G593 WeakPolarHBondContact CZ3-O 3.28Å; A590-G593 PolarHBondContact O-N 2.89Å; R591-G593 PolarHBondContact O-N 2.81Å
594	M	89.8	Confident	91.2	Very high	47 Å²	47	31.2 Å²	31.2	23%	0.232	15%	0.153	C	C	.	.	S	Bend	trans	-87.1	-27.9	-178.9	-63.5	-64.3	-57.8	0	0	112.8	S592 D609 V610 E612 A615 V616	S592-M594 PolarHBondContact O-N 3.29Å; M594-D609 VanDerWaalsContact O-OD1 3.12Å; M594-V610 WeakPolarHBondContact O-CB 3.4Å; M594-V610 PolarHBondContact O-N 3.34Å; M594-E612 HydrophobicContact CE-CB 3.9Å; M594-E612 HydrophobicContact CE-CG 4.13Å; M594-A615 HydrophobicContact CE-CB 4.19Å; M594-A615 HydrophobicContact SD-CB 3.37Å; M594-A615 WeakPolarHBondContact SD-CB 3.43Å; M594-V616 HydrophobicContact SD-CG2 4.32Å
595	Q	91.5	Very high	91.2	Very high	65 Å²	65	31.2 Å²	31.2	30%	0.304	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.8	-174.3	-66.3	176	1.9	0	0	111.2	A590 Y608 D609	A590-Q595 HydrophobicContact CB-CB 3.85Å; A590-Q595 WeakPolarHBondContact CB-O 3.17Å; A590-Q595 PolarHBondContact N-O 2.8Å; Q595-Y608 CarbonylContact C-O 3.5Å; Q595-Y608 VanDerWaalsContact CA-O 3.29Å; Q595-Y608 WeakPolarHBondContact CA-O 3.23Å; Q595-D609 WeakPolarHBondContact CG-OD1 3.29Å
596	V	93.8	Very high	91.3	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.2	173	178.5	0	0	0	0	108	A552 L560 L587 W589 V598 Y608 V610	A552-V596 HydrophobicContact CB-CG1 4.48Å; L560-V596 HydrophobicContact CD1-CG1 4.36Å; L560-V596 HydrophobicContact CD2-CG1 4.42Å; L587-V596 HydrophobicContact CD1-CG1 3.38Å; W589-V596 HydrophobicContact CD2-CG2 3.62Å; W589-V596 HydrophobicContact CE3-CG2 3.45Å; W589-V596 VanDerWaalsContact CE3-CG2 3.45Å; W589-V596 HydrophobicContact CH2-CG2 3.35Å; W589-V596 HydrophobicContact CZ2-CG2 3.54Å; W589-V596 HydrophobicContact CZ3-CG2 3.32Å; V596-V598 HydrophobicContact CG1-CG2 4.19Å; V596-Y608 PolarHBondContact N-O 3.05Å; V596-Y608 PolarHBondContact O-N 3.24Å; V596-V610 HydrophobicContact CG2-CG2 3.7Å
597	V	94.2	Very high	91.3	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.018	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.1	175.7	-177.1	0	0	0	0	110.8	I296 F298 M306 L587 V588 I605 W606 A607	I296-V597 HydrophobicContact CD1-CG1 4.03Å; F298-V597 HydrophobicContact CE2-CB 4.39Å; F298-V597 HydrophobicContact CE2-CG2 4.13Å; F298-V597 HydrophobicContact CZ-CB 4.25Å; F298-V597 HydrophobicContact CZ-CG2 3.57Å; M306-V597 HydrophobicContact CE-CG1 4.37Å; M306-V597 HydrophobicContact SD-CB 4.21Å; M306-V597 HydrophobicContact SD-CG1 3.58Å; M306-V597 VanDerWaalsContact SD-CG1 3.58Å; M306-V597 HydrophobicContact SD-CG2 4.23Å; L587-V597 WeakPolarHBondContact CA-O 3.37Å; V588-V597 PolarHBondContact N-O 3.36Å; V588-V597 PolarHBondContact O-N 3.3Å; V597-I605 HydrophobicContact CG1-CG2 3.17Å; V597-W606 CarbonylContact C-O 3.59Å; V597-W606 WeakPolarHBondContact CA-O 3.46Å; V597-A607 HydrophobicContact CG2-CB 3.94Å
598	V	94.7	Very high	91.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.4	-179.3	-160.1	0	0	0	0	110.7	V554 L560 L584 S586 L587 V596 I605 W606 Y608	V554-V598 HydrophobicContact CG1-CG1 4.15Å; V554-V598 HydrophobicContact CG2-CG1 3.88Å; L560-V598 HydrophobicContact CD1-CG2 3.88Å; L560-V598 HydrophobicContact CD2-CG2 3.89Å; L560-V598 HydrophobicContact CG-CG2 4.38Å; L584-V598 HydrophobicContact CB-CG1 3.82Å; L584-V598 HydrophobicContact CD1-CG1 3.97Å; L584-V598 HydrophobicContact CD2-CB 4.36Å; L584-V598 HydrophobicContact CD2-CG1 3.68Å; L584-V598 HydrophobicContact CG-CG1 4Å; S586-V598 CarbonylContact O-C 3.5Å; S586-V598 VanDerWaalsContact O-CA 3.27Å; S586-V598 WeakPolarHBondContact O-CA 3.32Å; S586-V598 WeakPolarHBondContact O-CG1 3.33Å; L587-V598 HydrophobicContact CD1-CG2 3.91Å; V596-V598 HydrophobicContact CG1-CG2 4.19Å; V598-I605 CarbonylContact O-C 3.46Å; V598-I605 WeakPolarHBondContact O-CA 3.37Å; V598-W606 PolarHBondContact N-O 3.28Å; V598-W606 PolarHBondContact O-N 2.88Å; V598-Y608 HydrophobicContact CG2-CD2 4.08Å; V598-Y608 HydrophobicContact CG2-CE2 4.06Å
599	G	93.3	Very high	91.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.5	175.6	0	0	0	0	0	112.5	K585 S586	K585-G599 PolarHBondContact N-O 3.22Å; S586-G599 PolarHBondContact N-O 2.79Å; S586-G599 PolarHBondContact O-N 2.85Å; S586-G599 WeakPolarHBondContact OG-CA 3.31Å; S586-G599 PolarHBondContact OG-N 2.84Å
600	G	91.2	Very high	90.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	177.5	178.4	0	0	0	0	0	115.1	V293 A583 K604	V293-G600 PolarHBondContact N-O 2.75Å; A583-G600 CarbonylContact O-C 3.58Å; A583-G600 WeakPolarHBondContact O-CA 3.16Å; G600-K604 PolarHBondContact N-O 3.49Å
