G4VGQ3_SCHMA Loading...

CLP1_P domain-containing protein

AlphaFold DB , UniProt , Accession G4VGQ3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 724 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	30.9	Very low	27.9	Very low	237 Å²	237	192.6 Å²	192.6	100%	1.167	88%	0.883	S	S	*	*				0	69.5	0	-151.1	179.8	-149.4	0	0	107.7	A3	M1-A3 PolarHBondContact O-N 3.19Å
2	F	27.5	Very low	27.9	Very low	200 Å²	200	186.1 Å²	186.1	88%	0.877	88%	0.875	S	S	*	*			trans	-92.2	104.8	-175.6	-79.8	-78.9	0	0	0	109.2	Y4	F2-Y4 PolarHBondContact O-N 3.29Å
3	A	28	Very low	27.8	Very low	97 Å²	97	185.8 Å²	185.8	80%	0.802	87%	0.874	S	S	*	*			trans	-71.4	114.1	175.4	0	0	0	0	0	109.6	M1 K5	M1-A3 PolarHBondContact O-N 3.19Å; A3-K5 PolarHBondContact O-N 3.38Å; A3-K5 VanDerWaalsContact O-N 3.14Å
4	Y	28.9	Very low	27.6	Very low	232 Å²	232	179.9 Å²	179.9	91%	0.91	86%	0.863	S	S	*	*			trans	-63.3	109.7	170.4	-80.7	-91.1	0	0	0	109.9	F2 K6	F2-Y4 PolarHBondContact O-N 3.29Å; Y4-K6 PolarHBondContact O-N 3.29Å
5	K	28.4	Very low	27.6	Very low	194 Å²	194	178.1 Å²	178.1	84%	0.843	86%	0.858	S	S	*	*			trans	-68.5	122.3	164.8	-88.7	-178.7	174.6	177.3	0	108.5	A3 I7	A3-K5 PolarHBondContact O-N 3.38Å; A3-K5 VanDerWaalsContact O-N 3.14Å; K5-I7 PolarHBondContact O-N 3.26Å; K5-I7 VanDerWaalsContact O-N 3.12Å
6	K	27.3	Very low	27.5	Very low	209 Å²	209	177.4 Å²	177.4	91%	0.909	85%	0.854	S	S	*	*			trans	-47.4	113.4	167.2	-84.7	176.7	172.2	174.4	0	110.2	Y4	Y4-K6 PolarHBondContact O-N 3.29Å
7	I	30.4	Very low	27.5	Very low	157 Å²	157	173.8 Å²	173.8	81%	0.805	84%	0.84	S	S	*	*			trans	-77.6	131.3	167.2	-60	174.6	0	0	0	107.6	K5	K5-I7 PolarHBondContact O-N 3.26Å; K5-I7 VanDerWaalsContact O-N 3.12Å
8	P	26	Very low	27.4	Very low	107 Å²	107	171.8 Å²	171.8	70%	0.695	83%	0.834	S	S	*	*			trans	-72.8	135.7	-177.3	28.5	-32	0	0	0	110.9	R10	P8-R10 PolarHBondContact O-N 2.91Å
9	R	26.3	Very low	27.4	Very low	250 Å²	250	169.5 Å²	169.5	94%	0.943	83%	0.832	S	S	*	*			trans	-54.1	103.4	171.2	-74.8	178.1	171.1	167.5	-3.6	110	K11	R9-K11 PolarHBondContact O-N 3.38Å
10	R	26.5	Very low	27.6	Very low	242 Å²	242	167.2 Å²	167.2	91%	0.913	82%	0.823	S	S	*	*			trans	-72.8	116.4	162.2	-95	-175.8	171	178.6	-2.4	108	P8 S12	P8-R10 PolarHBondContact O-N 2.91Å; R10-S12 PolarHBondContact O-N 3.2Å
11	K	26.7	Very low	28.2	Very low	194 Å²	194	163.8 Å²	163.8	84%	0.843	82%	0.822	S	S	*	*			trans	-53.7	127.5	166.7	-77.6	179	174.1	179.7	0	108.3	R9 Q13	R9-K11 PolarHBondContact O-N 3.38Å; K11-Q13 PolarHBondContact O-N 2.89Å; K11-Q13 VanDerWaalsContact O-N 3.12Å
12	S	27.9	Very low	28.7	Very low	114 Å²	114	159 Å²	159	80%	0.797	80%	0.801	S	S	*	*			trans	-51.9	115	164.4	50.1	0	0	0	0	108.6	R10 S14	R10-S12 PolarHBondContact O-N 3.2Å; S12-S14 PolarHBondContact O-N 2.96Å; S12-S14 VanDerWaalsContact O-N 3.16Å
13	Q	26.1	Very low	29.5	Very low	183 Å²	183	151.3 Å²	151.3	86%	0.855	77%	0.772	S	S	*	*			trans	-66.6	110.5	168.7	-85.4	176.5	-31.7	0	0	107.8	K11 L15	K11-Q13 PolarHBondContact O-N 2.89Å; K11-Q13 VanDerWaalsContact O-N 3.12Å; Q13-L15 PolarHBondContact O-N 3.38Å
14	S	26	Very low	30.3	Very low	103 Å²	103	151.8 Å²	151.8	72%	0.72	76%	0.761	S	S	*	*			trans	-66.7	105.8	159.3	52.6	0	0	0	0	107.5	S12 Q16	S12-S14 PolarHBondContact O-N 2.96Å; S12-S14 VanDerWaalsContact O-N 3.16Å; S14-Q16 PolarHBondContact O-N 3.43Å; S14-Q16 VanDerWaalsContact O-N 3.07Å
15	L	27.2	Very low	31.3	Very low	152 Å²	152	150.3 Å²	150.3	80%	0.796	75%	0.754	S	S	*	*			trans	-67.7	100.1	162.4	-88.2	132.1	0	0	0	107.7	Q13 D17	Q13-L15 PolarHBondContact O-N 3.38Å; L15-D17 PolarHBondContact O-N 2.95Å
16	Q	25.4	Very low	32.5	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	73%	0.726	S	S	*	*			trans	-72.3	107.9	159.3	-88.8	178.2	-54.9	0	0	107.3	S14	S14-Q16 PolarHBondContact O-N 3.43Å; S14-Q16 VanDerWaalsContact O-N 3.07Å
17	D	28.4	Very low	33.8	Very low	116 Å²	116	137.9 Å²	137.9	62%	0.62	70%	0.702	S	S	*	*			trans	-110.1	113	156.3	-89.6	-26.3	0	0	0	107.3	L15 K27	L15-D17 PolarHBondContact O-N 2.95Å; D17-K27 PolarHBondContact O-NZ 3.33Å
18	D	25.9	Very low	35.6	Very low	138 Å²	138	137.8 Å²	137.8	74%	0.738	70%	0.698	S	S	*	*			trans	-68.9	162.9	167.8	-82.5	-42.6	0	0	0	111.2
19	T	27.5	Very low	38.4	Very low	129 Å²	129	134.4 Å²	134.4	79%	0.791	67%	0.673	S	S	*	*			trans	79.7	80.6	178.9	73.9	0	0	0	0	117.2
20	D	31	Very low	41.4	Very low	122 Å²	122	123.4 Å²	123.4	65%	0.652	63%	0.632	S	S	*	*				172.5	127.2	122.2	-101.7	-24.3	0	0	0	110.5	N22 S23 N24	D20-N22 PolarHBondContact O-N 3.13Å; D20-S23 WeakPolarHBondContact O-CA 3.31Å; D20-S23 VanDerWaalsContact O-CB 3.25Å; D20-S23 WeakPolarHBondContact O-CB 3.23Å; D20-S23 PolarHBondContact O-N 3.06Å; D20-N24 PolarHBondContact O-N 2.95Å
21	A	39.6	Very low	44.5	Very low	96 Å²	96	116 Å²	116	79%	0.793	61%	0.607	S	S	*	*	H	α-helix	trans	-64.5	-24.9	-175.3	0	0	0	0	0	113.6
22	N	41.5	Very low	47.7	Very low	136 Å²	136	109 Å²	109	73%	0.727	58%	0.581	S	S	*	*	H	α-helix	trans	-81	-26.3	170.4	-97.7	-6.8	0	0	0	113.2	D20 N24	D20-N22 PolarHBondContact O-N 3.13Å; N22-N24 VanDerWaalsContact C-N 3.35Å; N22-N24 PolarHBondContact O-N 3.34Å
23	S	44.9	Very low	50.8	Low	39 Å²	39	105.9 Å²	105.9	27%	0.273	56%	0.556	S	S	.	*	H	α-helix	trans	-66	-35.9	177.5	162.9	0	0	0	0	111.7	D20 R25 N26 K27	D20-S23 WeakPolarHBondContact O-CA 3.31Å; D20-S23 VanDerWaalsContact O-CB 3.25Å; D20-S23 WeakPolarHBondContact O-CB 3.23Å; D20-S23 PolarHBondContact O-N 3.06Å; S23-R25 PolarHBondContact O-N 2.81Å; S23-N26 PolarHBondContact O-N 3.21Å; S23-K27 WeakPolarHBondContact O-CB 3.33Å; S23-K27 WeakPolarHBondContact O-CG 3.28Å; S23-K27 PolarHBondContact O-N 3.33Å; S23-K27 WeakPolarHBondContact OG-CE 3.41Å
24	N	44.5	Very low	53.8	Low	107 Å²	107	100.9 Å²	100.9	57%	0.572	53%	0.534	S	S	*	.	H	α-helix	trans	-68.7	-34.1	-177.8	-94.9	-11.6	0	0	0	114.8	D20 N22 Q28	D20-N24 PolarHBondContact O-N 2.95Å; N22-N24 VanDerWaalsContact C-N 3.35Å; N22-N24 PolarHBondContact O-N 3.34Å; N24-Q28 PolarHBondContact O-N 3.14Å
25	R	49.9	Very low	56.9	Low	201 Å²	201	96.2 Å²	96.2	76%	0.758	50%	0.501	S	S	*	.	H	α-helix	trans	-68	-39.5	174.1	-93.9	-173.8	175.9	-178.9	0.4	111.8	S23 Q28	S23-R25 PolarHBondContact O-N 2.81Å; R25-Q28 PolarHBondContact O-N 3.15Å
26	N	52.8	Low	59.8	Low	48 Å²	48	98.1 Å²	98.1	26%	0.257	51%	0.506	S	S	.	.	H	α-helix	trans	-74.9	-32.1	179.7	-72.8	-8.4	0	0	0	112.5	S23 Q28 K29 F147	S23-N26 PolarHBondContact O-N 3.21Å; N26-Q28 VanDerWaalsContact C-N 3.27Å; N26-Q28 PolarHBondContact O-N 3.34Å; N26-K29 PolarHBondContact O-N 2.93Å; N26-K29 VanDerWaalsContact O-N 3.1Å; N26-F147 HydrophobicContact CB-CD1 4.41Å; N26-F147 HydrophobicContact CB-CD2 4.41Å; N26-F147 HydrophobicContact CB-CE1 3.9Å; N26-F147 HydrophobicContact CB-CE2 3.92Å; N26-F147 HydrophobicContact CB-CZ 3.65Å
27	K	54.8	Low	62.7	Low	95 Å²	95	92.4 Å²	92.4	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-30.8	173.2	-82.3	-179.6	-179.7	178.4	0	113.1	D17 S23 K29	D17-K27 PolarHBondContact O-NZ 3.33Å; S23-K27 WeakPolarHBondContact O-CB 3.33Å; S23-K27 WeakPolarHBondContact O-CG 3.28Å; S23-K27 PolarHBondContact O-N 3.33Å; S23-K27 WeakPolarHBondContact OG-CE 3.41Å; K27-K29 VanDerWaalsContact C-N 3.29Å; K27-K29 PolarHBondContact O-N 3.43Å
28	Q	69.5	Low	65.6	Low	155 Å²	155	94.3 Å²	94.3	72%	0.724	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19	175.5	-75.7	-172.2	-8.7	0	0	113.7	N24 R25 N26	N24-Q28 PolarHBondContact O-N 3.14Å; R25-Q28 PolarHBondContact O-N 3.15Å; N26-Q28 VanDerWaalsContact C-N 3.27Å; N26-Q28 PolarHBondContact O-N 3.34Å
29	K	83.6	Confident	68.7	Low	36 Å²	36	92.3 Å²	92.3	16%	0.157	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-18.4	179.8	-66.7	-174.3	174.7	-174.8	0	113.5	N26 K27 Y45 L46 D144	N26-K29 PolarHBondContact O-N 2.93Å; N26-K29 VanDerWaalsContact O-N 3.1Å; K27-K29 VanDerWaalsContact C-N 3.29Å; K27-K29 PolarHBondContact O-N 3.43Å; K29-Y45 HydrophobicContact CB-CD2 4.44Å; K29-Y45 HydrophobicContact CB-CE2 4.39Å; K29-Y45 HydrophobicContact CD-CE2 4.38Å; K29-Y45 WeakPolarHBondContact O-CA 3.45Å; K29-L46 PolarHBondContact O-N 3.4Å; K29-D144 WeakPolarHBondContact CD-OD2 3.35Å; K29-D144 IonicContact NZ-OD1 3.42Å; K29-D144 PolarHBondContact NZ-OD1 3.23Å; K29-D144 IonicContact NZ-OD2 3.23Å; K29-D144 PolarHBondContact NZ-OD2 3.18Å
30	L	90	Very high	71.8	Confident	19 Å²	19	86.2 Å²	86.2	10%	0.099	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127	-176.7	-66.3	-178.7	0	0	0	111.7	I43 V44 Y45 F147 L148 R151	L30-I43 HydrophobicContact CD2-CG2 4Å; L30-V44 CarbonylContact C-O 3.23Å; L30-V44 WeakPolarHBondContact CA-O 3.48Å; L30-Y45 HydrophobicContact CD2-CD2 3.77Å; L30-Y45 HydrophobicContact CD2-CG 4.2Å; L30-F147 HydrophobicContact CD1-CD1 4.33Å; L30-F147 HydrophobicContact CD1-CE1 3.31Å; L30-F147 HydrophobicContact CD1-CZ 3.45Å; L30-F147 VanDerWaalsContact CD1-CZ 3.45Å; L30-F147 HydrophobicContact CG-CE1 3.84Å; L30-F147 HydrophobicContact CG-CZ 4.21Å; L30-L148 HydrophobicContact CD2-CD1 3.85Å; L30-R151 HydrophobicContact CD1-CB 4.16Å; L30-R151 HydrophobicContact CD1-CG 3.83Å
31	F	92	Very high	74.9	Confident	85 Å²	85	80.8 Å²	80.8	37%	0.373	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	116.3	169.7	-67	-97.9	0	0	0	108.9	I43 V44 L46 L202	F31-I43 CarbonylContact O-C 3.53Å; F31-I43 WeakPolarHBondContact O-CA 3.25Å; F31-V44 HydrophobicContact CB-CB 4.24Å; F31-V44 PolarHBondContact N-O 2.83Å; F31-V44 PolarHBondContact O-N 3.39Å; F31-L46 HydrophobicContact CD2-CD1 3.85Å; F31-L46 HydrophobicContact CD2-CG 4.14Å; F31-L46 HydrophobicContact CE2-CD1 3.36Å; F31-L46 HydrophobicContact CE2-CG 4.1Å; F31-L46 HydrophobicContact CZ-CD1 4.33Å; F31-L202 HydrophobicContact CB-CD1 3.84Å; F31-L202 HydrophobicContact CD1-CD1 4.22Å; F31-L202 HydrophobicContact CD2-CD2 4.42Å; F31-L202 HydrophobicContact CG-CD1 3.98Å
32	V	92.5	Very high	77.5	Confident	49 Å²	49	76.2 Å²	76.2	30%	0.297	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.7	179.7	-174.6	0	0	0	0	108.8	Q41 I42 I43	V32-Q41 HydrophobicContact CG1-CG 3.97Å; V32-I42 CarbonylContact C-O 3.56Å; V32-I42 WeakPolarHBondContact CA-O 3.38Å; V32-I43 HydrophobicContact CG1-CG1 4.23Å; V32-I43 HydrophobicContact CG2-CG1 4.22Å; V32-I43 HydrophobicContact CG2-CG2 4.29Å
33	T	92.9	Very high	80.1	Confident	47 Å²	47	69.7 Å²	69.7	29%	0.288	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	121.3	177	-54.1	0	0	0	0	109.7	I42 V197	T33-I42 PolarHBondContact N-O 3.34Å; T33-I42 PolarHBondContact O-N 3.48Å; T33-V197 HydrophobicContact CG2-CG1 3.57Å
34	M	90	Very high	82.5	Confident	78 Å²	78	67.9 Å²	67.9	38%	0.384	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	143	170.6	-74	-61.3	-69	0	0	110.1	K38 Q41 F159	M34-K38 VanDerWaalsContact CE-CA 3.47Å; M34-K38 HydrophobicContact CE-CB 3.74Å; M34-K38 HydrophobicContact CE-CG 4.33Å; M34-K38 WeakPolarHBondContact CE-O 3.42Å; M34-Q41 HydrophobicContact CE-CB 4.45Å; M34-Q41 HydrophobicContact CG-CG 4.23Å; M34-Q41 HydrophobicContact SD-CB 3.4Å; M34-Q41 WeakPolarHBondContact SD-CB 3.32Å; M34-Q41 HydrophobicContact SD-CG 3.26Å; M34-Q41 WeakPolarHBondContact SD-CG 3Å; M34-Q41 PolarHBondContact SD-NE2 3.49Å; M34-F159 HydrophobicContact CE-CZ 4.27Å
35	F	91.8	Very high	84.9	Confident	6 Å²	6	62.8 Å²	62.8	3%	0.026	29%	0.29	C	S	.	.			trans	-74.1	163.5	165.8	-73.1	-100.6	0	0	0	111	S37 K38 A40 I42 L64 V197 F210 E212	F35-S37 VanDerWaalsContact C-N 3.33Å; F35-S37 PolarHBondContact O-N 3.5Å; F35-K38 PolarHBondContact O-N 3.5Å; F35-A40 HydrophobicContact CB-CB 4.28Å; F35-A40 HydrophobicContact CD2-CB 3.44Å; F35-A40 VanDerWaalsContact CD2-CB 3.44Å; F35-A40 WeakPolarHBondContact CD2-O 3.37Å; F35-A40 HydrophobicContact CE2-CB 3.84Å; F35-A40 HydrophobicContact CG-CB 3.99Å; F35-A40 PolarHBondContact N-O 2.89Å; F35-I42 HydrophobicContact CE2-CD1 3.44Å; F35-I42 VanDerWaalsContact CE2-CD1 3.44Å; F35-I42 HydrophobicContact CE2-CG1 3.77Å; F35-I42 HydrophobicContact CZ-CD1 3.42Å; F35-I42 VanDerWaalsContact CZ-CD1 3.42Å; F35-I42 HydrophobicContact CZ-CG1 4.24Å; F35-L64 HydrophobicContact CD1-CD2 4.15Å; F35-L64 HydrophobicContact CE1-CD2 3.67Å; F35-L64 HydrophobicContact CE2-CD1 4.4Å; F35-L64 HydrophobicContact CE2-CD2 4.33Å; F35-L64 HydrophobicContact CZ-CD1 4.16Å; F35-L64 HydrophobicContact CZ-CD2 3.75Å; F35-V197 HydrophobicContact CD1-CB 4.22Å; F35-V197 HydrophobicContact CD1-CG2 3.75Å; F35-V197 HydrophobicContact CE1-CB 3.72Å; F35-V197 HydrophobicContact CE1-CG2 3.73Å; F35-V197 HydrophobicContact CE2-CB 4.27Å; F35-V197 HydrophobicContact CE2-CG1 4.33Å; F35-V197 HydrophobicContact CG-CG2 4.27Å; F35-V197 HydrophobicContact CZ-CB 3.78Å; F35-V197 HydrophobicContact CZ-CG1 4.3Å; F35-V197 HydrophobicContact CZ-CG2 4.24Å; F35-F210 HydrophobicContact CE1-CB 4.16Å; F35-F210 HydrophobicContact CZ-CB 3.81Å; F35-E212 WeakPolarHBondContact CB-OE2 3.45Å; F35-E212 HydrophobicContact CD1-CB 3.72Å; F35-E212 HydrophobicContact CE1-CB 4.22Å
36	E	87.1	Confident	86.8	Confident	191 Å²	191	55.1 Å²	55.1	89%	0.893	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-38.7	-175.3	-68.8	-168.9	164.7	0	0	112.8	K38	E36-K38 PolarHBondContact O-N 3.44Å
37	S	87.3	Confident	88.1	Confident	48 Å²	48	53.9 Å²	53.9	34%	0.336	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.4	177.8	74	0	0	0	0	113.8	F35 R39 E212	F35-S37 VanDerWaalsContact C-N 3.33Å; F35-S37 PolarHBondContact O-N 3.5Å; S37-R39 PolarHBondContact O-N 3.48Å; S37-R39 WeakPolarHBondContact OG-CB 3.46Å; S37-R39 PolarHBondContact OG-N 3Å; S37-E212 WeakPolarHBondContact CB-OE1 3.44Å; S37-E212 WeakPolarHBondContact CB-OE2 3.46Å; S37-E212 PolarHBondContact N-OE2 3.01Å; S37-E212 PolarHBondContact OG-OE1 2.75Å; S37-E212 PolarHBondContact OG-OE2 3.01Å; S37-E212 VanDerWaalsContact OG-OE2 3.04Å
38	K	88.8	Confident	89.1	Confident	155 Å²	155	53.8 Å²	53.8	67%	0.674	27%	0.269	S	S	*	.	S	Bend	trans	59.1	14.6	-167.4	-52.4	177.5	-179.9	177.4	0	115.1	M34 F35 E36	M34-K38 VanDerWaalsContact CE-CA 3.47Å; M34-K38 HydrophobicContact CE-CB 3.74Å; M34-K38 HydrophobicContact CE-CG 4.33Å; M34-K38 WeakPolarHBondContact CE-O 3.42Å; F35-K38 PolarHBondContact O-N 3.5Å; E36-K38 PolarHBondContact O-N 3.44Å
39	R	89.8	Confident	89.3	Confident	97 Å²	97	57.3 Å²	57.3	37%	0.366	28%	0.276	S	S	.	.	S	Bend	trans	-95.7	-4.2	174.2	-56	-176.1	-63.3	156.5	4.9	113.2	S37 G59 H60 D61 T62 E212	S37-R39 PolarHBondContact O-N 3.48Å; S37-R39 WeakPolarHBondContact OG-CB 3.46Å; S37-R39 PolarHBondContact OG-N 3Å; R39-G59 WeakPolarHBondContact O-CA 3.44Å; R39-G59 PolarHBondContact O-N 3.47Å; R39-H60 PolarHBondContact NH1-O 3.41Å; R39-D61 VanDerWaalsContact CZ-O 3.28Å; R39-D61 PolarHBondContact NH1-O 2.9Å; R39-D61 PolarHBondContact NH2-O 3.49Å; R39-D61 VanDerWaalsContact NH2-O 3.12Å; R39-T62 HydrophobicContact CB-CG2 4.43Å; R39-T62 WeakPolarHBondContact CB-OG1 3.34Å; R39-E212 IonicContact NH2-OE1 2.84Å
40	A	93.8	Very high	89	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	154	166.8	0	0	0	0	0	111.6	F35 L57 L58 T62 L64	F35-A40 HydrophobicContact CB-CB 4.28Å; F35-A40 HydrophobicContact CD2-CB 3.44Å; F35-A40 VanDerWaalsContact CD2-CB 3.44Å; F35-A40 WeakPolarHBondContact CD2-O 3.37Å; F35-A40 HydrophobicContact CE2-CB 3.84Å; F35-A40 HydrophobicContact CG-CB 3.99Å; F35-A40 PolarHBondContact N-O 2.89Å; A40-L57 CarbonylContact C-O 3.58Å; A40-L57 WeakPolarHBondContact CA-O 3.38Å; A40-L58 HydrophobicContact CB-CD1 4.23Å; A40-T62 HydrophobicContact CB-CG2 3.96Å; A40-L64 HydrophobicContact CB-CD1 4.31Å; A40-L64 HydrophobicContact CB-CD2 4.34Å
41	Q	95.2	Very high	88.5	Confident	8 Å²	8	66.5 Å²	66.5	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	141	174.3	-166.4	173.5	35.1	0	0	110.7	V32 M34 I56 L57 E155 F159	V32-Q41 HydrophobicContact CG1-CG 3.97Å; M34-Q41 HydrophobicContact CE-CB 4.45Å; M34-Q41 HydrophobicContact CG-CG 4.23Å; M34-Q41 HydrophobicContact SD-CB 3.4Å; M34-Q41 WeakPolarHBondContact SD-CB 3.32Å; M34-Q41 HydrophobicContact SD-CG 3.26Å; M34-Q41 WeakPolarHBondContact SD-CG 3Å; M34-Q41 PolarHBondContact SD-NE2 3.49Å; Q41-I56 WeakPolarHBondContact O-CA 3.47Å; Q41-L57 HydrophobicContact CB-CB 4.26Å; Q41-L57 PolarHBondContact N-O 3.33Å; Q41-L57 PolarHBondContact O-N 3.08Å; Q41-E155 PolarHBondContact NE2-OE2 3.3Å; Q41-E155 PolarHBondContact OE1-OE2 3.23Å; Q41-F159 HydrophobicContact CB-CE2 4.32Å; Q41-F159 HydrophobicContact CB-CZ 4Å
42	I	95.6	Very high	88.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.2	170.9	-83	159.5	0	0	0	109.9	V32 T33 F35 V44 F55 I56 V197 P198 F210	V32-I42 CarbonylContact C-O 3.56Å; V32-I42 WeakPolarHBondContact CA-O 3.38Å; T33-I42 PolarHBondContact N-O 3.34Å; T33-I42 PolarHBondContact O-N 3.48Å; F35-I42 HydrophobicContact CE2-CD1 3.44Å; F35-I42 VanDerWaalsContact CE2-CD1 3.44Å; F35-I42 HydrophobicContact CE2-CG1 3.77Å; F35-I42 HydrophobicContact CZ-CD1 3.42Å; F35-I42 VanDerWaalsContact CZ-CD1 3.42Å; F35-I42 HydrophobicContact CZ-CG1 4.24Å; I42-V44 HydrophobicContact CG2-CG2 3.63Å; I42-F55 CarbonylContact C-O 3.5Å; I42-F55 WeakPolarHBondContact CA-O 3.39Å; I42-I56 HydrophobicContact CD1-CD1 4.48Å; I42-I56 HydrophobicContact CG1-CD1 4.25Å; I42-I56 HydrophobicContact CG1-CG1 3.81Å; I42-V197 HydrophobicContact CB-CG1 4.15Å; I42-V197 HydrophobicContact CD1-CB 3.9Å; I42-V197 HydrophobicContact CD1-CG1 3.57Å; I42-V197 HydrophobicContact CG1-CG1 4.4Å; I42-P198 HydrophobicContact CG2-CB 4.45Å; I42-F210 HydrophobicContact CD1-CB 4.35Å; I42-F210 HydrophobicContact CD1-CD2 3.53Å; I42-F210 HydrophobicContact CD1-CE2 4.21Å; I42-F210 HydrophobicContact CD1-CG 4.21Å
43	I	95.6	Very high	88.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	105	171.4	-56.7	158.4	0	0	0	107.4	L30 F31 V32 F55 L57 L152 E155	L30-I43 HydrophobicContact CD2-CG2 4Å; F31-I43 CarbonylContact O-C 3.53Å; F31-I43 WeakPolarHBondContact O-CA 3.25Å; V32-I43 HydrophobicContact CG1-CG1 4.23Å; V32-I43 HydrophobicContact CG2-CG1 4.22Å; V32-I43 HydrophobicContact CG2-CG2 4.29Å; I43-F55 HydrophobicContact CB-CB 4.3Å; I43-F55 PolarHBondContact N-O 2.93Å; I43-F55 PolarHBondContact O-N 3.04Å; I43-L57 HydrophobicContact CD1-CD1 4.26Å; I43-L57 HydrophobicContact CD1-CG 4.43Å; I43-L152 HydrophobicContact CD1-CD2 3.64Å; I43-E155 HydrophobicContact CD1-CB 4.09Å; I43-E155 HydrophobicContact CD1-CG 3.85Å
44	V	95.2	Very high	88.5	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120.4	175.9	-174.5	0	0	0	0	109.2	L30 F31 I42 L46 S53 P198 L202 L206	L30-V44 CarbonylContact C-O 3.23Å; L30-V44 WeakPolarHBondContact CA-O 3.48Å; F31-V44 HydrophobicContact CB-CB 4.24Å; F31-V44 PolarHBondContact N-O 2.83Å; F31-V44 PolarHBondContact O-N 3.39Å; I42-V44 HydrophobicContact CG2-CG2 3.63Å; V44-L46 HydrophobicContact CG1-CD2 3.92Å; V44-S53 CarbonylContact C-O 3.56Å; V44-S53 WeakPolarHBondContact CA-O 3.37Å; V44-P198 HydrophobicContact CG2-CB 4.1Å; V44-P198 HydrophobicContact CG2-CG 4.14Å; V44-L202 HydrophobicContact CG1-CD2 4.36Å; V44-L202 HydrophobicContact CG2-CD1 4.35Å; V44-L206 HydrophobicContact CG1-CD1 4.17Å; V44-L206 HydrophobicContact CG1-CD2 4.36Å; V44-L206 HydrophobicContact CG2-CD1 4.09Å
45	Y	93.7	Very high	88.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121	173.7	171.6	-119.8	0	0	0	110.7	K29 L30 P47 S53 C140 D141 D144	K29-Y45 HydrophobicContact CB-CD2 4.44Å; K29-Y45 HydrophobicContact CB-CE2 4.39Å; K29-Y45 HydrophobicContact CD-CE2 4.38Å; K29-Y45 WeakPolarHBondContact O-CA 3.45Å; L30-Y45 HydrophobicContact CD2-CD2 3.77Å; L30-Y45 HydrophobicContact CD2-CG 4.2Å; Y45-P47 HydrophobicContact CD1-CB 4.34Å; Y45-P47 HydrophobicContact CD1-CG 4.42Å; Y45-P47 HydrophobicContact CE1-CB 3.55Å; Y45-P47 HydrophobicContact CE1-CG 4.05Å; Y45-P47 HydrophobicContact CE2-CB 4.5Å; Y45-P47 WeakPolarHBondContact O-CD 3.43Å; Y45-S53 PolarHBondContact N-O 3.02Å; Y45-S53 PolarHBondContact O-N 2.88Å; Y45-C140 HydrophobicContact CD1-CB 4.32Å; Y45-C140 HydrophobicContact CE1-CB 3.66Å; Y45-D141 WeakPolarHBondContact OH-CB 3.26Å; Y45-D141 PolarHBondContact OH-N 2.78Å; Y45-D144 HydrophobicContact CE2-CB 4.09Å; Y45-D144 WeakPolarHBondContact CE2-OD2 3.35Å; Y45-D144 WeakPolarHBondContact OH-CB 3.21Å; Y45-D144 PolarHBondContact OH-OD2 3.06Å
46	L	90.2	Very high	89	Confident	41 Å²	41	55.1 Å²	55.1	22%	0.215	26%	0.259	C	S	.	.			trans	-103.5	90.9	175.1	-57.3	-171.4	0	0	0	108.9	K29 F31 V44 C52 L202 L205	K29-L46 PolarHBondContact O-N 3.4Å; F31-L46 HydrophobicContact CD2-CD1 3.85Å; F31-L46 HydrophobicContact CD2-CG 4.14Å; F31-L46 HydrophobicContact CE2-CD1 3.36Å; F31-L46 HydrophobicContact CE2-CG 4.1Å; F31-L46 HydrophobicContact CZ-CD1 4.33Å; V44-L46 HydrophobicContact CG1-CD2 3.92Å; L46-C52 HydrophobicContact CD2-CB 4.24Å; L46-L202 HydrophobicContact CD2-CD2 4.49Å; L46-L205 HydrophobicContact CD2-CD2 3.7Å
47	P	81.3	Confident	89.5	Confident	22 Å²	22	46 Å²	46	14%	0.143	22%	0.216	C	C	.	.			trans	-69.1	167.2	177.3	28.3	-35.6	0	0	0	112.1	Y45 R50 L51 D141	Y45-P47 HydrophobicContact CD1-CB 4.34Å; Y45-P47 HydrophobicContact CD1-CG 4.42Å; Y45-P47 HydrophobicContact CE1-CB 3.55Å; Y45-P47 HydrophobicContact CE1-CG 4.05Å; Y45-P47 HydrophobicContact CE2-CB 4.5Å; Y45-P47 WeakPolarHBondContact O-CD 3.43Å; P47-R50 HydrophobicContact CB-CB 3.86Å; P47-R50 VanDerWaalsContact CG-C 3.47Å; P47-R50 HydrophobicContact CG-CB 3.79Å; P47-R50 WeakPolarHBondContact CG-O 3.46Å; P47-L51 VanDerWaalsContact CG-O 3.32Å; P47-L51 WeakPolarHBondContact CG-O 3.46Å; P47-D141 WeakPolarHBondContact CB-OD2 3.4Å
48	S	76.1	Confident	89.8	Confident	92 Å²	92	43.7 Å²	43.7	64%	0.643	20%	0.2	S	C	*	.	S	Bend	trans	-88.5	-29.1	174.7	-56.7	0	0	0	0	112.7	D141	S48-D141 PolarHBondContact N-OD2 2.79Å
49	R	72.9	Confident	89.9	Confident	230 Å²	230	36.5 Å²	36.5	87%	0.868	17%	0.17	S	C	*	.	S	Bend	trans	-124.5	-13.1	-174.9	-61.7	-177.2	179.8	-176.2	0.2	115.1	D141	R49-D141 PolarHBondContact N-OD2 3.41Å
50	R	77.4	Confident	89.7	Confident	143 Å²	143	34.2 Å²	34.2	54%	0.54	16%	0.163	S	C	.	.	S	Bend	trans	-107.9	178.2	-174.1	-70.1	-75.3	-172.4	160.5	3.7	111.9	P47 D141	P47-R50 HydrophobicContact CB-CB 3.86Å; P47-R50 VanDerWaalsContact CG-C 3.47Å; P47-R50 HydrophobicContact CG-CB 3.79Å; P47-R50 WeakPolarHBondContact CG-O 3.46Å; R50-D141 VanDerWaalsContact CG-OD1 3.27Å; R50-D141 WeakPolarHBondContact CG-OD1 3.4Å
51	L	78.7	Confident	89.1	Confident	104 Å²	104	37.8 Å²	37.8	55%	0.545	18%	0.182	S	C	.	.			trans	-71.7	145.4	170.4	-71.3	169.1	0	0	0	110.3	P47 S53	P47-L51 VanDerWaalsContact CG-O 3.32Å; P47-L51 WeakPolarHBondContact CG-O 3.46Å; L51-S53 PolarHBondContact O-N 3.32Å
52	C	89.4	Confident	88.8	Confident	22 Å²	22	37.4 Å²	37.4	15%	0.149	18%	0.18	C	C	.	.			trans	-54.8	138.3	173.2	-63.9	0	0	0	0	110.4	L46 P170 L206	L46-C52 HydrophobicContact CD2-CB 4.24Å; C52-P170 WeakPolarHBondContact O-CD 2.99Å; C52-L206 HydrophobicContact CB-CD2 3.81Å
53	S	92.3	Very high	88.6	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.3	179.7	-71.2	0	0	0	0	110	V44 Y45 L51 H167	V44-S53 CarbonylContact C-O 3.56Å; V44-S53 WeakPolarHBondContact CA-O 3.37Å; Y45-S53 PolarHBondContact N-O 3.02Å; Y45-S53 PolarHBondContact O-N 2.88Å; L51-S53 PolarHBondContact O-N 3.32Å; S53-H167 VanDerWaalsContact CB-NE2 3.3Å; S53-H167 WeakPolarHBondContact CB-NE2 3.39Å; S53-H167 PolarHBondContact OG-NE2 2.76Å
54	C	96	Very high	88.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.4	176.5	177	0	0	0	0	108.2	H167 F168 L206 F208	C54-H167 CarbonylContact O-C 3.51Å; C54-F168 HydrophobicContact CB-CB 4.18Å; C54-F168 PolarHBondContact N-O 3.08Å; C54-F168 PolarHBondContact O-N 3.16Å; C54-L206 HydrophobicContact CB-CD1 4.02Å; C54-L206 HydrophobicContact CB-CD2 4.27Å; C54-F208 HydrophobicContact CB-CE2 3.89Å; C54-F208 HydrophobicContact CB-CZ 3.88Å
55	F	96.8	Very high	88.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.1	172.9	-59.6	-91.2	0	0	0	109	I42 I43 L75 L136 L148 L152 L166 H167	I42-F55 CarbonylContact C-O 3.5Å; I42-F55 WeakPolarHBondContact CA-O 3.39Å; I43-F55 HydrophobicContact CB-CB 4.3Å; I43-F55 PolarHBondContact N-O 2.93Å; I43-F55 PolarHBondContact O-N 3.04Å; F55-L75 HydrophobicContact CD1-CD1 4.07Å; F55-L75 HydrophobicContact CE1-CD1 3.89Å; F55-L136 HydrophobicContact CE1-CD2 3.65Å; F55-L136 HydrophobicContact CZ-CD2 3.93Å; F55-L148 HydrophobicContact CD2-CD1 4.26Å; F55-L148 HydrophobicContact CE2-CD1 3.96Å; F55-L148 HydrophobicContact CE2-CD2 3.66Å; F55-L148 HydrophobicContact CE2-CG 4.3Å; F55-L148 HydrophobicContact CZ-CD2 3.59Å; F55-L148 HydrophobicContact CZ-CG 4.48Å; F55-L152 HydrophobicContact CB-CD2 3.92Å; F55-L152 HydrophobicContact CD1-CD1 4.16Å; F55-L152 HydrophobicContact CD1-CD2 4.42Å; F55-L152 HydrophobicContact CE1-CD1 4.38Å; F55-L152 HydrophobicContact CG-CD1 4.48Å; F55-L152 HydrophobicContact CG-CD2 4.16Å; F55-L166 CarbonylContact C-O 3.58Å; F55-L166 VanDerWaalsContact CA-O 3.27Å; F55-L166 WeakPolarHBondContact CA-O 3.3Å; F55-H167 HydrophobicContact CD1-CB 4.18Å; F55-H167 HydrophobicContact CE1-CB 4.04Å; F55-H167 AromaticContact CE1-CD2 3.59Å; F55-H167 AromaticContact CZ-CD2 3.6Å
56	I	96.8	Very high	88.7	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.7	173	-61.3	-170.8	0	0	0	108	Q41 I42 L58 L64 T164 V165 L166 F168 F210	Q41-I56 WeakPolarHBondContact O-CA 3.47Å; I42-I56 HydrophobicContact CD1-CD1 4.48Å; I42-I56 HydrophobicContact CG1-CD1 4.25Å; I42-I56 HydrophobicContact CG1-CG1 3.81Å; I56-L58 HydrophobicContact CG2-CB 4.18Å; I56-L64 HydrophobicContact CD1-CD1 4.18Å; I56-L64 HydrophobicContact CG2-CD1 3.85Å; I56-T164 VanDerWaalsContact O-O 3.11Å; I56-V165 WeakPolarHBondContact O-CA 3.04Å; I56-L166 HydrophobicContact CB-CB 4.32Å; I56-L166 PolarHBondContact N-O 2.93Å; I56-L166 PolarHBondContact O-N 2.9Å; I56-F168 HydrophobicContact CB-CE2 4.43Å; I56-F168 HydrophobicContact CD1-CD2 3.93Å; I56-F168 HydrophobicContact CD1-CE2 3.62Å; I56-F168 HydrophobicContact CD1-CZ 4.27Å; I56-F168 HydrophobicContact CG1-CD2 4.05Å; I56-F168 HydrophobicContact CG1-CE2 4.03Å; I56-F210 HydrophobicContact CD1-CD1 3.8Å; I56-F210 HydrophobicContact CD1-CD2 3.94Å; I56-F210 HydrophobicContact CD1-CE1 3.48Å; I56-F210 VanDerWaalsContact CD1-CE1 3.48Å; I56-F210 HydrophobicContact CD1-CE2 3.63Å; I56-F210 HydrophobicContact CD1-CG 4.03Å; I56-F210 HydrophobicContact CD1-CZ 3.41Å; I56-F210 VanDerWaalsContact CD1-CZ 3.41Å
57	L	96.1	Very high	89	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	114.4	162.1	-51.5	-175	0	0	0	106.8	A40 Q41 I43 L152 E155 I156 F159 T164 V165	A40-L57 CarbonylContact C-O 3.58Å; A40-L57 WeakPolarHBondContact CA-O 3.38Å; Q41-L57 HydrophobicContact CB-CB 4.26Å; Q41-L57 PolarHBondContact N-O 3.33Å; Q41-L57 PolarHBondContact O-N 3.08Å; I43-L57 HydrophobicContact CD1-CD1 4.26Å; I43-L57 HydrophobicContact CD1-CG 4.43Å; L57-L152 HydrophobicContact CD2-CD2 4.13Å; L57-E155 HydrophobicContact CD1-CB 3.51Å; L57-I156 HydrophobicContact CD1-CG1 4.1Å; L57-I156 HydrophobicContact CD2-CG1 3.95Å; L57-F159 HydrophobicContact CB-CE2 4.01Å; L57-F159 HydrophobicContact CB-CZ 4.1Å; L57-F159 HydrophobicContact CD1-CE2 3.96Å; L57-T164 WeakPolarHBondContact CA-O 3.3Å; L57-V165 HydrophobicContact CD2-CB 4.35Å; L57-V165 HydrophobicContact CD2-CG1 4.07Å; L57-V165 HydrophobicContact CD2-CG2 3.82Å
58	L	94.4	Very high	89.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	114.5	-176.1	-172.5	68.5	0	0	0	109.3	A40 I56 T62 L64 I80 I108 Q110 V163 T164	A40-L58 HydrophobicContact CB-CD1 4.23Å; I56-L58 HydrophobicContact CG2-CB 4.18Å; L58-T62 HydrophobicContact CD1-CG2 3.62Å; L58-L64 HydrophobicContact CD1-CD1 3.64Å; L58-L64 HydrophobicContact CD1-CG 3.78Å; L58-I80 HydrophobicContact CD2-CG2 4.24Å; L58-I108 HydrophobicContact CD2-CG2 3.98Å; L58-Q110 HydrophobicContact CD2-CB 3.95Å; L58-Q110 HydrophobicContact CG-CB 4.15Å; L58-Q110 PolarHBondContact O-NE2 3.15Å; L58-Q110 VanDerWaalsContact O-NE2 3.09Å; L58-V163 CarbonylContact O-C 3.54Å; L58-V163 WeakPolarHBondContact O-CA 3.28Å; L58-T164 PolarHBondContact N-O 3.4Å; L58-T164 PolarHBondContact O-N 3.24Å
59	G	90.5	Very high	90.6	Very high	3 Å²	3	34 Å²	34	3%	0.031	15%	0.15	C	C	.	.			trans	-88.9	179.6	174.3	0	0	0	0	0	113.2	R39 T62 Q110	R39-G59 WeakPolarHBondContact O-CA 3.44Å; R39-G59 PolarHBondContact O-N 3.47Å; G59-T62 VanDerWaalsContact O-CB 3.26Å; G59-T62 WeakPolarHBondContact O-CB 3.45Å; G59-T62 PolarHBondContact O-N 3.37Å; G59-T62 PolarHBondContact O-OG1 3.21Å; G59-Q110 PolarHBondContact O-OE1 2.63Å
60	H	85.3	Confident	91.7	Very high	49 Å²	49	23 Å²	23	23%	0.227	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	145.5	-171	-166.6	-89.2	0	0	0	113.2	R39 T62 P112 E161	R39-H60 PolarHBondContact NH1-O 3.41Å; H60-T62 PolarHBondContact O-N 2.9Å; H60-T62 PolarHBondContact O-OG1 2.72Å; H60-P112 VanDerWaalsContact NE2-CA 3.3Å; H60-P112 WeakPolarHBondContact NE2-CA 3.41Å; H60-P112 WeakPolarHBondContact NE2-CB 3.32Å; H60-E161 WeakPolarHBondContact CB-OE2 3.34Å; H60-E161 IonicContact CG-OE2 2.81Å
61	D	81.2	Confident	92.6	Very high	75 Å²	75	21.2 Å²	21.2	40%	0.401	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	33	-179.9	-65.6	-31.1	0	0	0	114.1	R39	R39-D61 VanDerWaalsContact CZ-O 3.28Å; R39-D61 PolarHBondContact NH1-O 2.9Å; R39-D61 PolarHBondContact NH2-O 3.49Å; R39-D61 VanDerWaalsContact NH2-O 3.12Å
62	T	89.1	Confident	93.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.076	C	C	.	.			trans	-101.1	128.3	178.1	-53.5	0	0	0	0	109.9	R39 A40 L58 G59 H60 L64 T109	R39-T62 HydrophobicContact CB-CG2 4.43Å; R39-T62 WeakPolarHBondContact CB-OG1 3.34Å; A40-T62 HydrophobicContact CB-CG2 3.96Å; L58-T62 HydrophobicContact CD1-CG2 3.62Å; G59-T62 VanDerWaalsContact O-CB 3.26Å; G59-T62 WeakPolarHBondContact O-CB 3.45Å; G59-T62 PolarHBondContact O-N 3.37Å; G59-T62 PolarHBondContact O-OG1 3.21Å; H60-T62 PolarHBondContact O-N 2.9Å; H60-T62 PolarHBondContact O-OG1 2.72Å; T62-L64 HydrophobicContact CG2-CD2 4.27Å; T62-L64 HydrophobicContact CG2-CG 4.45Å; T62-T109 WeakPolarHBondContact O-CA 3.33Å
63	H	92.3	Very high	93.7	Very high	44 Å²	44	15.3 Å²	15.3	20%	0.204	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.1	179.2	-47.8	-86.7	0	0	0	110.1	I108 T109 E212 H213 G215	H63-I108 WeakPolarHBondContact CA-O 3.36Å; H63-T109 VanDerWaalsContact CE1-CG2 3.42Å; H63-T109 WeakPolarHBondContact CE1-CG2 3.24Å; H63-T109 VanDerWaalsContact ND1-CG2 3.27Å; H63-T109 WeakPolarHBondContact ND1-CG2 3.23Å; H63-T109 PolarHBondContact ND1-OG1 2.62Å; H63-E212 WeakPolarHBondContact O-CA 3.28Å; H63-H213 WeakPolarHBondContact CB-CE1 3.24Å; H63-H213 WeakPolarHBondContact CB-NE2 3.09Å; H63-H213 PolarHBondContact O-N 3.07Å; H63-G215 PolarHBondContact CD2-N 2.92Å
64	L	95.1	Very high	93.8	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.01	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	112.4	178.4	-62.8	-175.2	0	0	0	110.2	F35 A40 I56 L58 T62 S107 I108 E212	F35-L64 HydrophobicContact CD1-CD2 4.15Å; F35-L64 HydrophobicContact CE1-CD2 3.67Å; F35-L64 HydrophobicContact CE2-CD1 4.4Å; F35-L64 HydrophobicContact CE2-CD2 4.33Å; F35-L64 HydrophobicContact CZ-CD1 4.16Å; F35-L64 HydrophobicContact CZ-CD2 3.75Å; A40-L64 HydrophobicContact CB-CD1 4.31Å; A40-L64 HydrophobicContact CB-CD2 4.34Å; I56-L64 HydrophobicContact CD1-CD1 4.18Å; I56-L64 HydrophobicContact CG2-CD1 3.85Å; L58-L64 HydrophobicContact CD1-CD1 3.64Å; L58-L64 HydrophobicContact CD1-CG 3.78Å; T62-L64 HydrophobicContact CG2-CD2 4.27Å; T62-L64 HydrophobicContact CG2-CG 4.45Å; L64-S107 CarbonylContact O-C 3.49Å; L64-S107 WeakPolarHBondContact O-CA 3.48Å; L64-I108 PolarHBondContact N-O 2.78Å; L64-I108 PolarHBondContact O-N 2.89Å; L64-E212 HydrophobicContact CD2-CB 3.96Å; L64-E212 HydrophobicContact CD2-CG 4.4Å