601	D	89.8	Confident	90.8	Very high	54 Å²	54	29.4 Å²	29.4	29%	0.289	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-31.2	172.1	58.6	-1.4	0	0	0	113.8	R291 V292 A582 A583 G603	R291-D601 CarbonylContact C-O 3.47Å; V292-D601 WeakPolarHBondContact CA-O 3.21Å; V292-D601 HydrophobicContact CG2-CB 4.19Å; V292-D601 PolarHBondContact N-O 3.23Å; A582-D601 WeakPolarHBondContact CA-OD1 3.38Å; A582-D601 WeakPolarHBondContact CB-OD1 3.31Å; A583-D601 HydrophobicContact CB-CB 4.41Å; A583-D601 WeakPolarHBondContact CB-OD2 3.43Å; A583-D601 PolarHBondContact N-OD1 3.43Å; A583-D601 PolarHBondContact N-OD2 3.33Å; A583-D601 VanDerWaalsContact N-OD2 3.16Å; A583-D601 PolarHBondContact O-N 3.01Å; D601-G603 PolarHBondContact O-N 3.26Å
602	N	86.8	Confident	90.6	Very high	66 Å²	66	28.1 Å²	28.1	35%	0.353	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	0.7	-179.8	-71.3	-22	0	0	0	114.5	K604	N602-K604 PolarHBondContact O-N 3.37Å
603	G	86	Confident	90.4	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	78	3.8	-176.8	0	0	0	0	0	114.8	S288 R291 D601	S288-G603 WeakPolarHBondContact CB-O 3.28Å; S288-G603 WeakPolarHBondContact O-CA 3.36Å; R291-G603 WeakPolarHBondContact O-CA 3.1Å; R291-G603 PolarHBondContact O-N 3.23Å; D601-G603 PolarHBondContact O-N 3.26Å
604	K	90.9	Very high	90.2	Very high	48 Å²	48	31.7 Å²	31.7	21%	0.209	16%	0.156	C	C	.	.			trans	-79.5	143.3	170.1	-67	-178.2	179.1	178.3	0	110	Y283 D580 G600 N602 W606	Y283-K604 HydrophobicContact CD2-CB 4.45Å; Y283-K604 HydrophobicContact CD2-CG 3.44Å; Y283-K604 VanDerWaalsContact CD2-CG 3.44Å; Y283-K604 HydrophobicContact CE2-CG 4.1Å; Y283-K604 HydrophobicContact CG-CG 3.93Å; D580-K604 IonicContact OD2-NZ 3.47Å; D580-K604 PolarHBondContact OD2-NZ 3.15Å; G600-K604 PolarHBondContact N-O 3.49Å; N602-K604 PolarHBondContact O-N 3.37Å; K604-W606 HydrophobicContact CB-CH2 3.75Å; K604-W606 HydrophobicContact CB-CZ2 3.68Å; K604-W606 HydrophobicContact CB-CZ3 4.2Å; K604-W606 HydrophobicContact CD-CZ2 3.98Å; K604-W606 HydrophobicContact CG-CZ2 4.47Å; K604-W606 WeakPolarHBondContact O-CZ3 3.49Å
605	I	92.8	Very high	89.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.6	172.2	-55.3	148.2	0	0	0	107.7	C281 F282 V293 I296 M306 V308 Y310 V597 V598	C281-I605 CarbonylContact C-O 3.58Å; C281-I605 VanDerWaalsContact CA-O 3.28Å; C281-I605 WeakPolarHBondContact CA-O 3.39Å; F282-I605 HydrophobicContact CB-CB 4.19Å; F282-I605 HydrophobicContact CB-CD1 4.1Å; F282-I605 HydrophobicContact CD2-CB 4.32Å; F282-I605 HydrophobicContact CD2-CG2 4.24Å; F282-I605 PolarHBondContact N-O 2.81Å; F282-I605 PolarHBondContact O-N 3.48Å; V293-I605 HydrophobicContact CG2-CG1 4.09Å; I296-I605 HydrophobicContact CD1-CG2 4.05Å; M306-I605 HydrophobicContact CE-CD1 4.19Å; M306-I605 HydrophobicContact CE-CG2 3.94Å; M306-I605 HydrophobicContact SD-CG2 4.36Å; V308-I605 HydrophobicContact CB-CD1 4.25Å; V308-I605 HydrophobicContact CG1-CD1 3.99Å; V308-I605 HydrophobicContact CG1-CG1 4.47Å; V308-I605 HydrophobicContact CG2-CD1 3.71Å; Y310-I605 WeakPolarHBondContact OH-CD1 3.21Å; V597-I605 HydrophobicContact CG1-CG2 3.17Å; V598-I605 CarbonylContact O-C 3.46Å; V598-I605 WeakPolarHBondContact O-CA 3.37Å
606	W	92.8	Very high	89.6	Confident	1 Å²	1	30 Å²	30	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.9	177.9	-60.7	-92.2	0	0	0	110	L278 A578 E579 A582 L584 V597 V598 K604 Y608	L278-W606 HydrophobicContact CD1-CB 4.07Å; L278-W606 HydrophobicContact CD1-CG 4.43Å; A578-W606 HydrophobicContact CB-CD2 4.36Å; A578-W606 HydrophobicContact CB-CE3 4.44Å; A578-W606 HydrophobicContact CB-CH2 4.26Å; A578-W606 HydrophobicContact CB-CZ2 4.16Å; A578-W606 HydrophobicContact CB-CZ3 4.4Å; E579-W606 WeakPolarHBondContact O-CZ2 3.44Å; A582-W606 HydrophobicContact CB-CH2 3.71Å; A582-W606 HydrophobicContact CB-CZ2 4.49Å; L584-W606 HydrophobicContact CD2-CE3 3.61Å; L584-W606 HydrophobicContact CD2-CH2 4.17Å; L584-W606 HydrophobicContact CD2-CZ3 3.3Å; V597-W606 CarbonylContact C-O 3.59Å; V597-W606 WeakPolarHBondContact CA-O 3.46Å; V598-W606 PolarHBondContact N-O 3.28Å; V598-W606 PolarHBondContact O-N 2.88Å; K604-W606 HydrophobicContact CB-CH2 3.75Å; K604-W606 HydrophobicContact CB-CZ2 3.68Å; K604-W606 HydrophobicContact CB-CZ3 4.2Å; K604-W606 HydrophobicContact CD-CZ2 3.98Å; K604-W606 HydrophobicContact CG-CZ2 4.47Å; K604-W606 WeakPolarHBondContact O-CZ3 3.49Å; W606-Y608 HydrophobicContact CB-CD2 4.23Å; W606-Y608 HydrophobicContact CB-CE1 4.38Å; W606-Y608 HydrophobicContact CB-CE2 3.48Å; W606-Y608 VanDerWaalsContact CB-CE2 3.48Å; W606-Y608 HydrophobicContact CG-CE2 4.37Å