65	A	94.9	Very high	93.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	128.1	167.9	0	0	0	0	0	109.6	Y67 P105 L106 F210 L211 L217	A65-Y67 HydrophobicContact CB-CE2 3.96Å; A65-P105 HydrophobicContact CB-CB 4.47Å; A65-L106 CarbonylContact C-O 3.53Å; A65-L106 WeakPolarHBondContact CA-O 3.4Å; A65-F210 CarbonylContact O-C 3.39Å; A65-F210 VanDerWaalsContact O-CA 3.25Å; A65-F210 WeakPolarHBondContact O-CA 3.43Å; A65-L211 HydrophobicContact CB-CB 4.39Å; A65-L211 PolarHBondContact N-O 3.4Å; A65-L211 PolarHBondContact O-N 2.83Å; A65-L217 HydrophobicContact CB-CD2 3.4Å; A65-L217 HydrophobicContact CB-CG 4.03Å
66	V	96	Very high	93.5	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.5	177.3	-169.6	0	0	0	0	108.7	S99 L106 I108 F210	V66-S99 WeakPolarHBondContact O-CB 3.47Å; V66-S99 PolarHBondContact O-OG 2.93Å; V66-L106 PolarHBondContact N-O 3Å; V66-I108 HydrophobicContact CG2-CD1 3.59Å; V66-I108 HydrophobicContact CG2-CG1 3.8Å; V66-F210 HydrophobicContact CB-CD1 4.44Å; V66-F210 HydrophobicContact CB-CE1 4.35Å; V66-F210 HydrophobicContact CG1-CD1 4.41Å; V66-F210 HydrophobicContact CG1-CE1 3.97Å; V66-F210 HydrophobicContact CG2-CD1 3.94Å; V66-F210 HydrophobicContact CG2-CE1 3.79Å
67	Y	95.8	Very high	93.3	Very high	15 Å²	15	15.5 Å²	15.5	6%	0.059	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140.8	171.3	-65	-92.3	0	0	0	109.9	A65 P105 P192 F208 T209 L211 Y444	A65-Y67 HydrophobicContact CB-CE2 3.96Å; Y67-P105 HydrophobicContact CD1-CB 4.45Å; Y67-P105 HydrophobicContact CE1-CB 3.96Å; Y67-P105 HydrophobicContact CE1-CG 4.28Å; Y67-P192 HydrophobicContact CD1-CG 3.76Å; Y67-P192 HydrophobicContact CD2-CG 3.74Å; Y67-P192 HydrophobicContact CE1-CG 3.98Å; Y67-P192 HydrophobicContact CE2-CG 3.97Å; Y67-P192 HydrophobicContact CG-CG 3.62Å; Y67-F208 CarbonylContact O-C 3.49Å; Y67-F208 WeakPolarHBondContact O-CA 3.42Å; Y67-F208 VanDerWaalsContact O-CB 3.24Å; Y67-F208 WeakPolarHBondContact O-CB 3.41Å; Y67-T209 HydrophobicContact CD2-CG2 4.46Å; Y67-T209 PolarHBondContact N-O 3.07Å; Y67-T209 PolarHBondContact O-N 2.86Å; Y67-L211 HydrophobicContact CE2-CB 3.84Å; Y67-L211 HydrophobicContact CE2-CD2 4.35Å; Y67-Y444 PolarHBondContact OH-OH 2.93Å
68	G	95.7	Very high	92.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	97.4	-151.8	178	0	0	0	0	0	113.7	S99	G68-S99 PolarHBondContact N-O 2.69Å; G68-S99 PolarHBondContact O-N 2.91Å
69	K	96.1	Very high	92.8	Very high	22 Å²	22	16.3 Å²	16.3	10%	0.096	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	118.9	-175.5	-55.9	-176.6	-69.4	177.4	0	109.6	L97 Y98 C171 L176 D177 F189 G207 F208	K69-L97 WeakPolarHBondContact CA-O 3.37Å; K69-Y98 HydrophobicContact CB-CD1 4.28Å; K69-Y98 HydrophobicContact CD-CD1 4.28Å; K69-Y98 HydrophobicContact CD-CE1 4.42Å; K69-Y98 HydrophobicContact CG-CD1 4.02Å; K69-C171 HydrophobicContact CB-CB 4.23Å; K69-L176 HydrophobicContact CD-CB 4.45Å; K69-L176 HydrophobicContact CD-CD1 4.06Å; K69-D177 IonicContact NZ-OD1 3.08Å; K69-D177 PolarHBondContact NZ-OD1 2.96Å; K69-D177 IonicContact NZ-OD2 2.83Å; K69-F189 HydrophobicContact CD-CD1 4.12Å; K69-F189 HydrophobicContact CD-CD2 4.03Å; K69-F189 HydrophobicContact CD-CE1 4.19Å; K69-F189 HydrophobicContact CD-CE2 4.11Å; K69-F189 HydrophobicContact CD-CG 4.03Å; K69-F189 HydrophobicContact CD-CZ 4.19Å; K69-F189 HydrophobicContact CG-CB 4.38Å; K69-F189 HydrophobicContact CG-CD1 3.43Å; K69-F189 VanDerWaalsContact CG-CD1 3.43Å; K69-F189 HydrophobicContact CG-CD2 4.24Å; K69-F189 HydrophobicContact CG-CE1 3.65Å; K69-F189 HydrophobicContact CG-CE2 4.43Å; K69-F189 HydrophobicContact CG-CG 3.75Å; K69-F189 HydrophobicContact CG-CZ 4.16Å; K69-G207 PolarHBondContact N-O 2.99Å; K69-F208 WeakPolarHBondContact O-CD1 3.34Å
70	A	96.5	Very high	92.9	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.2	179.6	0	0	0	0	0	111.1	L97 F168 C171 F208	A70-L97 PolarHBondContact N-O 2.96Å; A70-L97 PolarHBondContact O-N 3.43Å; A70-F168 HydrophobicContact CB-CD1 3.82Å; A70-C171 VanDerWaalsContact C-CB 3.45Å; A70-F208 HydrophobicContact CB-CB 4.11Å; A70-F208 HydrophobicContact CB-CD1 3.51Å; A70-F208 HydrophobicContact CB-CD2 4.36Å; A70-F208 HydrophobicContact CB-CE1 3.96Å; A70-F208 HydrophobicContact CB-CG 3.74Å
71	R	95.5	Very high	93.3	Very high	105 Å²	105	15.7 Å²	15.7	40%	0.396	8%	0.076	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.6	161.9	179	178.3	-61.3	151.6	5.4	107.2	F95 N96 F168 S169 C171	R71-F95 CarbonylContact C-O 3.59Å; R71-F95 VanDerWaalsContact CA-O 3.31Å; R71-F95 WeakPolarHBondContact CA-O 3.37Å; R71-N96 PolarHBondContact NE-OD1 3.11Å; R71-N96 VanDerWaalsContact NE-OD1 3.08Å; R71-F168 CarbonylContact O-C 3.51Å; R71-F168 VanDerWaalsContact O-CA 3.29Å; R71-F168 WeakPolarHBondContact O-CA 3.42Å; R71-S169 PolarHBondContact N-O 2.84Å; R71-S169 PolarHBondContact O-N 2.77Å; R71-S169 PolarHBondContact O-OG 2.88Å; R71-C171 HydrophobicContact CB-CB 4.42Å
72	F	95.8	Very high	93.9	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.6	179.9	94	-84.3	0	0	0	112.6	I80 I82 I87 S94 F95 L97 H167 F168 F310	F72-I80 HydrophobicContact CE2-CD1 3.87Å; F72-I80 HydrophobicContact CZ-CD1 4.41Å; F72-I82 HydrophobicContact CD1-CD1 4.48Å; F72-I82 HydrophobicContact CE1-CD1 3.68Å; F72-I82 HydrophobicContact CE2-CD1 4.15Å; F72-I82 HydrophobicContact CZ-CD1 3.51Å; F72-I87 HydrophobicContact CE2-CG2 4.19Å; F72-I87 HydrophobicContact CZ-CG1 4.33Å; F72-I87 HydrophobicContact CZ-CG2 4.14Å; F72-S94 CarbonylContact O-C 3.55Å; F72-S94 WeakPolarHBondContact O-CA 3.45Å; F72-F95 HydrophobicContact CD1-CB 3.88Å; F72-F95 HydrophobicContact CD1-CD2 4.47Å; F72-F95 HydrophobicContact CE1-CB 3.51Å; F72-F95 AromaticContact CE1-CD2 3.77Å; F72-F95 HydrophobicContact CE1-CD2 3.77Å; F72-F95 AromaticContact CE1-CG 3.97Å; F72-F95 HydrophobicContact CE1-CG 3.97Å; F72-F95 HydrophobicContact CE2-CD2 4.28Å; F72-F95 HydrophobicContact CZ-CB 4.28Å; F72-F95 AromaticContact CZ-CD2 3.63Å; F72-F95 HydrophobicContact CZ-CD2 3.63Å; F72-F95 HydrophobicContact CZ-CE2 4.39Å; F72-F95 HydrophobicContact CZ-CG 4.26Å; F72-F95 PolarHBondContact N-O 3.42Å; F72-F95 PolarHBondContact O-N 3.27Å; F72-L97 HydrophobicContact CB-CD1 4.11Å; F72-L97 HydrophobicContact CD1-CD1 3.51Å; F72-L97 HydrophobicContact CD1-CD2 3.91Å; F72-L97 HydrophobicContact CD1-CG 3.61Å; F72-L97 HydrophobicContact CE1-CD1 4.19Å; F72-L97 HydrophobicContact CE1-CD2 3.87Å; F72-L97 HydrophobicContact CE1-CG 4.11Å; F72-L97 HydrophobicContact CG-CD1 4.06Å; F72-H167 CarbonylContact C-O 3.55Å; F72-H167 WeakPolarHBondContact CA-O 3.43Å; F72-H167 WeakPolarHBondContact CB-O 3.37Å; F72-F168 HydrophobicContact CB-CD1 3.7Å; F72-F168 HydrophobicContact CB-CD2 4.43Å; F72-F168 HydrophobicContact CB-CE1 3.56Å; F72-F168 HydrophobicContact CB-CE2 4.3Å; F72-F168 HydrophobicContact CB-CG 4.13Å; F72-F168 HydrophobicContact CB-CZ 3.86Å; F72-F168 HydrophobicContact CG-CE1 4.37Å; F72-F168 HydrophobicContact CG-CZ 4.44Å; F72-F310 HydrophobicContact CE1-CD2 4.03Å; F72-F310 AromaticContact CE1-CE2 3.82Å; F72-F310 HydrophobicContact CE1-CE2 3.82Å; F72-F310 HydrophobicContact CZ-CE2 4.17Å
73	T	95.8	Very high	94	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.012	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.1	174	-56.1	0	0	0	0	108.1	L75 P91 S94 H167	T73-L75 HydrophobicContact CG2-CD2 3.85Å; T73-P91 WeakPolarHBondContact CG2-O 3.45Å; T73-S94 PolarHBondContact OG1-OG 3.23Å; T73-H167 PolarHBondContact N-O 3.24Å; T73-H167 PolarHBondContact O-N 3.2Å
74	H	95.2	Very high	93.9	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.009	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	108.3	170.6	-171.6	-50.6	0	0	0	108.8	C76 G77 P78 I87 S89 N90 T164 L166	H74-C76 PolarHBondContact CE1-O 2.85Å; H74-G77 PolarHBondContact CE1-O 3.35Å; H74-P78 PolarHBondContact NE2-O 3.29Å; H74-I87 HydrophobicContact CB-CG2 4.31Å; H74-I87 PolarHBondContact CD2-O 3.2Å; H74-I87 VanDerWaalsContact CD2-O 3.28Å; H74-S89 WeakPolarHBondContact ND1-CA 3.36Å; H74-N90 CarbonylContact O-C 3.59Å; H74-N90 VanDerWaalsContact O-C 3.23Å; H74-N90 PolarHBondContact O-N 2.89Å; H74-T164 WeakPolarHBondContact NE2-CG2 3.15Å; H74-L166 HydrophobicContact CB-CD2 3.96Å
75	L	94.3	Very high	93.7	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-52.6	-172.6	-64.1	-179.3	0	0	0	111.7	F55 T73 S89 P91 T132 A135 L136 V165 H167	F55-L75 HydrophobicContact CD1-CD1 4.07Å; F55-L75 HydrophobicContact CE1-CD1 3.89Å; T73-L75 HydrophobicContact CG2-CD2 3.85Å; L75-S89 PolarHBondContact O-OG 2.99Å; L75-P91 HydrophobicContact CD2-CB 4.4Å; L75-P91 WeakPolarHBondContact O-CG 3.14Å; L75-T132 HydrophobicContact CB-CG2 4.1Å; L75-T132 PolarHBondContact O-OG1 2.96Å; L75-A135 HydrophobicContact CD2-CB 4.21Å; L75-L136 HydrophobicContact CD1-CD2 4.15Å; L75-V165 WeakPolarHBondContact CB-O 3.41Å; L75-V165 HydrophobicContact CD1-CG1 4.16Å; L75-V165 PolarHBondContact N-O 2.91Å; L75-H167 HydrophobicContact CD1-CB 3.93Å; L75-H167 HydrophobicContact CD2-CB 4.41Å; L75-H167 HydrophobicContact CG-CB 4.11Å
76	C	92.4	Very high	93.6	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.007	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	159.9	176.8	60	0	0	0	0	108.5	H74 S89 V165	H74-C76 PolarHBondContact CE1-O 2.85Å; C76-S89 WeakPolarHBondContact CA-OG 3.4Å; C76-V165 PolarHBondContact O-N 3.02Å; C76-V165 VanDerWaalsContact SG-CG2 3.58Å
77	G	90.5	Very high	93.4	Very high	5 Å²	5	12.1 Å²	12.1	5%	0.052	6%	0.058	C	C	.	.	S	Bend	trans	132.5	170.7	-175.4	0	0	0	0	0	114.5	H74 Y118	H74-G77 PolarHBondContact CE1-O 3.35Å; G77-Y118 WeakPolarHBondContact CA-OH 3.44Å; G77-Y118 PolarHBondContact N-OH 3.25Å
78	P	89.3	Confident	93.1	Very high	8 Å²	8	12.9 Å²	12.9	5%	0.052	7%	0.07	C	C	.	.	S	Bend	trans	-55.7	155.7	160.1	-23.5	34.6	0	0	0	111.6	H74 Q110 Y118 D162 T164	H74-P78 PolarHBondContact NE2-O 3.29Å; P78-Q110 HydrophobicContact CB-CG 3.95Å; P78-Q110 HydrophobicContact CG-CG 4.48Å; P78-Q110 VanDerWaalsContact CG-NE2 3.3Å; P78-Y118 HydrophobicContact CB-CE2 4.33Å; P78-Y118 WeakPolarHBondContact CD-OH 2.87Å; P78-Y118 HydrophobicContact CG-CE2 3.92Å; P78-Y118 VanDerWaalsContact N-CE2 3.29Å; P78-D162 HydrophobicContact CG-CB 4.22Å; P78-T164 WeakPolarHBondContact CD-OG1 3.46Å; P78-T164 PolarHBondContact O-OG1 3.48Å
79	T	90.7	Very high	92.8	Very high	8 Å²	8	15.6 Å²	15.6	5%	0.049	9%	0.089	C	C	.	.			trans	-59.5	146.7	175.3	-65.3	0	0	0	0	111.2	N86 C111 W116	T79-N86 HydrophobicContact CG2-CB 3.83Å; T79-C111 WeakPolarHBondContact O-CB 3.08Å; T79-C111 PolarHBondContact O-N 3Å; T79-W116 HydrophobicContact CG2-CD2 4.01Å; T79-W116 HydrophobicContact CG2-CE3 3.94Å; T79-W116 HydrophobicContact CG2-CH2 3.65Å; T79-W116 HydrophobicContact CG2-CZ2 3.67Å; T79-W116 HydrophobicContact CG2-CZ3 3.75Å; T79-W116 WeakPolarHBondContact OG1-CZ3 3.18Å
80	I	93.5	Very high	92.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	153.9	170.2	65.5	176.4	0	0	0	110.2	L58 F72 I82 N86 I87 I108 T109 T164 L166	L58-I80 HydrophobicContact CD2-CG2 4.24Å; F72-I80 HydrophobicContact CE2-CD1 3.87Å; F72-I80 HydrophobicContact CZ-CD1 4.41Å; I80-I82 HydrophobicContact CD1-CD1 3.88Å; I80-I82 HydrophobicContact CD1-CG1 4.09Å; I80-I82 HydrophobicContact CG1-CG1 4.41Å; I80-N86 CarbonylContact O-C 3.6Å; I80-N86 WeakPolarHBondContact O-CA 3.37Å; I80-I87 HydrophobicContact CD1-CB 4.48Å; I80-I87 HydrophobicContact CG1-CB 3.96Å; I80-I87 PolarHBondContact N-O 3.01Å; I80-I87 PolarHBondContact O-N 3.01Å; I80-I108 HydrophobicContact CB-CG2 4.1Å; I80-I108 HydrophobicContact CD1-CG2 3.86Å; I80-I108 HydrophobicContact CG1-CG2 4.47Å; I80-I108 HydrophobicContact CG2-CG2 4.36Å; I80-T109 CarbonylContact C-O 3.54Å; I80-T109 WeakPolarHBondContact CA-O 3.33Å; I80-T109 WeakPolarHBondContact CB-O 3.44Å; I80-T164 HydrophobicContact CG2-CG2 3.81Å; I80-L166 HydrophobicContact CD1-CD1 3.87Å; I80-L166 HydrophobicContact CD1-CD2 3.81Å; I80-L166 HydrophobicContact CG2-CD1 4.45Å; I80-L166 HydrophobicContact CG2-CD2 4.45Å
81	T	92.8	Very high	92.4	Very high	39 Å²	39	18.5 Å²	18.5	24%	0.239	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	133.2	167.4	-51.2	0	0	0	0	110	G85 N86 T109 C111	T81-G85 CarbonylContact C-O 3.55Å; T81-G85 WeakPolarHBondContact CA-O 3.27Å; T81-N86 PolarHBondContact OG1-OD1 3.33Å; T81-T109 PolarHBondContact N-O 3.47Å; T81-T109 PolarHBondContact O-N 3.41Å; T81-T109 VanDerWaalsContact O-N 3.08Å; T81-C111 PolarHBondContact OG1-SG 3.17Å
82	I	94.7	Very high	92.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	114.3	169.4	-49	-175.8	0	0	0	107.7	F72 I80 G84 G85 L97 I108 F310	F72-I82 HydrophobicContact CD1-CD1 4.48Å; F72-I82 HydrophobicContact CE1-CD1 3.68Å; F72-I82 HydrophobicContact CE2-CD1 4.15Å; F72-I82 HydrophobicContact CZ-CD1 3.51Å; I80-I82 HydrophobicContact CD1-CD1 3.88Å; I80-I82 HydrophobicContact CD1-CG1 4.09Å; I80-I82 HydrophobicContact CG1-CG1 4.41Å; I82-G84 VanDerWaalsContact C-N 3.29Å; I82-G84 PolarHBondContact O-N 2.99Å; I82-G84 VanDerWaalsContact O-N 3.16Å; I82-G85 PolarHBondContact N-O 2.64Å; I82-G85 PolarHBondContact O-N 3.24Å; I82-L97 HydrophobicContact CD1-CD2 4.32Å; I82-L97 HydrophobicContact CG2-CD2 4.42Å; I82-I108 HydrophobicContact CD1-CD1 4.1Å; I82-I108 HydrophobicContact CD1-CG1 3.91Å; I82-I108 HydrophobicContact CG1-CB 4.49Å; I82-I108 HydrophobicContact CG1-CG1 3.98Å; I82-I108 HydrophobicContact CG1-CG2 4.37Å; I82-F310 HydrophobicContact CB-CD1 4.27Å; I82-F310 HydrophobicContact CB-CE1 3.76Å; I82-F310 HydrophobicContact CB-CZ 3.97Å; I82-F310 HydrophobicContact CG2-CD1 3.82Å; I82-F310 HydrophobicContact CG2-CE1 3.85Å; I82-F310 HydrophobicContact CG2-CG 4.34Å; I82-F310 HydrophobicContact CG2-CZ 4.35Å; I82-F310 VanDerWaalsContact O-CE1 3.3Å; I82-F310 WeakPolarHBondContact O-CE1 3.31Å
83	W	92.1	Very high	91.9	Very high	16 Å²	16	20.5 Å²	20.5	6%	0.061	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	44	51.9	178.4	-154.3	-65.7	0	0	0	113.2	G85 L106 Y219 S260 N267	W83-G85 VanDerWaalsContact C-N 3.25Å; W83-G85 PolarHBondContact O-N 3.43Å; W83-L106 HydrophobicContact CD2-CD2 4.3Å; W83-L106 HydrophobicContact CE3-CD2 3.41Å; W83-L106 VanDerWaalsContact CE3-CD2 3.41Å; W83-L106 HydrophobicContact CZ3-CD2 3.87Å; W83-Y219 HydrophobicContact CD2-CG 4.22Å; W83-Y219 AromaticContact CE2-CD2 3.88Å; W83-Y219 AromaticContact CE2-CG 3.8Å; W83-Y219 HydrophobicContact CH2-CD2 4.37Å; W83-Y219 AromaticContact CZ2-CD2 3.7Å; W83-Y219 HydrophobicContact CZ2-CD2 3.7Å; W83-Y219 HydrophobicContact CZ2-CG 4.02Å; W83-Y219 AromaticContact NE1-CG 3.94Å; W83-S260 PolarHBondContact NE1-O 2.84Å; W83-S260 VanDerWaalsContact NE1-O 3.17Å; W83-N267 PolarHBondContact O-ND2 2.95Å
84	G	89.7	Confident	91.8	Very high	3 Å²	3	23 Å²	23	3%	0.031	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	-15.1	179.3	0	0	0	0	0	116.3	I82 F264 K268	I82-G84 VanDerWaalsContact C-N 3.29Å; I82-G84 PolarHBondContact O-N 2.99Å; I82-G84 VanDerWaalsContact O-N 3.16Å; G84-F264 VanDerWaalsContact CA-CD2 3.41Å; G84-K268 WeakPolarHBondContact O-CA 3.49Å; G84-K268 WeakPolarHBondContact O-CD 3.05Å
85	G	91.5	Very high	91.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125.3	174	0	0	0	0	0	110.9	T81 I82 W83	T81-G85 CarbonylContact C-O 3.55Å; T81-G85 WeakPolarHBondContact CA-O 3.27Å; I82-G85 PolarHBondContact N-O 2.64Å; I82-G85 PolarHBondContact O-N 3.24Å; W83-G85 VanDerWaalsContact C-N 3.25Å; W83-G85 PolarHBondContact O-N 3.43Å
86	N	91.9	Very high	91.8	Very high	17 Å²	17	27 Å²	27	9%	0.091	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.1	173.2	-68.2	-34.9	0	0	0	110.7	T79 I80 T81 W116 K268 T271 D272	T79-N86 HydrophobicContact CG2-CB 3.83Å; I80-N86 CarbonylContact O-C 3.6Å; I80-N86 WeakPolarHBondContact O-CA 3.37Å; T81-N86 PolarHBondContact OG1-OD1 3.33Å; N86-W116 HydrophobicContact CB-CH2 3.39Å; N86-W116 HydrophobicContact CB-CZ2 3.84Å; N86-W116 HydrophobicContact CB-CZ3 4.36Å; N86-K268 PolarHBondContact ND2-NZ 3.46Å; N86-T271 PolarHBondContact N-OG1 3.38Å; N86-T271 WeakPolarHBondContact O-CB 3.35Å; N86-T271 VanDerWaalsContact O-CG2 3.32Å; N86-T271 WeakPolarHBondContact O-CG2 3.36Å; N86-D272 VanDerWaalsContact CB-OD1 3.28Å; N86-D272 WeakPolarHBondContact CB-OD1 3.35Å; N86-D272 VanDerWaalsContact ND2-CG 3.3Å; N86-D272 PolarHBondContact ND2-OD1 2.77Å; N86-D272 VanDerWaalsContact ND2-OD1 3.09Å; N86-D272 PolarHBondContact ND2-OD2 2.98Å
87	I	92.3	Very high	91.9	Very high	12 Å²	12	27 Å²	27	6%	0.062	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.1	-173.8	-51.1	-60.9	0	0	0	109.1	F72 H74 I80 F95 T271 P308 F310	F72-I87 HydrophobicContact CE2-CG2 4.19Å; F72-I87 HydrophobicContact CZ-CG1 4.33Å; F72-I87 HydrophobicContact CZ-CG2 4.14Å; H74-I87 HydrophobicContact CB-CG2 4.31Å; H74-I87 PolarHBondContact CD2-O 3.2Å; H74-I87 VanDerWaalsContact CD2-O 3.28Å; I80-I87 HydrophobicContact CD1-CB 4.48Å; I80-I87 HydrophobicContact CG1-CB 3.96Å; I80-I87 PolarHBondContact N-O 3.01Å; I80-I87 PolarHBondContact O-N 3.01Å; I87-F95 HydrophobicContact CD1-CE2 4.43Å; I87-F95 HydrophobicContact CD1-CZ 4.3Å; I87-F95 HydrophobicContact CG2-CE2 3.92Å; I87-T271 HydrophobicContact CD1-CG2 3.77Å; I87-P308 HydrophobicContact CD1-CG 4.18Å; I87-F310 HydrophobicContact CD1-CE2 4.44Å; I87-F310 HydrophobicContact CD1-CZ 4.02Å; I87-F310 HydrophobicContact CG1-CE2 4.49Å; I87-F310 HydrophobicContact CG1-CZ 4.07Å
88	G	89.7	Confident	92.2	Very high	31 Å²	31	27.8 Å²	27.8	32%	0.32	17%	0.174	S	C	.	.			trans	-84.7	177.1	173.3	0	0	0	0	0	112.9	N90	G88-N90 PolarHBondContact O-N 3.26Å
89	S	89.7	Confident	92.5	Very high	56 Å²	56	27.7 Å²	27.7	39%	0.392	17%	0.173	S	C	.	.			trans	-61.3	117.7	177.8	-175.6	0	0	0	0	112.4	H74 L75 C76	H74-S89 WeakPolarHBondContact ND1-CA 3.36Å; L75-S89 PolarHBondContact O-OG 2.99Å; C76-S89 WeakPolarHBondContact CA-OG 3.4Å
90	N	91.4	Very high	92.5	Very high	70 Å²	70	27.5 Å²	27.5	37%	0.374	17%	0.172	S	C	.	.			trans	-155.1	90.1	170.2	-171.9	-18.1	0	0	0	109.9	H74 G88 S92 T93	H74-N90 CarbonylContact O-C 3.59Å; H74-N90 VanDerWaalsContact O-C 3.23Å; H74-N90 PolarHBondContact O-N 2.89Å; G88-N90 PolarHBondContact O-N 3.26Å; N90-S92 PolarHBondContact O-N 3.31Å; N90-S92 PolarHBondContact OD1-N 2.93Å; N90-S92 VanDerWaalsContact OD1-N 3.17Å; N90-S92 PolarHBondContact OD1-OG 3.37Å; N90-T93 PolarHBondContact ND2-OG1 3.11Å; N90-T93 VanDerWaalsContact ND2-OG1 3.15Å; N90-T93 PolarHBondContact O-N 3.06Å; N90-T93 VanDerWaalsContact O-N 3.09Å
91	P	91.4	Very high	92.4	Very high	13 Å²	13	29.4 Å²	29.4	8%	0.084	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.7	-178.6	-23.9	31.2	0	0	0	114.9	T73 L75 E131 A135	T73-P91 WeakPolarHBondContact CG2-O 3.45Å; L75-P91 HydrophobicContact CD2-CB 4.4Å; L75-P91 WeakPolarHBondContact O-CG 3.14Å; P91-E131 HydrophobicContact CG-CB 4.22Å; P91-A135 HydrophobicContact CB-CB 3.63Å
92	S	90.4	Very high	92.3	Very high	103 Å²	103	28.3 Å²	28.3	72%	0.72	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.4	-178.5	73.2	0	0	0	0	114	N90	N90-S92 PolarHBondContact O-N 3.31Å; N90-S92 PolarHBondContact OD1-N 2.93Å; N90-S92 VanDerWaalsContact OD1-N 3.17Å; N90-S92 PolarHBondContact OD1-OG 3.37Å
93	T	91.3	Very high	92	Very high	45 Å²	45	30.8 Å²	30.8	28%	0.276	19%	0.189	S	C	.	.			trans	-116.9	126.4	-173.7	-58.3	0	0	0	0	111	N90 F95	N90-T93 PolarHBondContact ND2-OG1 3.11Å; N90-T93 VanDerWaalsContact ND2-OG1 3.15Å; N90-T93 PolarHBondContact O-N 3.06Å; N90-T93 VanDerWaalsContact O-N 3.09Å; T93-F95 HydrophobicContact CG2-CE1 4.23Å; T93-F95 HydrophobicContact CG2-CE2 3.88Å; T93-F95 HydrophobicContact CG2-CZ 3.64Å
94	S	92.9	Very high	91.9	Very high	53 Å²	53	33 Å²	33	37%	0.371	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	149.3	176	-55.2	0	0	0	0	111.7	F72 T73	F72-S94 CarbonylContact O-C 3.55Å; F72-S94 WeakPolarHBondContact O-CA 3.45Å; T73-S94 PolarHBondContact OG1-OG 3.23Å
95	F	93.9	Very high	92	Very high	26 Å²	26	33.1 Å²	33.1	11%	0.114	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143	176.5	-53.5	-90.5	0	0	0	110.8	R71 F72 I87 T93 L307 P308 F310	R71-F95 CarbonylContact C-O 3.59Å; R71-F95 VanDerWaalsContact CA-O 3.31Å; R71-F95 WeakPolarHBondContact CA-O 3.37Å; F72-F95 HydrophobicContact CD1-CB 3.88Å; F72-F95 HydrophobicContact CD1-CD2 4.47Å; F72-F95 HydrophobicContact CE1-CB 3.51Å; F72-F95 AromaticContact CE1-CD2 3.77Å; F72-F95 HydrophobicContact CE1-CD2 3.77Å; F72-F95 AromaticContact CE1-CG 3.97Å; F72-F95 HydrophobicContact CE1-CG 3.97Å; F72-F95 HydrophobicContact CE2-CD2 4.28Å; F72-F95 HydrophobicContact CZ-CB 4.28Å; F72-F95 AromaticContact CZ-CD2 3.63Å; F72-F95 HydrophobicContact CZ-CD2 3.63Å; F72-F95 HydrophobicContact CZ-CE2 4.39Å; F72-F95 HydrophobicContact CZ-CG 4.26Å; F72-F95 PolarHBondContact N-O 3.42Å; F72-F95 PolarHBondContact O-N 3.27Å; I87-F95 HydrophobicContact CD1-CE2 4.43Å; I87-F95 HydrophobicContact CD1-CZ 4.3Å; I87-F95 HydrophobicContact CG2-CE2 3.92Å; T93-F95 HydrophobicContact CG2-CE1 4.23Å; T93-F95 HydrophobicContact CG2-CE2 3.88Å; T93-F95 HydrophobicContact CG2-CZ 3.64Å; F95-L307 HydrophobicContact CE1-CD2 4.3Å; F95-P308 HydrophobicContact CE1-CG 4.22Å; F95-F310 HydrophobicContact CB-CD2 4Å; F95-F310 HydrophobicContact CB-CE2 4.1Å; F95-F310 HydrophobicContact CD1-CE2 4.26Å; F95-F310 HydrophobicContact CG-CD2 4.46Å; F95-F310 HydrophobicContact CG-CE2 4.09Å
96	N	94.9	Very high	92.1	Very high	60 Å²	60	33.4 Å²	33.4	32%	0.321	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.1	170.7	-61.9	-33.9	0	0	0	109.2	R71 Y98	R71-N96 PolarHBondContact NE-OD1 3.11Å; R71-N96 VanDerWaalsContact NE-OD1 3.08Å; N96-Y98 HydrophobicContact CB-CD2 4.49Å; N96-Y98 HydrophobicContact CB-CE2 3.79Å
97	L	95.6	Very high	92.3	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122	174.2	-62.6	171.8	0	0	0	108.5	K69 A70 F72 I82 L106 F168 F310	K69-L97 WeakPolarHBondContact CA-O 3.37Å; A70-L97 PolarHBondContact N-O 2.96Å; A70-L97 PolarHBondContact O-N 3.43Å; F72-L97 HydrophobicContact CB-CD1 4.11Å; F72-L97 HydrophobicContact CD1-CD1 3.51Å; F72-L97 HydrophobicContact CD1-CD2 3.91Å; F72-L97 HydrophobicContact CD1-CG 3.61Å; F72-L97 HydrophobicContact CE1-CD1 4.19Å; F72-L97 HydrophobicContact CE1-CD2 3.87Å; F72-L97 HydrophobicContact CE1-CG 4.11Å; F72-L97 HydrophobicContact CG-CD1 4.06Å; I82-L97 HydrophobicContact CD1-CD2 4.32Å; I82-L97 HydrophobicContact CG2-CD2 4.42Å; L97-L106 HydrophobicContact CB-CD1 4.16Å; L97-L106 HydrophobicContact CD2-CD1 3.88Å; L97-F168 HydrophobicContact CD1-CD1 4.43Å; L97-F168 HydrophobicContact CD1-CE1 3.64Å; L97-F168 HydrophobicContact CD1-CZ 4.49Å; L97-F310 HydrophobicContact CD2-CB 3.4Å; L97-F310 HydrophobicContact CD2-CD2 3.57Å; L97-F310 HydrophobicContact CD2-CE2 4.47Å; L97-F310 HydrophobicContact CD2-CG 3.65Å
98	Y	96	Very high	92.4	Very high	23 Å²	23	32.9 Å²	32.9	9%	0.09	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	83.7	175.6	-60.4	-67.3	0	0	0	110	K69 N96 S100 L176 F310 G311 P312 T315	K69-Y98 HydrophobicContact CB-CD1 4.28Å; K69-Y98 HydrophobicContact CD-CD1 4.28Å; K69-Y98 HydrophobicContact CD-CE1 4.42Å; K69-Y98 HydrophobicContact CG-CD1 4.02Å; N96-Y98 HydrophobicContact CB-CD2 4.49Å; N96-Y98 HydrophobicContact CB-CE2 3.79Å; Y98-S100 PolarHBondContact O-N 3.38Å; Y98-L176 HydrophobicContact CD1-CD1 3.54Å; Y98-L176 HydrophobicContact CE1-CD1 3.52Å; Y98-L176 HydrophobicContact CG-CD1 4.26Å; Y98-F310 PolarHBondContact N-O 3.35Å; Y98-G311 WeakPolarHBondContact O-CA 3.49Å; Y98-P312 WeakPolarHBondContact O-CD 3.35Å; Y98-T315 HydrophobicContact CD2-CG2 4.02Å; Y98-T315 HydrophobicContact CG-CG2 3.89Å
99	S	95.4	Very high	92.6	Very high	5 Å²	5	32.9 Å²	32.9	4%	0.035	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	83.4	179.1	-164.2	0	0	0	0	110.3	V66 G68 P105 L106	V66-S99 WeakPolarHBondContact O-CB 3.47Å; V66-S99 PolarHBondContact O-OG 2.93Å; G68-S99 PolarHBondContact N-O 2.69Å; G68-S99 PolarHBondContact O-N 2.91Å; S99-P105 WeakPolarHBondContact OG-CA 3.47Å; S99-L106 PolarHBondContact OG-N 3.49Å; S99-L106 VanDerWaalsContact OG-N 3.07Å
100	S	92.2	Very high	92.5	Very high	4 Å²	4	30.4 Å²	30.4	3%	0.028	18%	0.181	C	C	.	.			trans	-83.4	154.4	179.7	77.1	0	0	0	0	112.3	Y98 S102 H103 L188 Y314	Y98-S100 PolarHBondContact O-N 3.38Å; S100-S102 PolarHBondContact O-N 2.61Å; S100-S102 VanDerWaalsContact O-N 3.15Å; S100-S102 PolarHBondContact OG-N 3.47Å; S100-S102 PolarHBondContact OG-OG 3.1Å; S100-H103 PolarHBondContact O-N 3.5Å; S100-H103 VanDerWaalsContact O-O 3.12Å; S100-L188 CarbonylContact C-O 3.55Å; S100-L188 WeakPolarHBondContact CA-O 3.24Å; S100-L188 VanDerWaalsContact CB-O 3.25Å; S100-L188 WeakPolarHBondContact CB-O 3.47Å; S100-Y314 WeakPolarHBondContact CB-OH 3.43Å; S100-Y314 PolarHBondContact OG-OH 2.78Å
101	T	90.8	Very high	91.8	Very high	41 Å²	41	27.7 Å²	27.7	25%	0.252	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-8.4	171.4	66	0	0	0	0	113.8	H103 F187 L188 H190 Y454	T101-H103 VanDerWaalsContact C-N 3.27Å; T101-H103 PolarHBondContact O-N 3.32Å; T101-F187 PolarHBondContact OG1-O 3.04Å; T101-F187 VanDerWaalsContact OG1-O 3.05Å; T101-L188 PolarHBondContact N-O 2.97Å; T101-L188 PolarHBondContact OG1-O 3.17Å; T101-H190 HydrophobicContact CG2-CB 4.14Å; T101-Y454 HydrophobicContact CG2-CD1 4.18Å; T101-Y454 HydrophobicContact CG2-CE1 4.13Å
102	S	89.6	Confident	90.8	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-16.6	179	67.3	0	0	0	0	113.6	S100 Y314	S100-S102 PolarHBondContact O-N 2.61Å; S100-S102 VanDerWaalsContact O-N 3.15Å; S100-S102 PolarHBondContact OG-N 3.47Å; S100-S102 PolarHBondContact OG-OG 3.1Å; S102-Y314 WeakPolarHBondContact OG-CE1 3.43Å; S102-Y314 PolarHBondContact OG-OH 2.93Å
103	H	89.9	Confident	89.3	Confident	51 Å²	51	29.9 Å²	29.9	24%	0.236	17%	0.171	C	C	.	.	S	Bend	trans	-139.4	173.2	-177.4	-67	74.2	0	0	0	109.3	S100 T101 P312 H461	S100-H103 PolarHBondContact O-N 3.5Å; S100-H103 VanDerWaalsContact O-O 3.12Å; T101-H103 VanDerWaalsContact C-N 3.27Å; T101-H103 PolarHBondContact O-N 3.32Å; H103-P312 WeakPolarHBondContact CE1-CB 3.41Å; H103-P312 VanDerWaalsContact ND1-CB 3.29Å; H103-P312 WeakPolarHBondContact ND1-CB 3.46Å; H103-H461 AromaticContact CE1-CE1 3.33Å; H103-H461 PolarHBondContact CE1-CE1 3.35Å; H103-H461 AromaticContact CE1-ND1 3.51Å; H103-H461 AromaticContact ND1-CE1 3.93Å; H103-H461 AromaticContact NE2-CE1 3.89Å
104	T	88.5	Confident	87.3	Confident	63 Å²	63	34.1 Å²	34.1	39%	0.387	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-55.2	135.7	172.8	-52.1	0	0	0	0	110.6	G218	T104-G218 WeakPolarHBondContact CG2-O 3.43Å
105	P	91.9	Very high	85.3	Confident	6 Å²	6	39.4 Å²	39.4	4%	0.039	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-61.8	146.6	178.3	24.9	-33.6	0	0	0	111.2	A65 Y67 S99 L217 G218	A65-P105 HydrophobicContact CB-CB 4.47Å; Y67-P105 HydrophobicContact CD1-CB 4.45Å; Y67-P105 HydrophobicContact CE1-CB 3.96Å; Y67-P105 HydrophobicContact CE1-CG 4.28Å; S99-P105 WeakPolarHBondContact OG-CA 3.47Å; P105-L217 HydrophobicContact CG-CD1 3.71Å; P105-L217 HydrophobicContact CG-CD2 4.4Å; P105-L217 HydrophobicContact CG-CG 3.96Å; P105-G218 WeakPolarHBondContact O-CA 3.48Å
106	L	94.9	Very high	83.3	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	135.2	170	-58	178.6	0	0	0	108.8	A65 V66 W83 L97 S99 F310	A65-L106 CarbonylContact C-O 3.53Å; A65-L106 WeakPolarHBondContact CA-O 3.4Å; V66-L106 PolarHBondContact N-O 3Å; W83-L106 HydrophobicContact CD2-CD2 4.3Å; W83-L106 HydrophobicContact CE3-CD2 3.41Å; W83-L106 VanDerWaalsContact CE3-CD2 3.41Å; W83-L106 HydrophobicContact CZ3-CD2 3.87Å; L97-L106 HydrophobicContact CB-CD1 4.16Å; L97-L106 HydrophobicContact CD2-CD1 3.88Å; S99-L106 PolarHBondContact OG-N 3.49Å; S99-L106 VanDerWaalsContact OG-N 3.07Å; L106-F310 HydrophobicContact CD1-CB 4.04Å; L106-F310 WeakPolarHBondContact CD1-O 3.49Å
107	S	94.7	Very high	81.3	Confident	16 Å²	16	49.9 Å²	49.9	11%	0.112	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.3	173.6	-178.8	0	0	0	0	110	L64 H213	L64-S107 CarbonylContact O-C 3.49Å; L64-S107 WeakPolarHBondContact O-CA 3.48Å; S107-H213 PolarHBondContact OG-CE1 3.39Å; S107-H213 PolarHBondContact OG-NE2 3.07Å
108	I	95.7	Very high	79.5	Confident	2 Å²	2	53 Å²	53	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.5	176.1	-55	-178.2	0	0	0	107.6	L58 H63 L64 V66 I80 I82 L166 F168	L58-I108 HydrophobicContact CD2-CG2 3.98Å; H63-I108 WeakPolarHBondContact CA-O 3.36Å; L64-I108 PolarHBondContact N-O 2.78Å; L64-I108 PolarHBondContact O-N 2.89Å; V66-I108 HydrophobicContact CG2-CD1 3.59Å; V66-I108 HydrophobicContact CG2-CG1 3.8Å; I80-I108 HydrophobicContact CB-CG2 4.1Å; I80-I108 HydrophobicContact CD1-CG2 3.86Å; I80-I108 HydrophobicContact CG1-CG2 4.47Å; I80-I108 HydrophobicContact CG2-CG2 4.36Å; I82-I108 HydrophobicContact CD1-CD1 4.1Å; I82-I108 HydrophobicContact CD1-CG1 3.91Å; I82-I108 HydrophobicContact CG1-CB 4.49Å; I82-I108 HydrophobicContact CG1-CG1 3.98Å; I82-I108 HydrophobicContact CG1-CG2 4.37Å; I108-L166 HydrophobicContact CG2-CD1 4.1Å; I108-F168 HydrophobicContact CD1-CE1 4.08Å; I108-F168 HydrophobicContact CD1-CZ 3.5Å; I108-F168 VanDerWaalsContact CD1-CZ 3.5Å
109	T	92.5	Very high	77.9	Confident	32 Å²	32	58.3 Å²	58.3	20%	0.196	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.9	177.2	-55.9	0	0	0	0	109.3	T62 H63 I80 T81	T62-T109 WeakPolarHBondContact O-CA 3.33Å; H63-T109 VanDerWaalsContact CE1-CG2 3.42Å; H63-T109 WeakPolarHBondContact CE1-CG2 3.24Å; H63-T109 VanDerWaalsContact ND1-CG2 3.27Å; H63-T109 WeakPolarHBondContact ND1-CG2 3.23Å; H63-T109 PolarHBondContact ND1-OG1 2.62Å; I80-T109 CarbonylContact C-O 3.54Å; I80-T109 WeakPolarHBondContact CA-O 3.33Å; I80-T109 WeakPolarHBondContact CB-O 3.44Å; T81-T109 PolarHBondContact N-O 3.47Å; T81-T109 PolarHBondContact O-N 3.41Å; T81-T109 VanDerWaalsContact O-N 3.08Å
110	Q	88.4	Confident	76.4	Confident	3 Å²	3	60.5 Å²	60.5	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131	169.8	-168.4	-172.5	49.5	0	0	109.5	L58 G59 P78 D162 T164	L58-Q110 HydrophobicContact CD2-CB 3.95Å; L58-Q110 HydrophobicContact CG-CB 4.15Å; L58-Q110 PolarHBondContact O-NE2 3.15Å; L58-Q110 VanDerWaalsContact O-NE2 3.09Å; G59-Q110 PolarHBondContact O-OE1 2.63Å; P78-Q110 HydrophobicContact CB-CG 3.95Å; P78-Q110 HydrophobicContact CG-CG 4.48Å; P78-Q110 VanDerWaalsContact CG-NE2 3.3Å; Q110-D162 PolarHBondContact NE2-O 3.09Å; Q110-T164 WeakPolarHBondContact CG-OG1 3.44Å; Q110-T164 PolarHBondContact NE2-OG1 3.04Å
111	C	77.6	Confident	75.4	Confident	13 Å²	13	69.2 Å²	69.2	9%	0.088	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-72	148.4	175.7	-59	0	0	0	0	110.9	T79 T81	T79-C111 WeakPolarHBondContact O-CB 3.08Å; T79-C111 PolarHBondContact O-N 3Å; T81-C111 PolarHBondContact OG1-SG 3.17Å
112	P	69.5	Low	75	Confident	66 Å²	66	69.8 Å²	69.8	43%	0.429	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.1	171.9	-22.1	32.3	0	0	0	112.8	H60 V114	H60-P112 VanDerWaalsContact NE2-CA 3.3Å; H60-P112 WeakPolarHBondContact NE2-CA 3.41Å; H60-P112 WeakPolarHBondContact NE2-CB 3.32Å; P112-V114 PolarHBondContact O-N 3.02Å