607	A	92.6	Very high	89.2	Confident	6 Å²	6	31.8 Å²	31.8	5%	0.05	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.5	170.2	0	0	0	0	0	109.2	N279 R280 F282 V597	N279-A607 WeakPolarHBondContact CB-O 3.45Å; N279-A607 PolarHBondContact N-O 2.85Å; R280-A607 PolarHBondContact N-O 3.43Å; R280-A607 PolarHBondContact O-N 3.35Å; F282-A607 HydrophobicContact CE2-CB 4.05Å; V597-A607 HydrophobicContact CG2-CB 3.94Å
608	Y	92.8	Very high	88.8	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.016	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135	176.2	-61.8	-69.7	0	0	0	110.1	S277 L278 L560 L576 Q595 V596 V598 W606	S277-Y608 CarbonylContact O-C 3.54Å; S277-Y608 VanDerWaalsContact O-CA 3.31Å; S277-Y608 WeakPolarHBondContact O-CA 3.3Å; L278-Y608 HydrophobicContact CB-CD1 4.08Å; L278-Y608 HydrophobicContact CB-CE1 3.95Å; L278-Y608 HydrophobicContact CD1-CD1 3.86Å; L278-Y608 HydrophobicContact CD1-CE1 3.45Å; L278-Y608 VanDerWaalsContact CD1-CE1 3.45Å; L278-Y608 HydrophobicContact CG-CE1 4.25Å; L560-Y608 HydrophobicContact CD2-CD2 3.39Å; L560-Y608 HydrophobicContact CD2-CE2 3.67Å; L560-Y608 HydrophobicContact CD2-CG 4.1Å; L576-Y608 HydrophobicContact CD2-CD1 3.55Å; L576-Y608 HydrophobicContact CD2-CE1 3.05Å; L576-Y608 HydrophobicContact CD2-CE2 4.27Å; L576-Y608 HydrophobicContact CD2-CG 4.35Å; L576-Y608 VanDerWaalsContact CD2-CZ 3.44Å; L576-Y608 HydrophobicContact CG-CE1 4.38Å; Q595-Y608 CarbonylContact C-O 3.5Å; Q595-Y608 VanDerWaalsContact CA-O 3.29Å; Q595-Y608 WeakPolarHBondContact CA-O 3.23Å; V596-Y608 PolarHBondContact N-O 3.05Å; V596-Y608 PolarHBondContact O-N 3.24Å; V598-Y608 HydrophobicContact CG2-CD2 4.08Å; V598-Y608 HydrophobicContact CG2-CE2 4.06Å; W606-Y608 HydrophobicContact CB-CD2 4.23Å; W606-Y608 HydrophobicContact CB-CE1 4.38Å; W606-Y608 HydrophobicContact CB-CE2 3.48Å; W606-Y608 VanDerWaalsContact CB-CE2 3.48Å; W606-Y608 HydrophobicContact CG-CE2 4.37Å
609	D	92	Very high	88.3	Confident	48 Å²	48	40 Å²	40	26%	0.257	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.2	170.8	-151.4	17.7	0	0	0	108.9	L276 S277 N279 M594 Q595	L276-D609 WeakPolarHBondContact CA-O 3.36Å; S277-D609 PolarHBondContact N-O 3.5Å; S277-D609 PolarHBondContact O-N 2.86Å; N279-D609 HydrophobicContact CB-CB 4.44Å; M594-D609 VanDerWaalsContact O-OD1 3.12Å; Q595-D609 WeakPolarHBondContact CG-OD1 3.29Å
610	V	90.8	Very high	88.1	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.5	175.9	-173.2	0	0	0	0	107.5	L276 L550 L562 W589 M594 V596 E612 L614 A615	L276-V610 HydrophobicContact CD2-CB 4.3Å; L276-V610 HydrophobicContact CD2-CG1 4.46Å; L276-V610 HydrophobicContact CD2-CG2 3.71Å; L550-V610 HydrophobicContact CD2-CG1 4.38Å; L562-V610 HydrophobicContact CD2-CG1 4.11Å; W589-V610 HydrophobicContact CH2-CG2 3.86Å; W589-V610 HydrophobicContact CZ3-CG2 3.69Å; M594-V610 WeakPolarHBondContact O-CB 3.4Å; M594-V610 PolarHBondContact O-N 3.34Å; V596-V610 HydrophobicContact CG2-CG2 3.7Å; V610-E612 PolarHBondContact O-N 3.48Å; V610-L614 HydrophobicContact CG1-CB 4.1Å; V610-A615 HydrophobicContact CB-CB 4.35Å; V610-A615 HydrophobicContact CG1-CB 4.23Å
611	N	88.4	Confident	88	Confident	40 Å²	40	47.1 Å²	47.1	21%	0.214	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-53.7	133.7	177.9	-171.9	-28.5	0	0	0	110.4	V274 K275 Q613 L614 A615	V274-N611 PolarHBondContact O-ND2 2.96Å; K275-N611 PolarHBondContact O-N 2.56Å; N611-Q613 PolarHBondContact O-N 3.34Å; N611-Q613 VanDerWaalsContact O-N 3.11Å; N611-Q613 PolarHBondContact OD1-N 2.93Å; N611-L614 HydrophobicContact CB-CD1 4.45Å; N611-L614 PolarHBondContact O-N 3.39Å; N611-A615 PolarHBondContact O-N 2.9Å
612	E	83.7	Confident	87.9	Confident	130 Å²	130	45.3 Å²	45.3	61%	0.607	24%	0.243	S	C	*	.	H	α-helix	trans	-52.3	-35.5	-177.9	-169.2	176.9	-177.8	0	0	112.9	M594 V610 L614 A615 V616	M594-E612 HydrophobicContact CE-CB 3.9Å; M594-E612 HydrophobicContact CE-CG 4.13Å; V610-E612 PolarHBondContact O-N 3.48Å; E612-L614 PolarHBondContact O-N 3.07Å; E612-A615 PolarHBondContact O-N 3.13Å; E612-V616 HydrophobicContact CG-CG2 3.83Å; E612-V616 WeakPolarHBondContact O-CB 3.25Å; E612-V616 PolarHBondContact O-N 3.36Å
613	Q	82.1	Confident	88.2	Confident	137 Å²	137	45.6 Å²	45.6	64%	0.64	25%	0.25	S	S	*	.	H	α-helix	trans	-64.5	-25	178.3	-63.3	-177.8	-1.8	0	0	114	N611	N611-Q613 PolarHBondContact O-N 3.34Å; N611-Q613 VanDerWaalsContact O-N 3.11Å; N611-Q613 PolarHBondContact OD1-N 2.93Å