113	H	58.9	Low	74.7	Confident	96 Å²	96	69.1 Å²	69.1	44%	0.444	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-55.8	-16.1	-173.8	-120.9	-70	0	0	0	115.6	E115 D162	H113-E115 PolarHBondContact O-N 3.05Å; H113-D162 IonicContact CE1-OD2 3.9Å; H113-D162 PolarHBondContact CE1-OD2 3.04Å; H113-D162 VanDerWaalsContact NE2-CB 3.33Å; H113-D162 WeakPolarHBondContact NE2-CB 3Å; H113-D162 IonicContact NE2-OD2 3.45Å; H113-D162 PolarHBondContact NE2-OD2 3.44Å
114	V	50.3	Low	74.6	Confident	134 Å²	134	68.5 Å²	68.5	81%	0.812	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-81.1	-8.7	-158.8	-168.9	0	0	0	0	113.9	P112	P112-V114 PolarHBondContact O-N 3.02Å
115	E	50.2	Low	74.4	Confident	165 Å²	165	69.6 Å²	69.6	77%	0.771	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-122.1	9.2	-169	-71.9	-171.1	158	0	0	117.2	H113	H113-E115 PolarHBondContact O-N 3.05Å
116	W	52	Low	74.2	Confident	94 Å²	94	69.4 Å²	69.4	36%	0.356	35%	0.345	S	S	.	.			trans	-133.8	133.8	-165.4	-59.2	82.6	0	0	0	115.4	T79 N86 Y118	T79-W116 HydrophobicContact CG2-CD2 4.01Å; T79-W116 HydrophobicContact CG2-CE3 3.94Å; T79-W116 HydrophobicContact CG2-CH2 3.65Å; T79-W116 HydrophobicContact CG2-CZ2 3.67Å; T79-W116 HydrophobicContact CG2-CZ3 3.75Å; T79-W116 WeakPolarHBondContact OG1-CZ3 3.18Å; N86-W116 HydrophobicContact CB-CH2 3.39Å; N86-W116 HydrophobicContact CB-CZ2 3.84Å; N86-W116 HydrophobicContact CB-CZ3 4.36Å; W116-Y118 PolarHBondContact O-N 3.06Å; W116-Y118 VanDerWaalsContact O-N 3.11Å
117	K	51.7	Low	73.9	Confident	211 Å²	211	69.2 Å²	69.2	92%	0.917	34%	0.344	S	S	*	.			trans	-76.8	91.7	174.2	-73.1	-178.7	180	174.8	0	109.9	V119	K117-V119 PolarHBondContact O-N 3.19Å
118	Y	58.7	Low	73.7	Confident	67 Å²	67	74.5 Å²	74.5	26%	0.263	37%	0.367	S	S	.	.			trans	-67.2	129.7	169.8	-124.6	-85.1	0	0	0	110.4	G77 P78 W116 H120 T123	G77-Y118 WeakPolarHBondContact CA-OH 3.44Å; G77-Y118 PolarHBondContact N-OH 3.25Å; P78-Y118 HydrophobicContact CB-CE2 4.33Å; P78-Y118 WeakPolarHBondContact CD-OH 2.87Å; P78-Y118 HydrophobicContact CG-CE2 3.92Å; P78-Y118 VanDerWaalsContact N-CE2 3.29Å; W116-Y118 PolarHBondContact O-N 3.06Å; W116-Y118 VanDerWaalsContact O-N 3.11Å; Y118-H120 VanDerWaalsContact C-N 3.3Å; Y118-H120 WeakPolarHBondContact CB-O 3.47Å; Y118-H120 HydrophobicContact CD1-CB 4.11Å; Y118-H120 WeakPolarHBondContact CD1-O 3.36Å; Y118-H120 HydrophobicContact CE1-CB 4.35Å; Y118-T123 PolarHBondContact OH-OG1 3.31Å
119	V	63.3	Low	73.5	Confident	134 Å²	134	75.1 Å²	75.1	81%	0.812	37%	0.372	S	S	*	.	S	Bend	trans	-72.5	-30.8	171.5	-179.8	0	0	0	0	110.6	K117	K117-V119 PolarHBondContact O-N 3.19Å
120	H	63.5	Low	73.4	Confident	52 Å²	52	78 Å²	78	24%	0.241	39%	0.393	C	S	.	.	S	Bend	trans	-106.9	154.2	-178.1	-57.9	-61.5	0	0	0	112.1	Y118 N122 Q125 G126	Y118-H120 VanDerWaalsContact C-N 3.3Å; Y118-H120 WeakPolarHBondContact CB-O 3.47Å; Y118-H120 HydrophobicContact CD1-CB 4.11Å; Y118-H120 WeakPolarHBondContact CD1-O 3.36Å; Y118-H120 HydrophobicContact CE1-CB 4.35Å; H120-N122 VanDerWaalsContact C-N 3.32Å; H120-N122 PolarHBondContact O-N 2.78Å; H120-Q125 HydrophobicContact CB-CB 4.34Å; H120-G126 VanDerWaalsContact CD2-CA 3.44Å; H120-G126 WeakPolarHBondContact CD2-CA 3.32Å
121	K	70	Confident	73.5	Confident	186 Å²	186	83.9 Å²	83.9	81%	0.809	42%	0.42	S	S	*	.	S	Bend	trans	-72.4	-26.7	-179.7	-69.6	-175.1	175.4	-178.4	0	113.5
122	N	83.2	Confident	74.1	Confident	54 Å²	54	83.3 Å²	83.3	29%	0.289	42%	0.417	S	S	.	.	S	Bend	trans	-157	172.2	178.7	62.4	25.3	0	0	0	110.8	H120 T124 Q125 G126	H120-N122 VanDerWaalsContact C-N 3.32Å; H120-N122 PolarHBondContact O-N 2.78Å; N122-T124 PolarHBondContact O-N 3.41Å; N122-T124 PolarHBondContact OD1-N 3.5Å; N122-T124 PolarHBondContact OD1-OG1 3.08Å; N122-Q125 PolarHBondContact O-N 3.28Å; N122-Q125 WeakPolarHBondContact OD1-CB 3.37Å; N122-Q125 VanDerWaalsContact OD1-CG 3.31Å; N122-Q125 WeakPolarHBondContact OD1-CG 3.03Å; N122-Q125 PolarHBondContact OD1-N 2.8Å; N122-G126 PolarHBondContact O-N 2.8Å
123	T	83.4	Confident	75.2	Confident	1 Å²	1	84.8 Å²	84.8	1%	0.006	42%	0.416	C	S	.	.	H	α-helix	trans	-63.6	-38.4	-178.1	-53.2	0	0	0	0	113.6	Y118 Q125 G126 L127 I156 D162 V163 V165	Y118-T123 PolarHBondContact OH-OG1 3.31Å; T123-Q125 PolarHBondContact O-N 2.86Å; T123-G126 PolarHBondContact O-N 3.34Å; T123-L127 PolarHBondContact O-N 2.87Å; T123-I156 HydrophobicContact CG2-CD1 4.12Å; T123-D162 PolarHBondContact N-OD1 3.33Å; T123-D162 PolarHBondContact OG1-OD1 3.27Å; T123-V163 HydrophobicContact CG2-CG2 4.1Å; T123-V163 WeakPolarHBondContact CG2-O 3.49Å; T123-V163 PolarHBondContact OG1-O 2.85Å; T123-V165 HydrophobicContact CG2-CG2 3.68Å
124	T	87.1	Confident	76.8	Confident	38 Å²	38	84.1 Å²	84.1	23%	0.233	42%	0.419	C	S	.	.	H	α-helix	trans	-66.5	-38.8	-178.9	48.3	0	0	0	0	112.4	N122 L127 Q128 I153 I156	N122-T124 PolarHBondContact O-N 3.41Å; N122-T124 PolarHBondContact OD1-N 3.5Å; N122-T124 PolarHBondContact OD1-OG1 3.08Å; T124-L127 PolarHBondContact O-N 3.09Å; T124-Q128 WeakPolarHBondContact O-CG 3.16Å; T124-Q128 PolarHBondContact O-N 3.33Å; T124-Q128 VanDerWaalsContact O-N 3.15Å; T124-I153 HydrophobicContact CG2-CG2 4.21Å; T124-I156 HydrophobicContact CG2-CB 4.43Å; T124-I156 HydrophobicContact CG2-CG2 3.79Å
125	Q	85.9	Confident	78.8	Confident	87 Å²	87	78.2 Å²	78.2	41%	0.407	38%	0.384	S	S	.	.	H	α-helix	trans	-63.8	-41.2	171.1	-77.1	-174.8	-8.1	0	0	112	H120 N122 T123 L127 Q128 S129	H120-Q125 HydrophobicContact CB-CB 4.34Å; N122-Q125 PolarHBondContact O-N 3.28Å; N122-Q125 WeakPolarHBondContact OD1-CB 3.37Å; N122-Q125 VanDerWaalsContact OD1-CG 3.31Å; N122-Q125 WeakPolarHBondContact OD1-CG 3.03Å; N122-Q125 PolarHBondContact OD1-N 2.8Å; T123-Q125 PolarHBondContact O-N 2.86Å; Q125-L127 VanDerWaalsContact C-N 3.28Å; Q125-L127 PolarHBondContact O-N 3.42Å; Q125-Q128 CarbonylContact O-C 3.53Å; Q125-Q128 PolarHBondContact O-N 2.88Å; Q125-S129 PolarHBondContact O-N 3.35Å; Q125-S129 VanDerWaalsContact O-N 3.14Å
126	G	86.5	Confident	80.8	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-35.2	176.4	0	0	0	0	0	112.8	H120 N122 T123 Q128 S129 T132	H120-G126 VanDerWaalsContact CD2-CA 3.44Å; H120-G126 WeakPolarHBondContact CD2-CA 3.32Å; N122-G126 PolarHBondContact O-N 2.8Å; T123-G126 PolarHBondContact O-N 3.34Å; G126-Q128 VanDerWaalsContact C-N 3.33Å; G126-S129 WeakPolarHBondContact O-CB 3.44Å; G126-S129 PolarHBondContact O-N 3.1Å; G126-S129 PolarHBondContact O-OG 2.64Å; G126-S129 VanDerWaalsContact O-OG 3.06Å; G126-T132 WeakPolarHBondContact O-CB 3.18Å; G126-T132 PolarHBondContact O-OG1 2.75Å
127	L	88.9	Confident	82.7	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-69.4	-32.6	175.8	-164.8	75.9	0	0	0	112.4	T123 T124 Q125 S129 T132 T149 L152 I153 I156 V165	T123-L127 PolarHBondContact O-N 2.87Å; T124-L127 PolarHBondContact O-N 3.09Å; Q125-L127 VanDerWaalsContact C-N 3.28Å; Q125-L127 PolarHBondContact O-N 3.42Å; L127-S129 VanDerWaalsContact C-N 3.3Å; L127-T132 HydrophobicContact CD1-CG2 3.99Å; L127-T149 HydrophobicContact CD2-CG2 4.16Å; L127-T149 HydrophobicContact CG-CG2 4.43Å; L127-L152 HydrophobicContact CD1-CD1 4.22Å; L127-L152 HydrophobicContact CD2-CB 3.56Å; L127-L152 HydrophobicContact CD2-CD1 4.31Å; L127-I153 HydrophobicContact CD2-CG1 3.84Å; L127-I156 HydrophobicContact CD2-CD1 4.05Å; L127-V165 HydrophobicContact CD1-CG1 4.24Å
128	Q	90.1	Very high	84.5	Confident	128 Å²	128	63.2 Å²	63.2	60%	0.598	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	1.7	176.9	-68.2	-177.8	-19.8	0	0	113.7	T124 Q125 G126 I153	T124-Q128 WeakPolarHBondContact O-CG 3.16Å; T124-Q128 PolarHBondContact O-N 3.33Å; T124-Q128 VanDerWaalsContact O-N 3.15Å; Q125-Q128 CarbonylContact O-C 3.53Å; Q125-Q128 PolarHBondContact O-N 2.88Å; G126-Q128 VanDerWaalsContact C-N 3.33Å; Q128-I153 HydrophobicContact CG-CD1 4.07Å
129	S	91	Very high	85.7	Confident	15 Å²	15	62 Å²	62	11%	0.105	33%	0.325	C	S	.	.	S	Bend	trans	-63	151.5	176.5	82	0	0	0	0	110.8	Q125 G126 L127 E131 T132 K133	Q125-S129 PolarHBondContact O-N 3.35Å; Q125-S129 VanDerWaalsContact O-N 3.14Å; G126-S129 WeakPolarHBondContact O-CB 3.44Å; G126-S129 PolarHBondContact O-N 3.1Å; G126-S129 PolarHBondContact O-OG 2.64Å; G126-S129 VanDerWaalsContact O-OG 3.06Å; L127-S129 VanDerWaalsContact C-N 3.3Å; S129-E131 PolarHBondContact O-N 2.76Å; S129-T132 PolarHBondContact O-N 2.86Å; S129-T132 WeakPolarHBondContact OG-CB 3.43Å; S129-T132 PolarHBondContact OG-N 3.44Å; S129-T132 VanDerWaalsContact OG-N 3.13Å; S129-T132 PolarHBondContact OG-OG1 2.8Å; S129-K133 WeakPolarHBondContact O-CB 3.3Å; S129-K133 PolarHBondContact O-N 2.86Å
130	S	90.7	Very high	86.8	Confident	93 Å²	93	55.7 Å²	55.7	65%	0.65	29%	0.287	S	S	*	.	H	α-helix	trans	-57.7	-39.7	176.9	49.1	0	0	0	0	111.9	K133 V134	S130-K133 PolarHBondContact O-N 2.95Å; S130-V134 VanDerWaalsContact O-CG2 3.28Å; S130-V134 WeakPolarHBondContact O-CG2 3.35Å; S130-V134 PolarHBondContact O-N 3.2Å
131	E	91.4	Very high	87.9	Confident	125 Å²	125	54 Å²	54	58%	0.584	28%	0.279	S	S	*	.	H	α-helix	trans	-64.3	-47.2	179.7	-66.1	165.1	-175.6	0	0	111.8	P91 S129 K133 V134 A135	P91-E131 HydrophobicContact CG-CB 4.22Å; S129-E131 PolarHBondContact O-N 2.76Å; E131-K133 VanDerWaalsContact C-N 3.34Å; E131-V134 PolarHBondContact O-N 3.16Å; E131-A135 PolarHBondContact O-N 2.7Å
132	T	90.9	Very high	88.7	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-38.5	178.1	-54.4	0	0	0	0	111.2	L75 G126 L127 S129 A135 L136	L75-T132 HydrophobicContact CB-CG2 4.1Å; L75-T132 PolarHBondContact O-OG1 2.96Å; G126-T132 WeakPolarHBondContact O-CB 3.18Å; G126-T132 PolarHBondContact O-OG1 2.75Å; L127-T132 HydrophobicContact CD1-CG2 3.99Å; S129-T132 PolarHBondContact O-N 2.86Å; S129-T132 WeakPolarHBondContact OG-CB 3.43Å; S129-T132 PolarHBondContact OG-N 3.44Å; S129-T132 VanDerWaalsContact OG-N 3.13Å; S129-T132 PolarHBondContact OG-OG1 2.8Å; T132-A135 WeakPolarHBondContact O-CB 3.29Å; T132-A135 PolarHBondContact O-N 2.81Å; T132-L136 HydrophobicContact CG2-CD1 4.42Å; T132-L136 WeakPolarHBondContact O-CG 3.39Å; T132-L136 PolarHBondContact O-N 2.81Å
133	K	91.9	Very high	89	Confident	97 Å²	97	53.4 Å²	53.4	42%	0.422	29%	0.292	S	S	.	.	H	α-helix	trans	-61	-47	175	-172.9	177.7	177.8	179.9	0	111.7	S129 S130 E131 A135 L136 E137	S129-K133 WeakPolarHBondContact O-CB 3.3Å; S129-K133 PolarHBondContact O-N 2.86Å; S130-K133 PolarHBondContact O-N 2.95Å; E131-K133 VanDerWaalsContact C-N 3.34Å; K133-A135 VanDerWaalsContact C-N 3.31Å; K133-A135 PolarHBondContact O-N 2.73Å; K133-L136 PolarHBondContact O-N 2.78Å; K133-E137 VanDerWaalsContact CE-OE1 3.23Å; K133-E137 WeakPolarHBondContact CE-OE1 3.5Å; K133-E137 WeakPolarHBondContact O-CG 3.21Å; K133-E137 PolarHBondContact O-N 2.88Å
134	V	92.9	Very high	89.3	Confident	83 Å²	83	53.6 Å²	53.6	50%	0.503	29%	0.293	S	S	.	.	H	α-helix	trans	-61.2	-40.5	175.9	169.8	0	0	0	0	111.1	S130 E131 E137 T138	S130-V134 VanDerWaalsContact O-CG2 3.28Å; S130-V134 WeakPolarHBondContact O-CG2 3.35Å; S130-V134 PolarHBondContact O-N 3.2Å; E131-V134 PolarHBondContact O-N 3.16Å; V134-E137 PolarHBondContact O-N 3.26Å; V134-T138 PolarHBondContact O-N 2.9Å; V134-T138 PolarHBondContact O-OG1 2.88Å
135	A	92.1	Very high	89.5	Confident	9 Å²	9	52.1 Å²	52.1	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-48.2	174.3	0	0	0	0	0	111.1	L75 P91 E131 T132 K133 E137 T138 L139	L75-A135 HydrophobicContact CD2-CB 4.21Å; P91-A135 HydrophobicContact CB-CB 3.63Å; E131-A135 PolarHBondContact O-N 2.7Å; T132-A135 WeakPolarHBondContact O-CB 3.29Å; T132-A135 PolarHBondContact O-N 2.81Å; K133-A135 VanDerWaalsContact C-N 3.31Å; K133-A135 PolarHBondContact O-N 2.73Å; A135-E137 VanDerWaalsContact C-N 3.35Å; A135-E137 PolarHBondContact O-N 2.87Å; A135-T138 WeakPolarHBondContact O-CB 3.12Å; A135-T138 PolarHBondContact O-N 2.82Å; A135-T138 VanDerWaalsContact O-N 3.08Å; A135-L139 WeakPolarHBondContact O-CB 3.37Å; A135-L139 WeakPolarHBondContact O-CD1 3.27Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 2.84Å
136	L	91.9	Very high	89.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-40.2	177	-69.6	174.5	0	0	0	112.7	F55 L75 T132 K133 T138 L139 C140 V145 L148	F55-L136 HydrophobicContact CE1-CD2 3.65Å; F55-L136 HydrophobicContact CZ-CD2 3.93Å; L75-L136 HydrophobicContact CD1-CD2 4.15Å; T132-L136 HydrophobicContact CG2-CD1 4.42Å; T132-L136 WeakPolarHBondContact O-CG 3.39Å; T132-L136 PolarHBondContact O-N 2.81Å; K133-L136 PolarHBondContact O-N 2.78Å; L136-T138 PolarHBondContact O-N 2.9Å; L136-L139 PolarHBondContact O-N 2.84Å; L136-C140 WeakPolarHBondContact O-CB 3.42Å; L136-C140 PolarHBondContact O-N 2.84Å; L136-V145 HydrophobicContact CB-CG1 4.09Å; L136-L148 HydrophobicContact CD2-CD2 4.31Å
137	E	91.7	Very high	89.9	Confident	68 Å²	68	56.1 Å²	56.1	32%	0.318	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-28.1	174.9	-71.9	171.8	177.7	0	0	112.9	K133 V134 A135 L142 V145	K133-E137 VanDerWaalsContact CE-OE1 3.23Å; K133-E137 WeakPolarHBondContact CE-OE1 3.5Å; K133-E137 WeakPolarHBondContact O-CG 3.21Å; K133-E137 PolarHBondContact O-N 2.88Å; V134-E137 PolarHBondContact O-N 3.26Å; A135-E137 VanDerWaalsContact C-N 3.35Å; A135-E137 PolarHBondContact O-N 2.87Å; E137-L142 HydrophobicContact CB-CD2 4.26Å; E137-L142 HydrophobicContact CG-CD2 4.15Å; E137-V145 HydrophobicContact CG-CG1 4.07Å; E137-V145 HydrophobicContact CG-CG2 4.02Å
138	T	88.5	Confident	90	Very high	87 Å²	87	56.1 Å²	56.1	53%	0.534	30%	0.301	S	S	.	.	H	α-helix	trans	-81.1	-32.8	176.4	-48.3	0	0	0	0	111.9	V134 A135 L136	V134-T138 PolarHBondContact O-N 2.9Å; V134-T138 PolarHBondContact O-OG1 2.88Å; A135-T138 WeakPolarHBondContact O-CB 3.12Å; A135-T138 PolarHBondContact O-N 2.82Å; A135-T138 VanDerWaalsContact O-N 3.08Å; L136-T138 PolarHBondContact O-N 2.9Å
139	L	85.1	Confident	90.2	Very high	42 Å²	42	50.6 Å²	50.6	22%	0.22	28%	0.277	C	S	.	.	H	α-helix	trans	-89.6	-29.5	-172.8	-66	170.9	0	0	0	113.6	A135 L136 H167	A135-L139 WeakPolarHBondContact O-CB 3.37Å; A135-L139 WeakPolarHBondContact O-CD1 3.27Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 2.84Å; L136-L139 PolarHBondContact O-N 2.84Å; L139-H167 HydrophobicContact CD1-CB 4.44Å
140	C	86	Confident	90.2	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.007	29%	0.292	C	S	.	.	S	Bend	trans	-120.8	169.1	-171.1	-64.1	0	0	0	0	112.3	Y45 L136 L142 V145 L148	Y45-C140 HydrophobicContact CD1-CB 4.32Å; Y45-C140 HydrophobicContact CE1-CB 3.66Å; L136-C140 WeakPolarHBondContact O-CB 3.42Å; L136-C140 PolarHBondContact O-N 2.84Å; C140-L142 PolarHBondContact O-N 3.01Å; C140-V145 HydrophobicContact CB-CG2 4.48Å; C140-L148 HydrophobicContact CB-CD2 4.28Å; C140-L148 WeakPolarHBondContact SG-CD2 3.32Å
141	D	86.9	Confident	90.3	Very high	16 Å²	16	53 Å²	53	9%	0.086	28%	0.275	C	S	.	.			trans	-66.8	128.7	171.6	-67	-29.8	0	0	0	108.6	Y45 P47 S48 R49 R50 S143 D144 V145	Y45-D141 WeakPolarHBondContact OH-CB 3.26Å; Y45-D141 PolarHBondContact OH-N 2.78Å; P47-D141 WeakPolarHBondContact CB-OD2 3.4Å; S48-D141 PolarHBondContact N-OD2 2.79Å; R49-D141 PolarHBondContact N-OD2 3.41Å; R50-D141 VanDerWaalsContact CG-OD1 3.27Å; R50-D141 WeakPolarHBondContact CG-OD1 3.4Å; D141-S143 PolarHBondContact O-N 2.78Å; D141-D144 PolarHBondContact O-N 3.03Å; D141-V145 PolarHBondContact O-N 2.93Å
142	L	87.6	Confident	90.5	Very high	131 Å²	131	47.1 Å²	47.1	69%	0.686	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-50.2	-36	-177.7	-84.2	149.9	0	0	0	113.3	E137 C140 D144	E137-L142 HydrophobicContact CB-CD2 4.26Å; E137-L142 HydrophobicContact CG-CD2 4.15Å; C140-L142 PolarHBondContact O-N 3.01Å; L142-D144 PolarHBondContact O-N 3.42Å
143	S	88.2	Confident	90.6	Very high	97 Å²	97	48.9 Å²	48.9	68%	0.678	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-65.5	-22.4	178	60.4	0	0	0	0	114.1	D141	D141-S143 PolarHBondContact O-N 2.78Å