614	L	84.3	Confident	88.4	Confident	13 Å²	13	49 Å²	49	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-96.3	-31.2	177.8	-65.3	168.9	0	0	0	111.7	K275 H547 V573 V610 N611 E612	K275-L614 HydrophobicContact CB-CD1 3.66Å; K275-L614 HydrophobicContact CD-CD1 3.96Å; K275-L614 HydrophobicContact CG-CD1 3.89Å; H547-L614 PolarHBondContact CD2-O 3.21Å; H547-L614 VanDerWaalsContact CD2-O 3.25Å; V573-L614 HydrophobicContact CG1-CD1 4.15Å; V573-L614 HydrophobicContact CG1-CD2 4.35Å; V610-L614 HydrophobicContact CG1-CB 4.1Å; N611-L614 HydrophobicContact CB-CD1 4.45Å; N611-L614 PolarHBondContact O-N 3.39Å; E612-L614 PolarHBondContact O-N 3.07Å
615	A	82.2	Confident	88.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-80.9	-36	-176.3	0	0	0	0	0	112.6	M594 V610 N611 E612 P617	M594-A615 HydrophobicContact CE-CB 4.19Å; M594-A615 HydrophobicContact SD-CB 3.37Å; M594-A615 WeakPolarHBondContact SD-CB 3.43Å; V610-A615 HydrophobicContact CB-CB 4.35Å; V610-A615 HydrophobicContact CG1-CB 4.23Å; N611-A615 PolarHBondContact O-N 2.9Å; E612-A615 PolarHBondContact O-N 3.13Å; A615-P617 WeakPolarHBondContact O-CD 3.25Å
616	V	86.2	Confident	88.4	Confident	76 Å²	76	49 Å²	49	46%	0.461	27%	0.274	S	S	.	.	S	Bend	trans	-88.9	115.4	179.1	-178.5	0	0	0	0	109.3	M594 E612 T618	M594-V616 HydrophobicContact SD-CG2 4.32Å; E612-V616 HydrophobicContact CG-CG2 3.83Å; E612-V616 WeakPolarHBondContact O-CB 3.25Å; E612-V616 PolarHBondContact O-N 3.36Å; V616-T618 PolarHBondContact O-N 3.15Å
617	P	84.7	Confident	88.4	Confident	38 Å²	38	54.7 Å²	54.7	25%	0.247	30%	0.299	C	S	.	.			trans	-69.4	131.8	-179.1	28.4	-34.3	0	0	0	111	H547 A615 E621	H547-P617 VanDerWaalsContact CD2-CA 3.48Å; H547-P617 WeakPolarHBondContact CD2-CA 3.29Å; A615-P617 WeakPolarHBondContact O-CD 3.25Å; P617-E621 HydrophobicContact CB-CB 4.47Å; P617-E621 HydrophobicContact CB-CG 4.47Å
618	T	86.4	Confident	88.3	Confident	67 Å²	67	55.1 Å²	55.1	41%	0.411	30%	0.301	S	S	.	.			trans	-69.3	149.9	162.8	78.8	0	0	0	0	109.1	V616 N620 E621	V616-T618 PolarHBondContact O-N 3.15Å; T618-N620 PolarHBondContact O-N 2.76Å; T618-E621 WeakPolarHBondContact O-CB 3.4Å; T618-E621 WeakPolarHBondContact O-CG 3.22Å; T618-E621 PolarHBondContact O-N 3.33Å; T618-E621 WeakPolarHBondContact OG1-CG 3.35Å; T618-E621 PolarHBondContact OG1-OE1 3.24Å; T618-E621 VanDerWaalsContact OG1-OE1 3.13Å
619	P	83.9	Confident	88.3	Confident	109 Å²	109	55.9 Å²	55.9	71%	0.708	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.6	-177.4	21.5	-33	0	0	0	113.1	E621	P619-E621 VanDerWaalsContact C-N 3.34Å
620	N	89.6	Confident	88.3	Confident	119 Å²	119	60.5 Å²	60.5	64%	0.636	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-17.7	178.6	-64.5	-21	0	0	0	113.4	T618 W622 S623 L624	T618-N620 PolarHBondContact O-N 2.76Å; N620-W622 PolarHBondContact O-N 3.22Å; N620-S623 PolarHBondContact O-N 2.95Å; N620-L624 WeakPolarHBondContact O-CB 3.46Å; N620-L624 PolarHBondContact O-N 2.93Å
621	E	88.4	Confident	88.3	Confident	31 Å²	31	64.5 Å²	64.5	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-32.4	-177.2	-64.8	-58.1	143.5	0	0	112.5	H564 N566 P617 T618 P619 L624 L625	H564-E621 IonicContact CE1-OE2 2.67Å; H564-E621 PolarHBondContact CE1-OE2 3.44Å; N566-E621 PolarHBondContact ND2-O 3.01Å; N566-E621 PolarHBondContact ND2-OE2 2.86Å; P617-E621 HydrophobicContact CB-CB 4.47Å; P617-E621 HydrophobicContact CB-CG 4.47Å; T618-E621 WeakPolarHBondContact O-CB 3.4Å; T618-E621 WeakPolarHBondContact O-CG 3.22Å; T618-E621 PolarHBondContact O-N 3.33Å; T618-E621 WeakPolarHBondContact OG1-CG 3.35Å; T618-E621 PolarHBondContact OG1-OE1 3.24Å; T618-E621 VanDerWaalsContact OG1-OE1 3.13Å; P619-E621 VanDerWaalsContact C-N 3.34Å; E621-L624 PolarHBondContact O-N 2.93Å; E621-L625 VanDerWaalsContact O-CB 3.29Å; E621-L625 WeakPolarHBondContact O-CB 3.45Å; E621-L625 PolarHBondContact O-N 3.23Å