144	D	89.8	Confident	90.7	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.032	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-104.1	-10.8	-172.1	-61.2	-8.6	0	0	0	112.2	K29 Y45 D141 L142 Q146 F147 L148	K29-D144 WeakPolarHBondContact CD-OD2 3.35Å; K29-D144 IonicContact NZ-OD1 3.42Å; K29-D144 PolarHBondContact NZ-OD1 3.23Å; K29-D144 IonicContact NZ-OD2 3.23Å; K29-D144 PolarHBondContact NZ-OD2 3.18Å; Y45-D144 HydrophobicContact CE2-CB 4.09Å; Y45-D144 WeakPolarHBondContact CE2-OD2 3.35Å; Y45-D144 WeakPolarHBondContact OH-CB 3.21Å; Y45-D144 PolarHBondContact OH-OD2 3.06Å; D141-D144 PolarHBondContact O-N 3.03Å; L142-D144 PolarHBondContact O-N 3.42Å; D144-Q146 PolarHBondContact O-N 3.16Å; D144-F147 PolarHBondContact O-N 2.9Å; D144-L148 VanDerWaalsContact O-CB 3.3Å; D144-L148 WeakPolarHBondContact O-CB 3.49Å; D144-L148 PolarHBondContact O-N 2.63Å
145	V	90.5	Very high	90.7	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-57	-48.5	-174.1	173.6	0	0	0	0	112.2	L136 E137 C140 D141 L148 T149	L136-V145 HydrophobicContact CB-CG1 4.09Å; E137-V145 HydrophobicContact CG-CG1 4.07Å; E137-V145 HydrophobicContact CG-CG2 4.02Å; C140-V145 HydrophobicContact CB-CG2 4.48Å; D141-V145 PolarHBondContact O-N 2.93Å; V145-L148 PolarHBondContact O-N 2.87Å; V145-T149 WeakPolarHBondContact O-CB 3.32Å; V145-T149 PolarHBondContact O-N 3.22Å; V145-T149 PolarHBondContact O-OG1 2.99Å
146	Q	91.1	Very high	90.8	Very high	110 Å²	110	47.7 Å²	47.7	51%	0.514	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-48.2	-179.7	-174.7	60.2	46.6	0	0	110.8	D144 L148 T149 D150	D144-Q146 PolarHBondContact O-N 3.16Å; Q146-L148 VanDerWaalsContact C-N 3.33Å; Q146-L148 PolarHBondContact O-N 3.47Å; Q146-T149 PolarHBondContact O-N 2.98Å; Q146-D150 PolarHBondContact NE2-OD1 3.48Å; Q146-D150 PolarHBondContact NE2-OD2 3.15Å; Q146-D150 VanDerWaalsContact O-CG 3.23Å; Q146-D150 PolarHBondContact O-N 3.22Å
147	F	90.6	Very high	90.7	Very high	62 Å²	62	52 Å²	52	27%	0.272	27%	0.274	S	S	.	.	H	α-helix	trans	-58.2	-44.1	177.5	162.6	-106.5	0	0	0	112.4	N26 L30 D144 R151	N26-F147 HydrophobicContact CB-CD1 4.41Å; N26-F147 HydrophobicContact CB-CD2 4.41Å; N26-F147 HydrophobicContact CB-CE1 3.9Å; N26-F147 HydrophobicContact CB-CE2 3.92Å; N26-F147 HydrophobicContact CB-CZ 3.65Å; L30-F147 HydrophobicContact CD1-CD1 4.33Å; L30-F147 HydrophobicContact CD1-CE1 3.31Å; L30-F147 HydrophobicContact CD1-CZ 3.45Å; L30-F147 VanDerWaalsContact CD1-CZ 3.45Å; L30-F147 HydrophobicContact CG-CE1 3.84Å; L30-F147 HydrophobicContact CG-CZ 4.21Å; D144-F147 PolarHBondContact O-N 2.9Å; F147-R151 WeakPolarHBondContact O-CB 3.49Å; F147-R151 PolarHBondContact O-N 2.76Å
148	L	91.3	Very high	90.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-42.2	178.2	-179.1	69	0	0	0	111.3	L30 F55 L136 C140 D144 V145 Q146 R151 L152	L30-L148 HydrophobicContact CD2-CD1 3.85Å; F55-L148 HydrophobicContact CD2-CD1 4.26Å; F55-L148 HydrophobicContact CE2-CD1 3.96Å; F55-L148 HydrophobicContact CE2-CD2 3.66Å; F55-L148 HydrophobicContact CE2-CG 4.3Å; F55-L148 HydrophobicContact CZ-CD2 3.59Å; F55-L148 HydrophobicContact CZ-CG 4.48Å; L136-L148 HydrophobicContact CD2-CD2 4.31Å; C140-L148 HydrophobicContact CB-CD2 4.28Å; C140-L148 WeakPolarHBondContact SG-CD2 3.32Å; D144-L148 VanDerWaalsContact O-CB 3.3Å; D144-L148 WeakPolarHBondContact O-CB 3.49Å; D144-L148 PolarHBondContact O-N 2.63Å; V145-L148 PolarHBondContact O-N 2.87Å; Q146-L148 VanDerWaalsContact C-N 3.33Å; Q146-L148 PolarHBondContact O-N 3.47Å; L148-R151 PolarHBondContact O-N 3.26Å; L148-L152 HydrophobicContact CG-CD1 4.14Å; L148-L152 WeakPolarHBondContact O-CB 3.48Å; L148-L152 WeakPolarHBondContact O-CG 3.43Å; L148-L152 PolarHBondContact O-N 3.08Å
149	T	93.2	Very high	90.6	Very high	13 Å²	13	49.9 Å²	49.9	8%	0.08	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-48.9	176.6	-55.6	0	0	0	0	110.5	L127 V145 Q146 R151 L152 I153	L127-T149 HydrophobicContact CD2-CG2 4.16Å; L127-T149 HydrophobicContact CG-CG2 4.43Å; V145-T149 WeakPolarHBondContact O-CB 3.32Å; V145-T149 PolarHBondContact O-N 3.22Å; V145-T149 PolarHBondContact O-OG1 2.99Å; Q146-T149 PolarHBondContact O-N 2.98Å; T149-R151 VanDerWaalsContact C-N 3.27Å; T149-R151 PolarHBondContact O-N 3.09Å; T149-L152 PolarHBondContact O-N 3.47Å; T149-I153 HydrophobicContact CG2-CD1 4.09Å; T149-I153 VanDerWaalsContact O-CG1 3.32Å; T149-I153 WeakPolarHBondContact O-CG1 3.2Å; T149-I153 PolarHBondContact O-N 3.09Å
150	D	92.6	Very high	90.4	Very high	80 Å²	80	57.4 Å²	57.4	43%	0.428	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-38.3	177.8	-64.5	-24.9	0	0	0	111.3	Q146 I153 K154	Q146-D150 PolarHBondContact NE2-OD1 3.48Å; Q146-D150 PolarHBondContact NE2-OD2 3.15Å; Q146-D150 VanDerWaalsContact O-CG 3.23Å; Q146-D150 PolarHBondContact O-N 3.22Å; D150-I153 PolarHBondContact O-N 2.75Å; D150-K154 PolarHBondContact O-N 3.24Å
151	R	93	Very high	90.2	Very high	79 Å²	79	63.1 Å²	63.1	30%	0.298	33%	0.331	S	S	.	.	H	α-helix	trans	-66	-45.4	175.4	-175.3	57.1	179.8	-143.1	6.3	111.9	L30 F147 L148 T149 I153 K154 E155	L30-R151 HydrophobicContact CD1-CB 4.16Å; L30-R151 HydrophobicContact CD1-CG 3.83Å; F147-R151 WeakPolarHBondContact O-CB 3.49Å; F147-R151 PolarHBondContact O-N 2.76Å; L148-R151 PolarHBondContact O-N 3.26Å; T149-R151 VanDerWaalsContact C-N 3.27Å; T149-R151 PolarHBondContact O-N 3.09Å; R151-I153 VanDerWaalsContact C-N 3.33Å; R151-I153 PolarHBondContact O-N 3.21Å; R151-K154 WeakPolarHBondContact O-CB 3.48Å; R151-K154 PolarHBondContact O-N 3.43Å; R151-E155 HydrophobicContact CG-CG 4.48Å; R151-E155 IonicContact CZ-OE1 3.1Å; R151-E155 IonicContact NE-OE1 2.91Å; R151-E155 PolarHBondContact NE-OE1 2.86Å; R151-E155 IonicContact NH2-OE1 2.59Å; R151-E155 PolarHBondContact NH2-OE1 3.04Å; R151-E155 WeakPolarHBondContact O-CG 3.37Å; R151-E155 PolarHBondContact O-N 2.83Å
152	L	94.6	Very high	90.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-44.2	176.3	-76.4	166	0	0	0	110.9	I43 F55 L57 L127 L148 T149 K154 E155 I156 V165	I43-L152 HydrophobicContact CD1-CD2 3.64Å; F55-L152 HydrophobicContact CB-CD2 3.92Å; F55-L152 HydrophobicContact CD1-CD1 4.16Å; F55-L152 HydrophobicContact CD1-CD2 4.42Å; F55-L152 HydrophobicContact CE1-CD1 4.38Å; F55-L152 HydrophobicContact CG-CD1 4.48Å; F55-L152 HydrophobicContact CG-CD2 4.16Å; L57-L152 HydrophobicContact CD2-CD2 4.13Å; L127-L152 HydrophobicContact CD1-CD1 4.22Å; L127-L152 HydrophobicContact CD2-CB 3.56Å; L127-L152 HydrophobicContact CD2-CD1 4.31Å; L148-L152 HydrophobicContact CG-CD1 4.14Å; L148-L152 WeakPolarHBondContact O-CB 3.48Å; L148-L152 WeakPolarHBondContact O-CG 3.43Å; L148-L152 PolarHBondContact O-N 3.08Å; T149-L152 PolarHBondContact O-N 3.47Å; L152-K154 VanDerWaalsContact C-N 3.34Å; L152-K154 PolarHBondContact O-N 2.87Å; L152-E155 PolarHBondContact O-N 2.84Å; L152-I156 WeakPolarHBondContact O-CB 3.2Å; L152-I156 WeakPolarHBondContact O-CD1 3.36Å; L152-I156 WeakPolarHBondContact O-CG1 3.42Å; L152-I156 PolarHBondContact O-N 3.35Å; L152-V165 HydrophobicContact CD2-CG1 4.43Å
153	I	93.9	Very high	90.3	Very high	39 Å²	39	58.2 Å²	58.2	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-45.9	175.8	-67.9	169.3	0	0	0	111	T124 L127 Q128 T149 D150 R151 E155 I156 S157	T124-I153 HydrophobicContact CG2-CG2 4.21Å; L127-I153 HydrophobicContact CD2-CG1 3.84Å; Q128-I153 HydrophobicContact CG-CD1 4.07Å; T149-I153 HydrophobicContact CG2-CD1 4.09Å; T149-I153 VanDerWaalsContact O-CG1 3.32Å; T149-I153 WeakPolarHBondContact O-CG1 3.2Å; T149-I153 PolarHBondContact O-N 3.09Å; D150-I153 PolarHBondContact O-N 2.75Å; R151-I153 VanDerWaalsContact C-N 3.33Å; R151-I153 PolarHBondContact O-N 3.21Å; I153-E155 VanDerWaalsContact C-N 3.34Å; I153-E155 PolarHBondContact O-N 2.89Å; I153-I156 PolarHBondContact O-N 3.05Å; I153-S157 PolarHBondContact O-N 3.12Å
154	K	93.4	Very high	90.6	Very high	129 Å²	129	53.6 Å²	53.6	56%	0.561	27%	0.274	S	S	*	.	H	α-helix	trans	-58.9	-46.5	177.4	178.8	178.9	176.9	173.7	0	111.5	D150 R151 L152 S157	D150-K154 PolarHBondContact O-N 3.24Å; R151-K154 WeakPolarHBondContact O-CB 3.48Å; R151-K154 PolarHBondContact O-N 3.43Å; L152-K154 VanDerWaalsContact C-N 3.34Å; L152-K154 PolarHBondContact O-N 2.87Å; K154-S157 PolarHBondContact O-N 2.93Å; K154-S157 PolarHBondContact O-OG 3.37Å
155	E	93.6	Very high	90.9	Very high	20 Å²	20	53.3 Å²	53.3	9%	0.093	27%	0.272	C	S	.	.	H	α-helix	trans	-69	-39.1	-179.6	-66.4	-57.6	164.1	0	0	112.2	Q41 I43 L57 R151 L152 I153 S157 A158 F159	Q41-E155 PolarHBondContact NE2-OE2 3.3Å; Q41-E155 PolarHBondContact OE1-OE2 3.23Å; I43-E155 HydrophobicContact CD1-CB 4.09Å; I43-E155 HydrophobicContact CD1-CG 3.85Å; L57-E155 HydrophobicContact CD1-CB 3.51Å; R151-E155 HydrophobicContact CG-CG 4.48Å; R151-E155 IonicContact CZ-OE1 3.1Å; R151-E155 IonicContact NE-OE1 2.91Å; R151-E155 PolarHBondContact NE-OE1 2.86Å; R151-E155 IonicContact NH2-OE1 2.59Å; R151-E155 PolarHBondContact NH2-OE1 3.04Å; R151-E155 WeakPolarHBondContact O-CG 3.37Å; R151-E155 PolarHBondContact O-N 2.83Å; L152-E155 PolarHBondContact O-N 2.84Å; I153-E155 VanDerWaalsContact C-N 3.34Å; I153-E155 PolarHBondContact O-N 2.89Å; E155-S157 VanDerWaalsContact C-N 3.26Å; E155-S157 PolarHBondContact O-N 2.88Å; E155-A158 WeakPolarHBondContact O-CB 3.14Å; E155-A158 PolarHBondContact O-N 3.03Å; E155-A158 VanDerWaalsContact O-N 3.08Å; E155-F159 WeakPolarHBondContact O-CD2 3.26Å
156	I	92.7	Very high	91.2	Very high	14 Å²	14	53 Å²	53	7%	0.072	27%	0.27	C	S	.	.	H	α-helix	trans	-56.8	-42	172.7	-70.7	161.3	0	0	0	110.6	L57 T123 T124 L127 L152 I153 A158 F159 V163 V165	L57-I156 HydrophobicContact CD1-CG1 4.1Å; L57-I156 HydrophobicContact CD2-CG1 3.95Å; T123-I156 HydrophobicContact CG2-CD1 4.12Å; T124-I156 HydrophobicContact CG2-CB 4.43Å; T124-I156 HydrophobicContact CG2-CG2 3.79Å; L127-I156 HydrophobicContact CD2-CD1 4.05Å; L152-I156 WeakPolarHBondContact O-CB 3.2Å; L152-I156 WeakPolarHBondContact O-CD1 3.36Å; L152-I156 WeakPolarHBondContact O-CG1 3.42Å; L152-I156 PolarHBondContact O-N 3.35Å; I153-I156 PolarHBondContact O-N 3.05Å; I156-A158 PolarHBondContact O-N 2.93Å; I156-A158 VanDerWaalsContact O-N 3.11Å; I156-F159 PolarHBondContact O-N 2.64Å; I156-V163 HydrophobicContact CB-CG2 4.16Å; I156-V163 HydrophobicContact CG1-CG2 3.8Å; I156-V163 HydrophobicContact CG2-CG2 3.76Å; I156-V165 HydrophobicContact CD1-CG2 3.87Å; I156-V165 HydrophobicContact CG1-CG2 4.39Å
157	S	90.8	Very high	91.5	Very high	90 Å²	90	47.9 Å²	47.9	63%	0.629	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.5	-179.8	74.1	0	0	0	0	114.7	I153 K154 E155 F159	I153-S157 PolarHBondContact O-N 3.12Å; K154-S157 PolarHBondContact O-N 2.93Å; K154-S157 PolarHBondContact O-OG 3.37Å; E155-S157 VanDerWaalsContact C-N 3.26Å; E155-S157 PolarHBondContact O-N 2.88Å; S157-F159 VanDerWaalsContact C-N 3.32Å
158	A	89.3	Confident	91.8	Very high	77 Å²	77	45 Å²	45	64%	0.636	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.4	174.7	0	0	0	0	0	113	E155 I156	E155-A158 WeakPolarHBondContact O-CB 3.14Å; E155-A158 PolarHBondContact O-N 3.03Å; E155-A158 VanDerWaalsContact O-N 3.08Å; I156-A158 PolarHBondContact O-N 2.93Å; I156-A158 VanDerWaalsContact O-N 3.11Å
159	F	88.6	Confident	92	Very high	34 Å²	34	45.7 Å²	45.7	15%	0.149	24%	0.238	C	C	.	.			trans	-87.2	144.1	176.6	-70.4	-101.6	0	0	0	110.7	M34 Q41 L57 E155 I156 S157 E161 V163	M34-F159 HydrophobicContact CE-CZ 4.27Å; Q41-F159 HydrophobicContact CB-CE2 4.32Å; Q41-F159 HydrophobicContact CB-CZ 4Å; L57-F159 HydrophobicContact CB-CE2 4.01Å; L57-F159 HydrophobicContact CB-CZ 4.1Å; L57-F159 HydrophobicContact CD1-CE2 3.96Å; E155-F159 WeakPolarHBondContact O-CD2 3.26Å; I156-F159 PolarHBondContact O-N 2.64Å; S157-F159 VanDerWaalsContact C-N 3.32Å; F159-E161 VanDerWaalsContact C-N 3.35Å; F159-V163 HydrophobicContact CB-CG1 3.59Å; F159-V163 HydrophobicContact CD1-CG1 3.45Å; F159-V163 VanDerWaalsContact CD1-CG1 3.45Å; F159-V163 HydrophobicContact CD2-CG1 3.93Å; F159-V163 HydrophobicContact CE1-CG1 4.06Å; F159-V163 HydrophobicContact CE2-CG1 4.49Å; F159-V163 HydrophobicContact CG-CG1 3.37Å
160	Q	81	Confident	92	Very high	201 Å²	201	46.1 Å²	46.1	94%	0.939	24%	0.242	S	C	*	.	S	Bend	trans	-80.1	-20.1	178.8	-67.1	-178.1	-7.3	0	0	112.9
161	E	82.1	Confident	92.1	Very high	120 Å²	120	42.6 Å²	42.6	56%	0.561	22%	0.223	S	C	*	.	S	Bend	trans	-125.7	167.6	-173.7	-62.7	177.8	173.3	0	0	110	H60 F159	H60-E161 WeakPolarHBondContact CB-OE2 3.34Å; H60-E161 IonicContact CG-OE2 2.81Å; F159-E161 VanDerWaalsContact C-N 3.35Å
162	D	84.8	Confident	91.8	Very high	44 Å²	44	46.1 Å²	46.1	24%	0.235	24%	0.243	C	C	.	.			trans	-63.2	137.2	174.1	-91.2	-50.3	0	0	0	111.1	P78 Q110 H113 T123	P78-D162 HydrophobicContact CG-CB 4.22Å; Q110-D162 PolarHBondContact NE2-O 3.09Å; H113-D162 IonicContact CE1-OD2 3.9Å; H113-D162 PolarHBondContact CE1-OD2 3.04Å; H113-D162 VanDerWaalsContact NE2-CB 3.33Å; H113-D162 WeakPolarHBondContact NE2-CB 3Å; H113-D162 IonicContact NE2-OD2 3.45Å; H113-D162 PolarHBondContact NE2-OD2 3.44Å; T123-D162 PolarHBondContact N-OD1 3.33Å; T123-D162 PolarHBondContact OG1-OD1 3.27Å
163	V	92	Very high	91.7	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	25%	0.248	C	C	.	.			trans	-115.9	145.8	-176.6	-71	0	0	0	0	110.5	L58 T123 I156 F159	L58-V163 CarbonylContact O-C 3.54Å; L58-V163 WeakPolarHBondContact O-CA 3.28Å; T123-V163 HydrophobicContact CG2-CG2 4.1Å; T123-V163 WeakPolarHBondContact CG2-O 3.49Å; T123-V163 PolarHBondContact OG1-O 2.85Å; I156-V163 HydrophobicContact CB-CG2 4.16Å; I156-V163 HydrophobicContact CG1-CG2 3.8Å; I156-V163 HydrophobicContact CG2-CG2 3.76Å; F159-V163 HydrophobicContact CB-CG1 3.59Å; F159-V163 HydrophobicContact CD1-CG1 3.45Å; F159-V163 VanDerWaalsContact CD1-CG1 3.45Å; F159-V163 HydrophobicContact CD2-CG1 3.93Å; F159-V163 HydrophobicContact CE1-CG1 4.06Å; F159-V163 HydrophobicContact CE2-CG1 4.49Å; F159-V163 HydrophobicContact CG-CG1 3.37Å
164	T	93.9	Very high	91.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.7	168	-57.5	0	0	0	0	110.2	I56 L57 L58 H74 P78 I80 Q110 L166	I56-T164 VanDerWaalsContact O-O 3.11Å; L57-T164 WeakPolarHBondContact CA-O 3.3Å; L58-T164 PolarHBondContact N-O 3.4Å; L58-T164 PolarHBondContact O-N 3.24Å; H74-T164 WeakPolarHBondContact NE2-CG2 3.15Å; P78-T164 WeakPolarHBondContact CD-OG1 3.46Å; P78-T164 PolarHBondContact O-OG1 3.48Å; I80-T164 HydrophobicContact CG2-CG2 3.81Å; Q110-T164 WeakPolarHBondContact CG-OG1 3.44Å; Q110-T164 PolarHBondContact NE2-OG1 3.04Å; T164-L166 HydrophobicContact CG2-CD2 3.53Å; T164-L166 HydrophobicContact CG2-CG 3.89Å
165	V	95.7	Very high	91.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	109.3	173.6	-169.2	0	0	0	0	108.9	I56 L57 L75 C76 T123 L127 L152 I156	I56-V165 WeakPolarHBondContact O-CA 3.04Å; L57-V165 HydrophobicContact CD2-CB 4.35Å; L57-V165 HydrophobicContact CD2-CG1 4.07Å; L57-V165 HydrophobicContact CD2-CG2 3.82Å; L75-V165 WeakPolarHBondContact CB-O 3.41Å; L75-V165 HydrophobicContact CD1-CG1 4.16Å; L75-V165 PolarHBondContact N-O 2.91Å; C76-V165 PolarHBondContact O-N 3.02Å; C76-V165 VanDerWaalsContact SG-CG2 3.58Å; T123-V165 HydrophobicContact CG2-CG2 3.68Å; L127-V165 HydrophobicContact CD1-CG1 4.24Å; L152-V165 HydrophobicContact CD2-CG1 4.43Å; I156-V165 HydrophobicContact CD1-CG2 3.87Å; I156-V165 HydrophobicContact CG1-CG2 4.39Å