622	W	89.4	Confident	88.4	Confident	16 Å²	16	63 Å²	63	6%	0.061	33%	0.33	C	S	.	.	H	α-helix	trans	-66.5	-45.2	178.9	-61.5	88.7	0	0	0	111.7	A498 P501 I502 F504 P548 N620 S626	A498-W622 HydrophobicContact CB-CH2 3.98Å; P501-W622 HydrophobicContact CG-CB 4.27Å; P501-W622 HydrophobicContact CG-CD2 4.27Å; P501-W622 HydrophobicContact CG-CG 3.95Å; I502-W622 HydrophobicContact CD1-CB 4.15Å; I502-W622 HydrophobicContact CG1-CB 4.48Å; I502-W622 WeakPolarHBondContact O-CZ3 3.26Å; F504-W622 AromaticContact CD2-CE3 3.87Å; F504-W622 HydrophobicContact CD2-CE3 3.87Å; F504-W622 AromaticContact CD2-CZ3 3.95Å; F504-W622 HydrophobicContact CD2-CZ3 3.95Å; F504-W622 AromaticContact CE2-CE3 3.64Å; F504-W622 HydrophobicContact CE2-CE3 3.64Å; F504-W622 HydrophobicContact CE2-CZ3 4.2Å; F504-W622 WeakPolarHBondContact CZ-O 3.46Å; P548-W622 HydrophobicContact CB-CD2 4.2Å; P548-W622 HydrophobicContact CB-CE3 3.85Å; P548-W622 HydrophobicContact CB-CH2 3.72Å; P548-W622 HydrophobicContact CB-CZ2 4.11Å; P548-W622 HydrophobicContact CB-CZ3 3.6Å; P548-W622 HydrophobicContact CG-CD2 3.81Å; P548-W622 HydrophobicContact CG-CE3 4Å; P548-W622 HydrophobicContact CG-CG 4.38Å; P548-W622 HydrophobicContact CG-CH2 4.02Å; P548-W622 HydrophobicContact CG-CZ2 3.88Å; P548-W622 HydrophobicContact CG-CZ3 4.1Å; N620-W622 PolarHBondContact O-N 3.22Å; W622-S626 PolarHBondContact O-N 3.32Å; W622-S626 VanDerWaalsContact O-N 3.12Å
623	S	91.2	Very high	88.7	Confident	72 Å²	72	60.4 Å²	60.4	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-72.8	-32.1	176.7	-57	0	0	0	0	112.2	N620 S626 K627	N620-S623 PolarHBondContact O-N 2.95Å; S623-S626 PolarHBondContact O-OG 2.82Å; S623-K627 PolarHBondContact O-N 3.46Å
624	L	91.9	Very high	89.1	Confident	70 Å²	70	57 Å²	57	37%	0.366	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-42	174.5	-172.8	56.8	0	0	0	110.6	N566 N620 E621 K627 T628	N566-L624 HydrophobicContact CB-CD2 3.68Å; N566-L624 HydrophobicContact CB-CG 3.95Å; N620-L624 WeakPolarHBondContact O-CB 3.46Å; N620-L624 PolarHBondContact O-N 2.93Å; E621-L624 PolarHBondContact O-N 2.93Å; L624-K627 WeakPolarHBondContact O-CB 3.28Å; L624-K627 PolarHBondContact O-N 3.35Å; L624-T628 WeakPolarHBondContact O-CG2 3.48Å; L624-T628 PolarHBondContact O-N 2.96Å; L624-T628 PolarHBondContact O-OG1 3.38Å
625	L	91	Very high	89.4	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-42.2	177	-177.2	62.2	0	0	0	112.2	F504 P548 A549 L565 N566 E621 K627 T628 L629	F504-L625 HydrophobicContact CD2-CD2 3.96Å; F504-L625 HydrophobicContact CE2-CB 4.39Å; F504-L625 HydrophobicContact CE2-CD2 3.76Å; F504-L625 HydrophobicContact CE2-CG 4.32Å; F504-L625 HydrophobicContact CG-CD2 4.46Å; F504-L625 HydrophobicContact CZ-CB 4.23Å; F504-L625 HydrophobicContact CZ-CD2 4.1Å; F504-L625 HydrophobicContact CZ-CG 4.18Å; P548-L625 HydrophobicContact CB-CD2 3.83Å; P548-L625 HydrophobicContact CG-CD2 4.49Å; P548-L625 WeakPolarHBondContact O-CD2 3.4Å; A549-L625 HydrophobicContact CB-CD1 3.89Å; A549-L625 HydrophobicContact CB-CD2 4.21Å; A549-L625 HydrophobicContact CB-CG 4.44Å; L565-L625 HydrophobicContact CB-CD1 4.06Å; L565-L625 HydrophobicContact CD1-CD1 4.03Å; N566-L625 WeakPolarHBondContact OD1-CA 3.41Å; N566-L625 PolarHBondContact OD1-N 3.04Å; E621-L625 VanDerWaalsContact O-CB 3.29Å; E621-L625 WeakPolarHBondContact O-CB 3.45Å; E621-L625 PolarHBondContact O-N 3.23Å; L625-K627 PolarHBondContact O-N 3.44Å; L625-T628 WeakPolarHBondContact CA-OG1 3.21Å; L625-T628 PolarHBondContact O-N 3.14Å; L625-T628 PolarHBondContact O-OG1 3.25Å; L625-L629 HydrophobicContact CD1-CD1 4.22Å; L625-L629 HydrophobicContact CD1-CG 4.08Å; L625-L629 HydrophobicContact CG-CD1 3.91Å; L625-L629 HydrophobicContact CG-CG 4.26Å; L625-L629 WeakPolarHBondContact O-CB 3.47Å; L625-L629 WeakPolarHBondContact O-CG 3.46Å; L625-L629 PolarHBondContact O-N 3.39Å
626	S	91.5	Very high	89.6	Confident	49 Å²	49	62.5 Å²	62.5	34%	0.343	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-36	176.2	66.3	0	0	0	0	111.9	W622 S623 Y630	W622-S626 PolarHBondContact O-N 3.32Å; W622-S626 VanDerWaalsContact O-N 3.12Å; S623-S626 PolarHBondContact O-OG 2.82Å; S626-Y630 PolarHBondContact O-N 3.41Å; S626-Y630 VanDerWaalsContact O-N 3.15Å
627	K	92.4	Very high	89.6	Confident	120 Å²	120	63.2 Å²	63.2	52%	0.522	33%	0.329	S	S	.	.	H	α-helix	trans	-68.5	-46.7	174.2	-174	-177	172.8	-162.6	0	112.2	S623 L624 L625 L629 Y630 E631	S623-K627 PolarHBondContact O-N 3.46Å; L624-K627 WeakPolarHBondContact O-CB 3.28Å; L624-K627 PolarHBondContact O-N 3.35Å; L625-K627 PolarHBondContact O-N 3.44Å; K627-L629 VanDerWaalsContact C-N 3.34Å; K627-L629 PolarHBondContact O-N 2.98Å; K627-Y630 WeakPolarHBondContact O-CB 3.47Å; K627-Y630 PolarHBondContact O-N 3.46Å; K627-E631 WeakPolarHBondContact CE-OE1 3.42Å; K627-E631 IonicContact NZ-OE1 3.98Å; K627-E631 WeakPolarHBondContact O-CG 3.46Å; K627-E631 PolarHBondContact O-N 3.31Å
628	T	92.2	Very high	89.8	Confident	16 Å²	16	66.8 Å²	66.8	10%	0.098	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-39.3	179.2	54.8	0	0	0	0	111.4	N566 L624 L625 Y630 E631 L632	N566-T628 PolarHBondContact OD1-OG1 2.87Å; L624-T628 WeakPolarHBondContact O-CG2 3.48Å; L624-T628 PolarHBondContact O-N 2.96Å; L624-T628 PolarHBondContact O-OG1 3.38Å; L625-T628 WeakPolarHBondContact CA-OG1 3.21Å; L625-T628 PolarHBondContact O-N 3.14Å; L625-T628 PolarHBondContact O-OG1 3.25Å; T628-Y630 VanDerWaalsContact C-N 3.31Å; T628-Y630 PolarHBondContact O-N 3.08Å; T628-E631 PolarHBondContact O-N 2.72Å; T628-L632 WeakPolarHBondContact O-CB 3.41Å; T628-L632 VanDerWaalsContact O-CG 3.29Å; T628-L632 WeakPolarHBondContact O-CG 3.44Å; T628-L632 PolarHBondContact O-N 3.2Å
629	L	91.8	Very high	89.8	Confident	20 Å²	20	65.7 Å²	65.7	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-38.1	173.7	-69.1	169.6	0	0	0	112.5	F504 L507 L519 L528 L625 K627 K633	F504-L629 HydrophobicContact CD1-CD1 4.03Å; F504-L629 HydrophobicContact CE1-CD1 3.88Å; L507-L629 HydrophobicContact CD1-CD1 3.61Å; L507-L629 HydrophobicContact CD1-CD2 4.26Å; L507-L629 HydrophobicContact CD2-CD1 4.27Å; L507-L629 HydrophobicContact CD2-CD2 4.15Å; L507-L629 HydrophobicContact CG-CD1 4.48Å; L519-L629 HydrophobicContact CD2-CD2 3.89Å; L528-L629 HydrophobicContact CD1-CD2 4.34Å; L625-L629 HydrophobicContact CD1-CD1 4.22Å; L625-L629 HydrophobicContact CD1-CG 4.08Å; L625-L629 HydrophobicContact CG-CD1 3.91Å; L625-L629 HydrophobicContact CG-CG 4.26Å; L625-L629 WeakPolarHBondContact O-CB 3.47Å; L625-L629 WeakPolarHBondContact O-CG 3.46Å; L625-L629 PolarHBondContact O-N 3.39Å; K627-L629 VanDerWaalsContact C-N 3.34Å; K627-L629 PolarHBondContact O-N 2.98Å; L629-K633 WeakPolarHBondContact O-CB 3.3Å; L629-K633 PolarHBondContact O-N 2.75Å
630	Y	91.4	Very high	89.8	Confident	144 Å²	144	64.1 Å²	64.1	57%	0.565	32%	0.323	S	S	*	.	H	α-helix	trans	-65.8	-43.2	174.6	-177.6	-100	0	0	0	111.8	S626 K627 T628 K633 Q634	S626-Y630 PolarHBondContact O-N 3.41Å; S626-Y630 VanDerWaalsContact O-N 3.15Å; K627-Y630 WeakPolarHBondContact O-CB 3.47Å; K627-Y630 PolarHBondContact O-N 3.46Å; T628-Y630 VanDerWaalsContact C-N 3.31Å; T628-Y630 PolarHBondContact O-N 3.08Å; Y630-K633 PolarHBondContact O-N 2.92Å; Y630-Q634 HydrophobicContact CD1-CG 4.38Å; Y630-Q634 HydrophobicContact CE1-CG 4.04Å; Y630-Q634 WeakPolarHBondContact O-CG 3.36Å; Y630-Q634 PolarHBondContact O-N 2.94Å; Y630-Q634 PolarHBondContact OH-NE2 3.44Å
631	E	91.8	Very high	89.7	Confident	86 Å²	86	65 Å²	65	40%	0.402	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-43.1	175	-70.7	176.9	-179.9	0	0	111.8	K627 T628 K633 Q634 N635	K627-E631 WeakPolarHBondContact CE-OE1 3.42Å; K627-E631 IonicContact NZ-OE1 3.98Å; K627-E631 WeakPolarHBondContact O-CG 3.46Å; K627-E631 PolarHBondContact O-N 3.31Å; T628-E631 PolarHBondContact O-N 2.72Å; E631-K633 PolarHBondContact O-N 3.34Å; E631-Q634 PolarHBondContact O-N 3.31Å; E631-N635 PolarHBondContact O-N 3.5Å; E631-N635 PolarHBondContact O-ND2 3.49Å
632	L	90.5	Very high	89.6	Confident	8 Å²	8	68.7 Å²	68.7	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-60	-45.2	175.9	-72.7	176.2	0	0	0	111.8	Y529 T569 T628 Q634 N635 E636	Y529-L632 HydrophobicContact CD2-CD2 3.58Å; Y529-L632 HydrophobicContact CE2-CD2 3.9Å; Y529-L632 HydrophobicContact CG-CD2 4.16Å; T569-L632 HydrophobicContact CG2-CD2 4.28Å; T628-L632 WeakPolarHBondContact O-CB 3.41Å; T628-L632 VanDerWaalsContact O-CG 3.29Å; T628-L632 WeakPolarHBondContact O-CG 3.44Å; T628-L632 PolarHBondContact O-N 3.2Å; L632-Q634 VanDerWaalsContact C-N 3.34Å; L632-Q634 PolarHBondContact O-N 2.72Å; L632-N635 PolarHBondContact O-N 2.9Å; L632-E636 PolarHBondContact O-N 3.2Å
633	K	90.1	Very high	89.3	Confident	76 Å²	76	72.4 Å²	72.4	33%	0.33	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-40.9	175.9	-177.8	175	176.9	171.8	0	112.4	E524 L528 L629 Y630 E631 E636 M637	E524-K633 WeakPolarHBondContact OE1-CE 3.14Å; E524-K633 IonicContact OE1-NZ 2.9Å; E524-K633 PolarHBondContact OE1-NZ 3.14Å; L528-K633 HydrophobicContact CD2-CB 4.26Å; L528-K633 HydrophobicContact CD2-CG 4.46Å; L629-K633 WeakPolarHBondContact O-CB 3.3Å; L629-K633 PolarHBondContact O-N 2.75Å; Y630-K633 PolarHBondContact O-N 2.92Å; E631-K633 PolarHBondContact O-N 3.34Å; K633-E636 PolarHBondContact O-N 3.05Å; K633-M637 HydrophobicContact CG-CE 4.39Å; K633-M637 WeakPolarHBondContact O-CG 3.41Å; K633-M637 PolarHBondContact O-N 3.16Å; K633-M637 VanDerWaalsContact O-N 3.13Å