166	L	97.1	Very high	91.8	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.3	175.8	-55	177.5	0	0	0	109.7	F55 I56 H74 I80 I108 T164 F168	F55-L166 CarbonylContact C-O 3.58Å; F55-L166 VanDerWaalsContact CA-O 3.27Å; F55-L166 WeakPolarHBondContact CA-O 3.3Å; I56-L166 HydrophobicContact CB-CB 4.32Å; I56-L166 PolarHBondContact N-O 2.93Å; I56-L166 PolarHBondContact O-N 2.9Å; H74-L166 HydrophobicContact CB-CD2 3.96Å; I80-L166 HydrophobicContact CD1-CD1 3.87Å; I80-L166 HydrophobicContact CD1-CD2 3.81Å; I80-L166 HydrophobicContact CG2-CD1 4.45Å; I80-L166 HydrophobicContact CG2-CD2 4.45Å; I108-L166 HydrophobicContact CG2-CD1 4.1Å; T164-L166 HydrophobicContact CG2-CD2 3.53Å; T164-L166 HydrophobicContact CG2-CG 3.89Å; L166-F168 HydrophobicContact CB-CD2 4.18Å; L166-F168 HydrophobicContact CB-CE2 3.56Å; L166-F168 HydrophobicContact CB-CZ 4.49Å; L166-F168 HydrophobicContact CD1-CE2 4Å; L166-F168 HydrophobicContact CD1-CZ 4.28Å; L166-F168 HydrophobicContact CG-CE2 4.44Å
167	H	96.9	Very high	91.9	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.7	168.2	170.2	-99.7	0	0	0	109.7	S53 C54 F55 F72 T73 L75 L139	S53-H167 VanDerWaalsContact CB-NE2 3.3Å; S53-H167 WeakPolarHBondContact CB-NE2 3.39Å; S53-H167 PolarHBondContact OG-NE2 2.76Å; C54-H167 CarbonylContact O-C 3.51Å; F55-H167 HydrophobicContact CD1-CB 4.18Å; F55-H167 HydrophobicContact CE1-CB 4.04Å; F55-H167 AromaticContact CE1-CD2 3.59Å; F55-H167 AromaticContact CZ-CD2 3.6Å; F72-H167 CarbonylContact C-O 3.55Å; F72-H167 WeakPolarHBondContact CA-O 3.43Å; F72-H167 WeakPolarHBondContact CB-O 3.37Å; T73-H167 PolarHBondContact N-O 3.24Å; T73-H167 PolarHBondContact O-N 3.2Å; L75-H167 HydrophobicContact CD1-CB 3.93Å; L75-H167 HydrophobicContact CD2-CB 4.41Å; L75-H167 HydrophobicContact CG-CB 4.11Å; L139-H167 HydrophobicContact CD1-CB 4.44Å
168	F	97.3	Very high	92.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.2	173.2	-70	-104.3	0	0	0	109.8	C54 I56 A70 R71 F72 L97 I108 L166 F208 F210	C54-F168 HydrophobicContact CB-CB 4.18Å; C54-F168 PolarHBondContact N-O 3.08Å; C54-F168 PolarHBondContact O-N 3.16Å; I56-F168 HydrophobicContact CB-CE2 4.43Å; I56-F168 HydrophobicContact CD1-CD2 3.93Å; I56-F168 HydrophobicContact CD1-CE2 3.62Å; I56-F168 HydrophobicContact CD1-CZ 4.27Å; I56-F168 HydrophobicContact CG1-CD2 4.05Å; I56-F168 HydrophobicContact CG1-CE2 4.03Å; A70-F168 HydrophobicContact CB-CD1 3.82Å; R71-F168 CarbonylContact O-C 3.51Å; R71-F168 VanDerWaalsContact O-CA 3.29Å; R71-F168 WeakPolarHBondContact O-CA 3.42Å; F72-F168 HydrophobicContact CB-CD1 3.7Å; F72-F168 HydrophobicContact CB-CD2 4.43Å; F72-F168 HydrophobicContact CB-CE1 3.56Å; F72-F168 HydrophobicContact CB-CE2 4.3Å; F72-F168 HydrophobicContact CB-CG 4.13Å; F72-F168 HydrophobicContact CB-CZ 3.86Å; F72-F168 HydrophobicContact CG-CE1 4.37Å; F72-F168 HydrophobicContact CG-CZ 4.44Å; L97-F168 HydrophobicContact CD1-CD1 4.43Å; L97-F168 HydrophobicContact CD1-CE1 3.64Å; L97-F168 HydrophobicContact CD1-CZ 4.49Å; I108-F168 HydrophobicContact CD1-CE1 4.08Å; I108-F168 HydrophobicContact CD1-CZ 3.5Å; I108-F168 VanDerWaalsContact CD1-CZ 3.5Å; L166-F168 HydrophobicContact CB-CD2 4.18Å; L166-F168 HydrophobicContact CB-CE2 3.56Å; L166-F168 HydrophobicContact CB-CZ 4.49Å; L166-F168 HydrophobicContact CD1-CE2 4Å; L166-F168 HydrophobicContact CD1-CZ 4.28Å; L166-F168 HydrophobicContact CG-CE2 4.44Å; F168-F208 HydrophobicContact CB-CE1 4.35Å; F168-F208 HydrophobicContact CB-CE2 3.67Å; F168-F208 HydrophobicContact CB-CZ 3.49Å; F168-F208 VanDerWaalsContact CB-CZ 3.49Å; F168-F208 HydrophobicContact CG-CE2 4.34Å; F168-F210 HydrophobicContact CD1-CE1 4.21Å; F168-F210 AromaticContact CD1-CZ 3.77Å; F168-F210 HydrophobicContact CD1-CZ 3.77Å; F168-F210 HydrophobicContact CD2-CZ 4.13Å; F168-F210 AromaticContact CE1-CE1 3.83Å; F168-F210 HydrophobicContact CE1-CE1 3.83Å; F168-F210 AromaticContact CE1-CZ 3.87Å; F168-F210 HydrophobicContact CE1-CZ 3.87Å; F168-F210 HydrophobicContact CE2-CE1 4.35Å; F168-F210 HydrophobicContact CE2-CZ 4.24Å; F168-F210 AromaticContact CG-CZ 3.92Å; F168-F210 HydrophobicContact CG-CZ 3.92Å; F168-F210 AromaticContact CZ-CE1 3.93Å; F168-F210 HydrophobicContact CZ-CE1 3.93Å; F168-F210 HydrophobicContact CZ-CZ 4.13Å
169	S	95.1	Very high	92.5	Very high	15 Å²	15	35 Å²	35	11%	0.105	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.2	174.2	53.8	0	0	0	0	110.9	R71 C171	R71-S169 PolarHBondContact N-O 2.84Å; R71-S169 PolarHBondContact O-N 2.77Å; R71-S169 PolarHBondContact O-OG 2.88Å; S169-C171 PolarHBondContact O-N 3.03Å
170	P	94.5	Very high	92.8	Very high	23 Å²	23	34.5 Å²	34.5	15%	0.149	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	129.4	175.6	-25.7	32	0	0	0	111.4	C52 L206	C52-P170 WeakPolarHBondContact O-CD 2.99Å; P170-L206 WeakPolarHBondContact CA-O 3.37Å; P170-L206 WeakPolarHBondContact CB-O 3.31Å; P170-L206 WeakPolarHBondContact CG-O 3.47Å
171	C	93	Very high	93.4	Very high	6 Å²	6	29.9 Å²	29.9	4%	0.041	15%	0.15	C	C	.	.			trans	-102	103.9	172.9	-173.8	0	0	0	0	109.9	K69 A70 R71 S169	K69-C171 HydrophobicContact CB-CB 4.23Å; A70-C171 VanDerWaalsContact C-CB 3.45Å; R71-C171 HydrophobicContact CB-CB 4.42Å; S169-C171 PolarHBondContact O-N 3.03Å
172	Q	87.5	Confident	94	Very high	153 Å²	153	24.4 Å²	24.4	72%	0.715	13%	0.125	S	C	*	.			trans	-80.1	137.2	173.9	-67	-174.4	-2.8	0	0	110.2
173	S	92.6	Very high	94.4	Very high	14 Å²	14	31.1 Å²	31.1	10%	0.098	15%	0.152	C	C	.	.			trans	-148.2	95.1	174.4	173.1	0	0	0	0	107.8	V175 L176 D177	S173-V175 PolarHBondContact O-N 3.13Å; S173-L176 PolarHBondContact O-N 2.79Å; S173-L176 WeakPolarHBondContact OG-CG 3.44Å; S173-L176 PolarHBondContact OG-N 3.49Å; S173-D177 VanDerWaalsContact C-OD2 3.26Å; S173-D177 PolarHBondContact O-N 2.5Å
174	R	92.4	Very high	94.4	Very high	46 Å²	46	35.6 Å²	35.6	17%	0.174	17%	0.169	C	C	.	.	H	α-helix	trans	-50.7	-29.9	177.1	50.2	178.8	-91.7	171.8	2.6	113.2	S178 A475 K486 L490	R174-S178 VanDerWaalsContact O-CB 3.25Å; R174-S178 WeakPolarHBondContact O-CB 3.32Å; R174-S178 PolarHBondContact O-N 3.12Å; R174-A475 VanDerWaalsContact NH2-CA 3.32Å; R174-A475 PolarHBondContact NH2-O 3.19Å; R174-K486 PolarHBondContact NH1-O 3.5Å; R174-L490 HydrophobicContact CB-CG 4.41Å; R174-L490 HydrophobicContact CG-CD1 4.48Å
175	V	95.2	Very high	94.4	Very high	10 Å²	10	35.8 Å²	35.8	6%	0.061	17%	0.17	C	C	.	.	H	α-helix	trans	-68.4	-51.1	174.8	176.4	0	0	0	0	111.3	S173 D177 S178 I179 L318 T468 M471 L490	S173-V175 PolarHBondContact O-N 3.13Å; V175-D177 VanDerWaalsContact C-N 3.3Å; V175-D177 PolarHBondContact O-N 3.46Å; V175-S178 WeakPolarHBondContact O-CB 3.35Å; V175-S178 PolarHBondContact O-N 2.77Å; V175-I179 HydrophobicContact CG1-CD1 4.05Å; V175-I179 WeakPolarHBondContact O-CG1 3.34Å; V175-I179 PolarHBondContact O-N 3Å; V175-L318 HydrophobicContact CB-CD2 3.88Å; V175-L318 HydrophobicContact CG1-CD2 3.68Å; V175-L318 HydrophobicContact CG2-CD2 4.09Å; V175-T468 HydrophobicContact CG1-CG2 3.85Å; V175-M471 HydrophobicContact CB-CB 4.49Å; V175-M471 HydrophobicContact CG1-CB 3.65Å; V175-L490 HydrophobicContact CG2-CD1 4.18Å
176	L	95.9	Very high	94.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.6	-32.8	178.7	-64.4	176.1	0	0	0	112	K69 Y98 S173 I179 S180 F189 Y314 T315 L318	K69-L176 HydrophobicContact CD-CB 4.45Å; K69-L176 HydrophobicContact CD-CD1 4.06Å; Y98-L176 HydrophobicContact CD1-CD1 3.54Å; Y98-L176 HydrophobicContact CE1-CD1 3.52Å; Y98-L176 HydrophobicContact CG-CD1 4.26Å; S173-L176 PolarHBondContact O-N 2.79Å; S173-L176 WeakPolarHBondContact OG-CG 3.44Å; S173-L176 PolarHBondContact OG-N 3.49Å; L176-I179 HydrophobicContact CD2-CD1 4.39Å; L176-I179 PolarHBondContact O-N 2.76Å; L176-S180 WeakPolarHBondContact O-CB 3.38Å; L176-S180 PolarHBondContact O-N 3.3Å; L176-S180 PolarHBondContact O-OG 3.42Å; L176-F189 HydrophobicContact CB-CE2 4.01Å; L176-F189 HydrophobicContact CD1-CE2 4.04Å; L176-F189 HydrophobicContact CD1-CZ 3.79Å; L176-F189 HydrophobicContact CD2-CE2 4.24Å; L176-F189 HydrophobicContact CD2-CZ 4.34Å; L176-F189 HydrophobicContact CG-CE2 4.31Å; L176-F189 HydrophobicContact CG-CZ 4.46Å; L176-Y314 HydrophobicContact CD2-CD2 4.09Å; L176-Y314 HydrophobicContact CD2-CE2 3.96Å; L176-T315 HydrophobicContact CD1-CG2 4.28Å; L176-T315 HydrophobicContact CD2-CG2 4.24Å; L176-L318 HydrophobicContact CD1-CD1 3.88Å; L176-L318 HydrophobicContact CD2-CD1 3.82Å; L176-L318 HydrophobicContact CG-CD1 3.63Å
177	D	95.1	Very high	94.1	Very high	64 Å²	64	45.9 Å²	45.9	34%	0.342	21%	0.209	S	C	.	.	H	α-helix	trans	-64.6	-45	173.6	-64	-36.5	0	0	0	110.4	K69 S173 V175 I179 S180 E181	K69-D177 IonicContact NZ-OD1 3.08Å; K69-D177 PolarHBondContact NZ-OD1 2.96Å; K69-D177 IonicContact NZ-OD2 2.83Å; S173-D177 VanDerWaalsContact C-OD2 3.26Å; S173-D177 PolarHBondContact O-N 2.5Å; V175-D177 VanDerWaalsContact C-N 3.3Å; V175-D177 PolarHBondContact O-N 3.46Å; D177-I179 PolarHBondContact O-N 3.46Å; D177-S180 WeakPolarHBondContact O-CB 3.4Å; D177-S180 PolarHBondContact O-N 2.88Å; D177-S180 VanDerWaalsContact O-N 3.17Å; D177-E181 PolarHBondContact O-N 3.35Å
178	S	95.4	Very high	93.9	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-48.5	172.6	-171	0	0	0	0	112.3	R174 V175 S180 E181 G491 P493	R174-S178 VanDerWaalsContact O-CB 3.25Å; R174-S178 WeakPolarHBondContact O-CB 3.32Å; R174-S178 PolarHBondContact O-N 3.12Å; V175-S178 WeakPolarHBondContact O-CB 3.35Å; V175-S178 PolarHBondContact O-N 2.77Å; S178-S180 PolarHBondContact O-N 2.72Å; S178-E181 VanDerWaalsContact O-CB 3.28Å; S178-E181 WeakPolarHBondContact O-CB 3.41Å; S178-E181 PolarHBondContact O-N 3.29Å; S178-G491 VanDerWaalsContact CA-O 3.3Å; S178-G491 WeakPolarHBondContact CA-O 3.5Å; S178-G491 VanDerWaalsContact CB-O 3.27Å; S178-G491 WeakPolarHBondContact CB-O 3.47Å; S178-G491 PolarHBondContact OG-O 2.86Å; S178-P493 WeakPolarHBondContact O-CD 3.43Å; S178-P493 WeakPolarHBondContact O-CG 3.4Å; S178-P493 WeakPolarHBondContact OG-CD 3.3Å; S178-P493 WeakPolarHBondContact OG-CG 3.26Å
179	I	96.1	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-34.7	178.6	-67	165	0	0	0	111.4	V175 L176 D177 E181 I182 F185 L188 L464 L467 T468	V175-I179 HydrophobicContact CG1-CD1 4.05Å; V175-I179 WeakPolarHBondContact O-CG1 3.34Å; V175-I179 PolarHBondContact O-N 3Å; L176-I179 HydrophobicContact CD2-CD1 4.39Å; L176-I179 PolarHBondContact O-N 2.76Å; D177-I179 PolarHBondContact O-N 3.46Å; I179-E181 PolarHBondContact O-N 2.94Å; I179-I182 WeakPolarHBondContact O-CB 3.43Å; I179-I182 PolarHBondContact O-N 3.28Å; I179-I182 VanDerWaalsContact O-N 3.11Å; I179-F185 HydrophobicContact CG2-CB 4.01Å; I179-F185 HydrophobicContact CG2-CD2 4.12Å; I179-F185 HydrophobicContact CG2-CG 4.3Å; I179-L188 HydrophobicContact CG2-CD1 3.89Å; I179-L464 HydrophobicContact CG2-CD2 3.74Å; I179-L467 HydrophobicContact CG1-CB 4.32Å; I179-T468 HydrophobicContact CD1-CG2 4.19Å; I179-T468 WeakPolarHBondContact CD1-OG1 3.19Å
180	S	95	Very high	93.6	Very high	24 Å²	24	50.6 Å²	50.6	17%	0.168	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-11.8	177.4	-57	0	0	0	0	113.5	L176 D177 S178 I182 R186	L176-S180 WeakPolarHBondContact O-CB 3.38Å; L176-S180 PolarHBondContact O-N 3.3Å; L176-S180 PolarHBondContact O-OG 3.42Å; D177-S180 WeakPolarHBondContact O-CB 3.4Å; D177-S180 PolarHBondContact O-N 2.88Å; D177-S180 VanDerWaalsContact O-N 3.17Å; S178-S180 PolarHBondContact O-N 2.72Å; S180-I182 VanDerWaalsContact C-N 3.29Å; S180-R186 VanDerWaalsContact O-CA 3.22Å; S180-R186 WeakPolarHBondContact O-CA 3.41Å
181	E	94.5	Very high	93.6	Very high	104 Å²	104	51.2 Å²	51.2	49%	0.486	23%	0.231	S	C	.	.	H	α-helix	trans	-73.2	-22.5	170.3	-64.8	-58.8	144.4	0	0	112.5	D177 S178 I179 K183 H492	D177-E181 PolarHBondContact O-N 3.35Å; S178-E181 VanDerWaalsContact O-CB 3.28Å; S178-E181 WeakPolarHBondContact O-CB 3.41Å; S178-E181 PolarHBondContact O-N 3.29Å; I179-E181 PolarHBondContact O-N 2.94Å; E181-K183 PolarHBondContact O-N 3.37Å; E181-H492 HydrophobicContact CB-CB 4.45Å
182	I	94.2	Very high	93.5	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.026	24%	0.241	C	C	.	.	S	Bend	trans	-71.2	125.9	174.9	-64.7	167.6	0	0	0	109	I179 S180 R184 F185 R186 L467 P493 C664	I179-I182 WeakPolarHBondContact O-CB 3.43Å; I179-I182 PolarHBondContact O-N 3.28Å; I179-I182 VanDerWaalsContact O-N 3.11Å; S180-I182 VanDerWaalsContact C-N 3.29Å; I182-R184 HydrophobicContact CG2-CB 4.29Å; I182-R184 PolarHBondContact O-N 2.96Å; I182-F185 HydrophobicContact CB-CD2 3.99Å; I182-F185 HydrophobicContact CD1-CD2 4.19Å; I182-F185 HydrophobicContact CG2-CD2 3.8Å; I182-F185 HydrophobicContact CG2-CE2 4.28Å; I182-F185 CarbonylContact O-C 3.56Å; I182-F185 PolarHBondContact O-N 3.24Å; I182-R186 PolarHBondContact O-N 3.44Å; I182-L467 HydrophobicContact CD1-CD1 3.5Å; I182-L467 HydrophobicContact CD1-CD2 3.94Å; I182-L467 HydrophobicContact CD1-CG 4.34Å; I182-P493 HydrophobicContact CD1-CB 4.27Å; I182-P493 HydrophobicContact CD1-CG 3.73Å; I182-P493 HydrophobicContact CG1-CG 4Å; I182-C664 HydrophobicContact CD1-CB 4.3Å; I182-C664 HydrophobicContact CG2-CB 4.42Å
183	K	92.3	Very high	93.4	Very high	185 Å²	185	49.9 Å²	49.9	80%	0.804	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	-39.8	-176.4	-175.7	179.5	178.9	-180	0	113.6	E181 F185	E181-K183 PolarHBondContact O-N 3.37Å; K183-F185 VanDerWaalsContact C-N 3.31Å; K183-F185 PolarHBondContact O-N 3.15Å
184	R	92.6	Very high	93.1	Very high	95 Å²	95	57.2 Å²	57.2	36%	0.358	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.6	179.1	-177.7	56.2	174.3	156.5	1.1	113.1	I182 P452 N455 D460	I182-R184 HydrophobicContact CG2-CB 4.29Å; I182-R184 PolarHBondContact O-N 2.96Å; R184-P452 PolarHBondContact NH1-O 2.94Å; R184-N455 PolarHBondContact NH2-O 3.41Å; R184-D460 IonicContact CZ-OD1 3.32Å; R184-D460 IonicContact CZ-OD2 2.81Å; R184-D460 IonicContact NE-OD1 3.81Å; R184-D460 PolarHBondContact NE-OD1 2.86Å; R184-D460 IonicContact NE-OD2 3.62Å; R184-D460 IonicContact NH2-OD1 3.77Å; R184-D460 PolarHBondContact NH2-OD1 2.94Å; R184-D460 IonicContact NH2-OD2 3.52Å; R184-D460 PolarHBondContact NH2-OD2 3.27Å
185	F	95	Very high	92.9	Very high	5 Å²	5	57.7 Å²	57.7	2%	0.022	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	2.5	-173.1	-56.3	-47.9	0	0	0	113.9	I179 I182 K183 F187 L188 D460 D463 L464 L467	I179-F185 HydrophobicContact CG2-CB 4.01Å; I179-F185 HydrophobicContact CG2-CD2 4.12Å; I179-F185 HydrophobicContact CG2-CG 4.3Å; I182-F185 HydrophobicContact CB-CD2 3.99Å; I182-F185 HydrophobicContact CD1-CD2 4.19Å; I182-F185 HydrophobicContact CG2-CD2 3.8Å; I182-F185 HydrophobicContact CG2-CE2 4.28Å; I182-F185 CarbonylContact O-C 3.56Å; I182-F185 PolarHBondContact O-N 3.24Å; K183-F185 VanDerWaalsContact C-N 3.31Å; K183-F185 PolarHBondContact O-N 3.15Å; F185-F187 PolarHBondContact O-N 3.27Å; F185-L188 HydrophobicContact CB-CD1 3.81Å; F185-L188 HydrophobicContact CB-CG 4.05Å; F185-L188 WeakPolarHBondContact O-CB 3.22Å; F185-L188 WeakPolarHBondContact O-CG 3.33Å; F185-L188 PolarHBondContact O-N 3.38Å; F185-D460 HydrophobicContact CE1-CB 4.16Å; F185-D463 HydrophobicContact CE2-CB 4.42Å; F185-D463 HydrophobicContact CZ-CB 4.02Å; F185-L464 HydrophobicContact CB-CD2 4.26Å; F185-L464 HydrophobicContact CD1-CD1 4.28Å; F185-L464 HydrophobicContact CD1-CD2 3.54Å; F185-L464 HydrophobicContact CD1-CG 3.93Å; F185-L464 HydrophobicContact CD2-CD2 3.84Å; F185-L464 HydrophobicContact CE1-CD1 4.14Å; F185-L464 HydrophobicContact CE1-CD2 3.73Å; F185-L464 HydrophobicContact CE1-CG 3.64Å; F185-L464 HydrophobicContact CE2-CD2 4.04Å; F185-L464 HydrophobicContact CE2-CG 4.41Å; F185-L464 HydrophobicContact CG-CD2 3.6Å; F185-L464 HydrophobicContact CG-CG 4.43Å; F185-L464 HydrophobicContact CZ-CD2 3.98Å; F185-L464 HydrophobicContact CZ-CG 3.91Å; F185-L467 HydrophobicContact CD2-CD1 4Å; F185-L467 HydrophobicContact CE2-CD1 3.51Å
186	R	93.4	Very high	92.8	Very high	158 Å²	158	58 Å²	58	60%	0.596	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-28.8	-179.2	-173.1	177.9	179.6	115.5	-0.2	115.7	S180 I182	S180-R186 VanDerWaalsContact O-CA 3.22Å; S180-R186 WeakPolarHBondContact O-CA 3.41Å; I182-R186 PolarHBondContact O-N 3.44Å