634	Q	90.6	Very high	88.9	Confident	67 Å²	67	71.1 Å²	71.1	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-62.1	-44.9	175.1	-75.6	-171.4	-29.3	0	0	111.7	Y630 E631 L632 E636 M637 E638	Y630-Q634 HydrophobicContact CD1-CG 4.38Å; Y630-Q634 HydrophobicContact CE1-CG 4.04Å; Y630-Q634 WeakPolarHBondContact O-CG 3.36Å; Y630-Q634 PolarHBondContact O-N 2.94Å; Y630-Q634 PolarHBondContact OH-NE2 3.44Å; E631-Q634 PolarHBondContact O-N 3.31Å; L632-Q634 VanDerWaalsContact C-N 3.34Å; L632-Q634 PolarHBondContact O-N 2.72Å; Q634-E636 VanDerWaalsContact C-N 3.31Å; Q634-E636 PolarHBondContact O-N 3.13Å; Q634-M637 HydrophobicContact CG-CE 4.14Å; Q634-M637 PolarHBondContact O-N 3.16Å; Q634-E638 WeakPolarHBondContact O-CG 3.14Å; Q634-E638 PolarHBondContact O-N 2.9Å
635	N	89.5	Confident	88.6	Confident	91 Å²	91	71.9 Å²	71.9	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-38.5	178.2	-66.5	-22.8	0	0	0	112.3	E631 L632 E638 A639	E631-N635 PolarHBondContact O-N 3.5Å; E631-N635 PolarHBondContact O-ND2 3.49Å; L632-N635 PolarHBondContact O-N 2.9Å; N635-E638 PolarHBondContact O-N 2.94Å; N635-A639 WeakPolarHBondContact O-CB 3.4Å; N635-A639 PolarHBondContact O-N 3.38Å
636	E	86.4	Confident	87.9	Confident	37 Å²	37	76.9 Å²	76.9	17%	0.173	39%	0.392	C	S	.	.	H	α-helix	trans	-64.2	-46.7	175.7	-168.7	-173.8	179.1	0	0	111.3	K526 P527 L528 L632 K633 Q634 E638 A639 E640	K526-E636 WeakPolarHBondContact CB-OE1 3.47Å; P527-E636 VanDerWaalsContact O-CD 3.3Å; P527-E636 VanDerWaalsContact O-OE1 3.06Å; L528-E636 WeakPolarHBondContact CA-OE2 3.32Å; L632-E636 PolarHBondContact O-N 3.2Å; K633-E636 PolarHBondContact O-N 3.05Å; Q634-E636 VanDerWaalsContact C-N 3.31Å; Q634-E636 PolarHBondContact O-N 3.13Å; E636-E638 PolarHBondContact O-N 3.3Å; E636-A639 PolarHBondContact O-N 3.33Å; E636-E640 WeakPolarHBondContact O-CG 3.17Å; E636-E640 PolarHBondContact O-N 3.12Å
637	M	87	Confident	87	Confident	92 Å²	92	81.2 Å²	81.2	45%	0.453	41%	0.411	S	S	.	.	H	α-helix	trans	-60.2	-43.8	176.3	-68.5	-174.9	-61.3	0	0	112	K633 Q634 A639 E640 E641	K633-M637 HydrophobicContact CG-CE 4.39Å; K633-M637 WeakPolarHBondContact O-CG 3.41Å; K633-M637 PolarHBondContact O-N 3.16Å; K633-M637 VanDerWaalsContact O-N 3.13Å; Q634-M637 HydrophobicContact CG-CE 4.14Å; Q634-M637 PolarHBondContact O-N 3.16Å; M637-A639 VanDerWaalsContact C-N 3.35Å; M637-A639 PolarHBondContact O-N 3.09Å; M637-E640 PolarHBondContact O-N 3.34Å; M637-E641 WeakPolarHBondContact O-CG 3.45Å; M637-E641 PolarHBondContact O-N 3.13Å
638	E	89.3	Confident	85.8	Confident	113 Å²	113	84.4 Å²	84.4	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-62.7	-40.4	176	-72.3	-177.6	-174.6	0	0	112	Q634 N635 E636 E640 E641 L642	Q634-E638 WeakPolarHBondContact O-CG 3.14Å; Q634-E638 PolarHBondContact O-N 2.9Å; N635-E638 PolarHBondContact O-N 2.94Å; E636-E638 PolarHBondContact O-N 3.3Å; E638-E640 VanDerWaalsContact C-N 3.31Å; E638-E640 PolarHBondContact O-N 2.81Å; E638-E641 PolarHBondContact O-N 2.99Å; E638-L642 WeakPolarHBondContact O-CG 3.19Å; E638-L642 PolarHBondContact O-N 3.14Å
639	A	86.6	Confident	83.9	Confident	44 Å²	44	96.7 Å²	96.7	36%	0.364	47%	0.47	S	S	.	.	H	α-helix	trans	-63.9	-36.9	175.9	0	0	0	0	0	112	N635 E636 M637 L642 N643	N635-A639 WeakPolarHBondContact O-CB 3.4Å; N635-A639 PolarHBondContact O-N 3.38Å; E636-A639 PolarHBondContact O-N 3.33Å; M637-A639 VanDerWaalsContact C-N 3.35Å; M637-A639 PolarHBondContact O-N 3.09Å; A639-L642 PolarHBondContact O-N 3.1Å; A639-N643 WeakPolarHBondContact O-CB 3.49Å; A639-N643 VanDerWaalsContact O-CG 3.27Å; A639-N643 PolarHBondContact O-N 3.22Å; A639-N643 PolarHBondContact O-ND2 3.21Å
640	E	83.3	Confident	83.5	Confident	76 Å²	76	100.6 Å²	100.6	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-42.8	174.3	-71.8	-171.8	178.1	0	0	112.6	K526 E636 M637 E638 L642 N643 A644	K526-E640 WeakPolarHBondContact CD-OE1 3.35Å; K526-E640 WeakPolarHBondContact CE-OE1 3.37Å; K526-E640 IonicContact NZ-OE1 2.71Å; K526-E640 PolarHBondContact NZ-OE1 2.87Å; K526-E640 IonicContact NZ-OE2 3Å; K526-E640 PolarHBondContact NZ-OE2 3.29Å; E636-E640 WeakPolarHBondContact O-CG 3.17Å; E636-E640 PolarHBondContact O-N 3.12Å; M637-E640 PolarHBondContact O-N 3.34Å; E638-E640 VanDerWaalsContact C-N 3.31Å; E638-E640 PolarHBondContact O-N 2.81Å; E640-L642 VanDerWaalsContact C-N 3.3Å; E640-L642 PolarHBondContact O-N 2.98Å; E640-N643 PolarHBondContact O-N 3.1Å; E640-A644 VanDerWaalsContact O-CB 3.29Å; E640-A644 WeakPolarHBondContact O-CB 3.49Å; E640-A644 PolarHBondContact O-N 2.95Å
641	E	86.9	Confident	83.1	Confident	136 Å²	136	98.3 Å²	98.3	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-62	-40.1	175.3	-71.7	-175.8	177.1	0	0	111.4	M637 E638 A644 T645	M637-E641 WeakPolarHBondContact O-CG 3.45Å; M637-E641 PolarHBondContact O-N 3.13Å; E638-E641 PolarHBondContact O-N 2.99Å; E641-A644 PolarHBondContact O-N 3.36Å; E641-T645 WeakPolarHBondContact O-CB 3.37Å; E641-T645 VanDerWaalsContact O-CG2 3.26Å; E641-T645 WeakPolarHBondContact O-CG2 3.25Å; E641-T645 PolarHBondContact O-N 3.35Å; E641-T645 PolarHBondContact O-OG1 3.25Å
642	L	87	Confident	82.6	Confident	110 Å²	110	98.9 Å²	98.9	58%	0.576	49%	0.489	S	S	*	.	H	α-helix	trans	-64.7	-44.5	174	-71.9	169.7	0	0	0	112	E638 A639 E640 T645 L646	E638-L642 WeakPolarHBondContact O-CG 3.19Å; E638-L642 PolarHBondContact O-N 3.14Å; A639-L642 PolarHBondContact O-N 3.1Å; E640-L642 VanDerWaalsContact C-N 3.3Å; E640-L642 PolarHBondContact O-N 2.98Å; L642-T645 WeakPolarHBondContact CA-OG1 3.08Å; L642-T645 PolarHBondContact O-N 3.17Å; L642-T645 PolarHBondContact O-OG1 3.44Å; L642-L646 WeakPolarHBondContact O-CB 3.32Å; L642-L646 VanDerWaalsContact O-CG 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.47Å; L642-L646 PolarHBondContact O-N 3.19Å
643	N	83.4	Confident	82.1	Confident	94 Å²	94	104.3 Å²	104.3	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-38.7	177.1	-74.7	-27.3	0	0	0	112.1	A639 E640 L646 N647	A639-N643 WeakPolarHBondContact O-CB 3.49Å; A639-N643 VanDerWaalsContact O-CG 3.27Å; A639-N643 PolarHBondContact O-N 3.22Å; A639-N643 PolarHBondContact O-ND2 3.21Å; E640-N643 PolarHBondContact O-N 3.1Å; N643-L646 PolarHBondContact O-N 3.21Å; N643-N647 WeakPolarHBondContact O-CB 3.35Å; N643-N647 VanDerWaalsContact O-CG 3.3Å; N643-N647 PolarHBondContact O-N 3.36Å; N643-N647 PolarHBondContact O-ND2 3.37Å
644	A	83.2	Confident	81.6	Confident	44 Å²	44	106.1 Å²	106.1	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-63.3	-48.1	174.7	0	0	0	0	0	110.7	E640 E641 L646 N647 F648	E640-A644 VanDerWaalsContact O-CB 3.29Å; E640-A644 WeakPolarHBondContact O-CB 3.49Å; E640-A644 PolarHBondContact O-N 2.95Å; E641-A644 PolarHBondContact O-N 3.36Å; A644-L646 VanDerWaalsContact C-N 3.3Å; A644-L646 PolarHBondContact O-N 3.48Å; A644-N647 PolarHBondContact O-N 3.24Å; A644-F648 WeakPolarHBondContact O-CD2 3.49Å; A644-F648 PolarHBondContact O-N 3.33Å; A644-F648 VanDerWaalsContact O-N 3.11Å
645	T	84.7	Confident	81	Confident	86 Å²	86	108.7 Å²	108.7	53%	0.528	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-31.5	178.9	53.3	0	0	0	0	113.3	E641 L642 R649	E641-T645 WeakPolarHBondContact O-CB 3.37Å; E641-T645 VanDerWaalsContact O-CG2 3.26Å; E641-T645 WeakPolarHBondContact O-CG2 3.25Å; E641-T645 PolarHBondContact O-N 3.35Å; E641-T645 PolarHBondContact O-OG1 3.25Å; L642-T645 WeakPolarHBondContact CA-OG1 3.08Å; L642-T645 PolarHBondContact O-N 3.17Å; L642-T645 PolarHBondContact O-OG1 3.44Å; T645-R649 PolarHBondContact O-N 3.2Å
646	L	76.9	Confident	80.4	Confident	105 Å²	105	109.9 Å²	109.9	55%	0.55	55%	0.545	S	S	.	.	H	α-helix	trans	-70.2	-38.9	172.3	-74.3	171	0	0	0	112.5	L642 N643 A644 F648 R649	L642-L646 WeakPolarHBondContact O-CB 3.32Å; L642-L646 VanDerWaalsContact O-CG 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.47Å; L642-L646 PolarHBondContact O-N 3.19Å; N643-L646 PolarHBondContact O-N 3.21Å; A644-L646 VanDerWaalsContact C-N 3.3Å; A644-L646 PolarHBondContact O-N 3.48Å; L646-F648 PolarHBondContact O-N 3.12Å; L646-R649 PolarHBondContact O-N 3.28Å; L646-R649 VanDerWaalsContact O-OXT 3.1Å
647	N	72.8	Confident	80	Confident	140 Å²	140	115.5 Å²	115.5	75%	0.749	57%	0.574	S	S	*	*	H	α-helix	trans	-70.9	-19.1	176.8	-72.7	-31.3	0	0	0	113.3	N643 A644	N643-N647 WeakPolarHBondContact O-CB 3.35Å; N643-N647 VanDerWaalsContact O-CG 3.3Å; N643-N647 PolarHBondContact O-N 3.36Å; N643-N647 PolarHBondContact O-ND2 3.37Å; A644-N647 PolarHBondContact O-N 3.24Å
648	F	67.4	Low	79.4	Confident	188 Å²	188	117.5 Å²	117.5	83%	0.825	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-6.4	172.5	-79.4	-69.2	0	0	0	113.9	A644 L646	A644-F648 WeakPolarHBondContact O-CD2 3.49Å; A644-F648 PolarHBondContact O-N 3.33Å; A644-F648 VanDerWaalsContact O-N 3.11Å; L646-F648 PolarHBondContact O-N 3.12Å
649	R	51	Low	78.5	Confident	274 Å²	274	117.9 Å²	117.9	100%	1.034	59%	0.589	S	S	*	*			trans	-99.8	0	172	-83.2	-172.9	172.8	178.9	1.4	111.1	T645 L646	T645-R649 PolarHBondContact O-N 3.2Å; L646-R649 PolarHBondContact O-N 3.28Å; L646-R649 VanDerWaalsContact O-OXT 3.1Å

Retrieved 649 of 649 residues in 1306.7 ms (Link to these results)

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