187	F	92.4	Very high	92.7	Very high	55 Å²	55	58.7 Å²	58.7	24%	0.241	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	9.6	-175.7	-61.3	-78.1	0	0	0	113.9	T101 F185 F189 H190 R453 Y454	T101-F187 PolarHBondContact OG1-O 3.04Å; T101-F187 VanDerWaalsContact OG1-O 3.05Å; F185-F187 PolarHBondContact O-N 3.27Å; F187-F189 PolarHBondContact O-N 3.47Å; F187-F189 VanDerWaalsContact O-N 3.11Å; F187-H190 HydrophobicContact CB-CB 4.31Å; F187-H190 HydrophobicContact CD1-CB 4.48Å; F187-H190 WeakPolarHBondContact O-CB 3.45Å; F187-H190 PolarHBondContact O-N 3.45Å; F187-R453 HydrophobicContact CD2-CB 4.21Å; F187-R453 HydrophobicContact CD2-CG 4.45Å; F187-R453 HydrophobicContact CE2-CG 4.45Å; F187-Y454 HydrophobicContact CB-CD1 4.44Å; F187-Y454 HydrophobicContact CB-CE1 3.81Å
188	L	92.6	Very high	92.7	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-37.5	-177.4	-84.5	175.4	0	0	0	114	S100 T101 I179 F185 L456 L464	S100-L188 CarbonylContact C-O 3.55Å; S100-L188 WeakPolarHBondContact CA-O 3.24Å; S100-L188 VanDerWaalsContact CB-O 3.25Å; S100-L188 WeakPolarHBondContact CB-O 3.47Å; T101-L188 PolarHBondContact N-O 2.97Å; T101-L188 PolarHBondContact OG1-O 3.17Å; I179-L188 HydrophobicContact CG2-CD1 3.89Å; F185-L188 HydrophobicContact CB-CD1 3.81Å; F185-L188 HydrophobicContact CB-CG 4.05Å; F185-L188 WeakPolarHBondContact O-CB 3.22Å; F185-L188 WeakPolarHBondContact O-CG 3.33Å; F185-L188 PolarHBondContact O-N 3.38Å; L188-L456 HydrophobicContact CD2-CD1 4.06Å; L188-L464 HydrophobicContact CD1-CD2 3.73Å; L188-L464 HydrophobicContact CD2-CD1 4.07Å; L188-L464 HydrophobicContact CD2-CD2 4.44Å
189	F	94	Very high	92.5	Very high	27 Å²	27	59.5 Å²	59.5	12%	0.118	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	33.3	-179.6	-62	-77.8	0	0	0	111.7	K69 L176 F187 L191	K69-F189 HydrophobicContact CD-CD1 4.12Å; K69-F189 HydrophobicContact CD-CD2 4.03Å; K69-F189 HydrophobicContact CD-CE1 4.19Å; K69-F189 HydrophobicContact CD-CE2 4.11Å; K69-F189 HydrophobicContact CD-CG 4.03Å; K69-F189 HydrophobicContact CD-CZ 4.19Å; K69-F189 HydrophobicContact CG-CB 4.38Å; K69-F189 HydrophobicContact CG-CD1 3.43Å; K69-F189 VanDerWaalsContact CG-CD1 3.43Å; K69-F189 HydrophobicContact CG-CD2 4.24Å; K69-F189 HydrophobicContact CG-CE1 3.65Å; K69-F189 HydrophobicContact CG-CE2 4.43Å; K69-F189 HydrophobicContact CG-CG 3.75Å; K69-F189 HydrophobicContact CG-CZ 4.16Å; L176-F189 HydrophobicContact CB-CE2 4.01Å; L176-F189 HydrophobicContact CD1-CE2 4.04Å; L176-F189 HydrophobicContact CD1-CZ 3.79Å; L176-F189 HydrophobicContact CD2-CE2 4.24Å; L176-F189 HydrophobicContact CD2-CZ 4.34Å; L176-F189 HydrophobicContact CG-CE2 4.31Å; L176-F189 HydrophobicContact CG-CZ 4.46Å; F187-F189 PolarHBondContact O-N 3.47Å; F187-F189 VanDerWaalsContact O-N 3.11Å; F189-L191 PolarHBondContact O-N 3.01Å
190	H	92.9	Very high	92.4	Very high	86 Å²	86	62.3 Å²	62.3	40%	0.398	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-59.8	134.2	175.2	-178.1	68.6	0	0	0	110.9	T101 F187 Y454	T101-H190 HydrophobicContact CG2-CB 4.14Å; F187-H190 HydrophobicContact CB-CB 4.31Å; F187-H190 HydrophobicContact CD1-CB 4.48Å; F187-H190 WeakPolarHBondContact O-CB 3.45Å; F187-H190 PolarHBondContact O-N 3.45Å; H190-Y454 HydrophobicContact CB-CE1 4.24Å; H190-Y454 PolarHBondContact CD2-OH 3.44Å
191	L	93.7	Very high	92.2	Very high	36 Å²	36	65.7 Å²	65.7	19%	0.188	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-96.3	119.7	179.9	-55.6	-178.1	0	0	0	109.6	F189 A203 T209	F189-L191 PolarHBondContact O-N 3.01Å; L191-A203 HydrophobicContact CD1-CB 4.16Å; L191-A203 VanDerWaalsContact CD1-O 3.28Å; L191-A203 WeakPolarHBondContact CD1-O 3.26Å; L191-T209 HydrophobicContact CB-CG2 4.21Å; L191-T209 HydrophobicContact CD2-CG2 4.47Å
192	P	90.3	Very high	92.2	Very high	38 Å²	38	61.4 Å²	61.4	25%	0.247	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-64.9	141.9	173.1	22.1	-25.6	0	0	0	110.5	Y67 T196 T209	Y67-P192 HydrophobicContact CD1-CG 3.76Å; Y67-P192 HydrophobicContact CD2-CG 3.74Å; Y67-P192 HydrophobicContact CE1-CG 3.98Å; Y67-P192 HydrophobicContact CE2-CG 3.97Å; Y67-P192 HydrophobicContact CG-CG 3.62Å; P192-T196 HydrophobicContact CB-CG2 4.12Å; P192-T196 HydrophobicContact CG-CG2 3.92Å; P192-T196 WeakPolarHBondContact O-CG2 3.47Å; P192-T196 PolarHBondContact O-OG1 3.39Å; P192-T209 HydrophobicContact CG-CG2 4.28Å
193	S	86.3	Confident	92.2	Very high	93 Å²	93	61.3 Å²	61.3	65%	0.65	33%	0.327	S	S	*	.			trans	-100.8	-22	-177.5	54.4	0	0	0	0	114.1
194	E	86.5	Confident	92.3	Very high	167 Å²	167	60.9 Å²	60.9	78%	0.78	33%	0.325	S	S	*	.	S	Bend	trans	-89.5	129	-175.5	-168.4	168.9	-162.6	0	0	110.5	T196	E194-T196 WeakPolarHBondContact O-CG2 3.02Å; E194-T196 PolarHBondContact O-N 3.22Å; E194-T196 VanDerWaalsContact O-N 3.12Å
195	G	87.5	Confident	92.3	Very high	56 Å²	56	60.8 Å²	60.8	58%	0.577	33%	0.331	S	S	*	.	S	Bend	trans	69	2.5	179.3	0	0	0	0	0	115.5	L211	G195-L211 WeakPolarHBondContact O-CD1 3.41Å
196	T	92.9	Very high	92.3	Very high	16 Å²	16	60.6 Å²	60.6	10%	0.098	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	152.9	-175	67.6	0	0	0	0	114	P192 E194 T209 F210 L211	P192-T196 HydrophobicContact CB-CG2 4.12Å; P192-T196 HydrophobicContact CG-CG2 3.92Å; P192-T196 WeakPolarHBondContact O-CG2 3.47Å; P192-T196 PolarHBondContact O-OG1 3.39Å; E194-T196 WeakPolarHBondContact O-CG2 3.02Å; E194-T196 PolarHBondContact O-N 3.22Å; E194-T196 VanDerWaalsContact O-N 3.12Å; T196-T209 VanDerWaalsContact CB-OG1 3.26Å; T196-T209 WeakPolarHBondContact CB-OG1 3.48Å; T196-T209 HydrophobicContact CG2-CG2 3.99Å; T196-T209 PolarHBondContact OG1-OG1 3.05Å; T196-F210 CarbonylContact C-O 3.57Å; T196-F210 WeakPolarHBondContact CA-O 3.19Å; T196-F210 VanDerWaalsContact CB-O 3.32Å; T196-F210 WeakPolarHBondContact CB-O 3.34Å; T196-L211 HydrophobicContact CG2-CB 4.23Å; T196-L211 HydrophobicContact CG2-CD1 4.4Å
197	V	94.3	Very high	92.4	Very high	16 Å²	16	54.5 Å²	54.5	10%	0.097	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.9	178.7	-171.3	0	0	0	0	108.8	T33 F35 I42 T209 F210	T33-V197 HydrophobicContact CG2-CG1 3.57Å; F35-V197 HydrophobicContact CD1-CB 4.22Å; F35-V197 HydrophobicContact CD1-CG2 3.75Å; F35-V197 HydrophobicContact CE1-CB 3.72Å; F35-V197 HydrophobicContact CE1-CG2 3.73Å; F35-V197 HydrophobicContact CE2-CB 4.27Å; F35-V197 HydrophobicContact CE2-CG1 4.33Å; F35-V197 HydrophobicContact CG-CG2 4.27Å; F35-V197 HydrophobicContact CZ-CB 3.78Å; F35-V197 HydrophobicContact CZ-CG1 4.3Å; F35-V197 HydrophobicContact CZ-CG2 4.24Å; I42-V197 HydrophobicContact CB-CG1 4.15Å; I42-V197 HydrophobicContact CD1-CB 3.9Å; I42-V197 HydrophobicContact CD1-CG1 3.57Å; I42-V197 HydrophobicContact CG1-CG1 4.4Å; V197-T209 PolarHBondContact O-OG1 3.2Å; V197-T209 VanDerWaalsContact O-OG1 3.13Å; V197-F210 PolarHBondContact N-O 3.16Å; V197-F210 WeakPolarHBondContact O-CB 3.48Å; V197-F210 WeakPolarHBondContact O-CD2 3.5Å; V197-F210 PolarHBondContact O-N 3.04Å
198	P	94.2	Very high	92.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	31%	0.306	C	S	.	.	S	Bend	cis	-72.2	177.8	-3.2	34.4	-36.1	0	0	0	111.7	I42 V44 L202 L206	I42-P198 HydrophobicContact CG2-CB 4.45Å; V44-P198 HydrophobicContact CG2-CB 4.1Å; V44-P198 HydrophobicContact CG2-CG 4.14Å; P198-L202 HydrophobicContact CB-CB 3.78Å; P198-L202 HydrophobicContact CB-CD1 4.01Å; P198-L202 HydrophobicContact CG-CB 3.76Å; P198-L206 HydrophobicContact CG-CD1 3.79Å
199	N	92.2	Very high	92.8	Very high	81 Å²	81	51.8 Å²	51.8	43%	0.433	31%	0.305	S	S	.	.			trans	-54.4	159.5	178	67.6	55.5	0	0	0	112.4	S201 L202 A203	N199-S201 PolarHBondContact O-N 3.35Å; N199-S201 WeakPolarHBondContact OD1-CB 3.43Å; N199-S201 PolarHBondContact OD1-N 3.37Å; N199-L202 PolarHBondContact O-N 2.96Å; N199-L202 PolarHBondContact OD1-N 2.94Å; N199-L202 VanDerWaalsContact OD1-N 3.07Å; N199-A203 WeakPolarHBondContact O-CB 3.19Å; N199-A203 PolarHBondContact O-N 2.8Å
200	A	92.7	Very high	92.9	Very high	58 Å²	58	50.5 Å²	50.5	48%	0.479	30%	0.299	S	S	.	.	H	α-helix	trans	-53.2	-33.9	-173.8	0	0	0	0	0	114.7	K204	A200-K204 WeakPolarHBondContact O-CB 3.21Å; A200-K204 PolarHBondContact O-N 3.3Å
201	S	92.5	Very high	93	Very high	96 Å²	96	48.4 Å²	48.4	67%	0.671	29%	0.291	S	S	*	.	H	α-helix	trans	-68.3	-46.9	178.7	-57.3	0	0	0	0	111.8	N199 L205	N199-S201 PolarHBondContact O-N 3.35Å; N199-S201 WeakPolarHBondContact OD1-CB 3.43Å; N199-S201 PolarHBondContact OD1-N 3.37Å; S201-L205 PolarHBondContact O-N 3.45Å
202	L	93.2	Very high	93	Very high	14 Å²	14	48.6 Å²	48.6	7%	0.073	29%	0.291	C	S	.	.	H	α-helix	trans	-69.4	-39.8	176.2	-71	174.2	0	0	0	111.5	F31 V44 L46 P198 N199 K204 L205 L206	F31-L202 HydrophobicContact CB-CD1 3.84Å; F31-L202 HydrophobicContact CD1-CD1 4.22Å; F31-L202 HydrophobicContact CD2-CD2 4.42Å; F31-L202 HydrophobicContact CG-CD1 3.98Å; V44-L202 HydrophobicContact CG1-CD2 4.36Å; V44-L202 HydrophobicContact CG2-CD1 4.35Å; L46-L202 HydrophobicContact CD2-CD2 4.49Å; P198-L202 HydrophobicContact CB-CB 3.78Å; P198-L202 HydrophobicContact CB-CD1 4.01Å; P198-L202 HydrophobicContact CG-CB 3.76Å; N199-L202 PolarHBondContact O-N 2.96Å; N199-L202 PolarHBondContact OD1-N 2.94Å; N199-L202 VanDerWaalsContact OD1-N 3.07Å; L202-K204 VanDerWaalsContact C-N 3.31Å; L202-K204 PolarHBondContact O-N 2.92Å; L202-L205 WeakPolarHBondContact O-CB 3.38Å; L202-L205 PolarHBondContact O-N 3.43Å; L202-L205 VanDerWaalsContact O-N 3.14Å; L202-L206 WeakPolarHBondContact O-CB 3.44Å; L202-L206 WeakPolarHBondContact O-CG 3.27Å; L202-L206 PolarHBondContact O-N 3.14Å
203	A	95.2	Very high	93	Very high	2 Å²	2	47.7 Å²	47.7	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-43.1	175.5	0	0	0	0	0	111.7	L191 N199 L205 L206 G207 F208	L191-A203 HydrophobicContact CD1-CB 4.16Å; L191-A203 VanDerWaalsContact CD1-O 3.28Å; L191-A203 WeakPolarHBondContact CD1-O 3.26Å; N199-A203 WeakPolarHBondContact O-CB 3.19Å; N199-A203 PolarHBondContact O-N 2.8Å; A203-L205 VanDerWaalsContact C-N 3.32Å; A203-L205 PolarHBondContact O-N 3.32Å; A203-L206 PolarHBondContact O-N 3.25Å; A203-G207 PolarHBondContact O-N 3.41Å; A203-F208 WeakPolarHBondContact CA-O 3.41Å; A203-F208 PolarHBondContact O-N 2.84Å
204	K	93.9	Very high	93.2	Very high	176 Å²	176	49.4 Å²	49.4	77%	0.765	29%	0.285	S	S	*	.	H	α-helix	trans	-62.3	-38	175.5	-174.4	179.5	179.4	-175.8	0	112.5	A200 L202	A200-K204 WeakPolarHBondContact O-CB 3.21Å; A200-K204 PolarHBondContact O-N 3.3Å; L202-K204 VanDerWaalsContact C-N 3.31Å; L202-K204 PolarHBondContact O-N 2.92Å
205	L	92.8	Very high	93.2	Very high	94 Å²	94	42.4 Å²	42.4	49%	0.492	26%	0.258	S	S	.	.	H	α-helix	trans	-68.1	-40.4	176.5	179.7	64.7	0	0	0	112	L46 S201 L202 A203	L46-L205 HydrophobicContact CD2-CD2 3.7Å; S201-L205 PolarHBondContact O-N 3.45Å; L202-L205 WeakPolarHBondContact O-CB 3.38Å; L202-L205 PolarHBondContact O-N 3.43Å; L202-L205 VanDerWaalsContact O-N 3.14Å; A203-L205 VanDerWaalsContact C-N 3.32Å; A203-L205 PolarHBondContact O-N 3.32Å
206	L	94.8	Very high	93	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-77	-29.2	-179.5	-70.3	169.9	0	0	0	113	V44 C52 C54 P170 P198 L202 A203 F208	V44-L206 HydrophobicContact CG1-CD1 4.17Å; V44-L206 HydrophobicContact CG1-CD2 4.36Å; V44-L206 HydrophobicContact CG2-CD1 4.09Å; C52-L206 HydrophobicContact CB-CD2 3.81Å; C54-L206 HydrophobicContact CB-CD1 4.02Å; C54-L206 HydrophobicContact CB-CD2 4.27Å; P170-L206 WeakPolarHBondContact CA-O 3.37Å; P170-L206 WeakPolarHBondContact CB-O 3.31Å; P170-L206 WeakPolarHBondContact CG-O 3.47Å; P198-L206 HydrophobicContact CG-CD1 3.79Å; L202-L206 WeakPolarHBondContact O-CB 3.44Å; L202-L206 WeakPolarHBondContact O-CG 3.27Å; L202-L206 PolarHBondContact O-N 3.14Å; A203-L206 PolarHBondContact O-N 3.25Å; L206-F208 VanDerWaalsContact C-N 3.3Å; L206-F208 HydrophobicContact CB-CD1 4.03Å; L206-F208 HydrophobicContact CB-CD2 4.42Å; L206-F208 HydrophobicContact CB-CE1 3.75Å; L206-F208 HydrophobicContact CB-CE2 4.17Å; L206-F208 HydrophobicContact CB-CG 4.36Å; L206-F208 HydrophobicContact CB-CZ 3.83Å; L206-F208 HydrophobicContact CD1-CE2 4.09Å; L206-F208 HydrophobicContact CD1-CZ 4.17Å; L206-F208 HydrophobicContact CD2-CE1 4.34Å; L206-F208 HydrophobicContact CD2-CZ 3.97Å; L206-F208 HydrophobicContact CG-CZ 4.21Å; L206-F208 WeakPolarHBondContact O-CD1 3.49Å; L206-F208 WeakPolarHBondContact O-CE1 3.17Å
207	G	95.2	Very high	92.7	Very high	30 Å²	30	44 Å²	44	31%	0.309	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	8.3	-173.5	0	0	0	0	0	114.1	K69 A203	K69-G207 PolarHBondContact N-O 2.99Å; A203-G207 PolarHBondContact O-N 3.41Å
208	F	96.7	Very high	92.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	160.5	177.6	57.1	-93.7	0	0	0	112.1	C54 Y67 K69 A70 F168 A203 L206 F210	C54-F208 HydrophobicContact CB-CE2 3.89Å; C54-F208 HydrophobicContact CB-CZ 3.88Å; Y67-F208 CarbonylContact O-C 3.49Å; Y67-F208 WeakPolarHBondContact O-CA 3.42Å; Y67-F208 VanDerWaalsContact O-CB 3.24Å; Y67-F208 WeakPolarHBondContact O-CB 3.41Å; K69-F208 WeakPolarHBondContact O-CD1 3.34Å; A70-F208 HydrophobicContact CB-CB 4.11Å; A70-F208 HydrophobicContact CB-CD1 3.51Å; A70-F208 HydrophobicContact CB-CD2 4.36Å; A70-F208 HydrophobicContact CB-CE1 3.96Å; A70-F208 HydrophobicContact CB-CG 3.74Å; F168-F208 HydrophobicContact CB-CE1 4.35Å; F168-F208 HydrophobicContact CB-CE2 3.67Å; F168-F208 HydrophobicContact CB-CZ 3.49Å; F168-F208 VanDerWaalsContact CB-CZ 3.49Å; F168-F208 HydrophobicContact CG-CE2 4.34Å; A203-F208 WeakPolarHBondContact CA-O 3.41Å; A203-F208 PolarHBondContact O-N 2.84Å; L206-F208 VanDerWaalsContact C-N 3.3Å; L206-F208 HydrophobicContact CB-CD1 4.03Å; L206-F208 HydrophobicContact CB-CD2 4.42Å; L206-F208 HydrophobicContact CB-CE1 3.75Å; L206-F208 HydrophobicContact CB-CE2 4.17Å; L206-F208 HydrophobicContact CB-CG 4.36Å; L206-F208 HydrophobicContact CB-CZ 3.83Å; L206-F208 HydrophobicContact CD1-CE2 4.09Å; L206-F208 HydrophobicContact CD1-CZ 4.17Å; L206-F208 HydrophobicContact CD2-CE1 4.34Å; L206-F208 HydrophobicContact CD2-CZ 3.97Å; L206-F208 HydrophobicContact CG-CZ 4.21Å; L206-F208 WeakPolarHBondContact O-CD1 3.49Å; L206-F208 WeakPolarHBondContact O-CE1 3.17Å; F208-F210 AromaticContact CD2-CE2 3.51Å; F208-F210 HydrophobicContact CD2-CE2 3.51Å; F208-F210 AromaticContact CD2-CZ 3.62Å; F208-F210 HydrophobicContact CD2-CZ 3.62Å; F208-F210 AromaticContact CE2-CE2 3.62Å; F208-F210 HydrophobicContact CE2-CE2 3.62Å; F208-F210 AromaticContact CE2-CZ 3.79Å; F208-F210 HydrophobicContact CE2-CZ 3.79Å
209	T	96.7	Very high	92	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	165.1	174.4	-163.4	0	0	0	0	110.9	Y67 L191 P192 T196 V197	Y67-T209 HydrophobicContact CD2-CG2 4.46Å; Y67-T209 PolarHBondContact N-O 3.07Å; Y67-T209 PolarHBondContact O-N 2.86Å; L191-T209 HydrophobicContact CB-CG2 4.21Å; L191-T209 HydrophobicContact CD2-CG2 4.47Å; P192-T209 HydrophobicContact CG-CG2 4.28Å; T196-T209 VanDerWaalsContact CB-OG1 3.26Å; T196-T209 WeakPolarHBondContact CB-OG1 3.48Å; T196-T209 HydrophobicContact CG2-CG2 3.99Å; T196-T209 PolarHBondContact OG1-OG1 3.05Å; V197-T209 PolarHBondContact O-OG1 3.2Å; V197-T209 VanDerWaalsContact O-OG1 3.13Å
210	F	96.4	Very high	91.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.7	-176.5	-55.5	-86.8	0	0	0	111.1	F35 I42 I56 A65 V66 F168 T196 V197 F208	F35-F210 HydrophobicContact CE1-CB 4.16Å; F35-F210 HydrophobicContact CZ-CB 3.81Å; I42-F210 HydrophobicContact CD1-CB 4.35Å; I42-F210 HydrophobicContact CD1-CD2 3.53Å; I42-F210 HydrophobicContact CD1-CE2 4.21Å; I42-F210 HydrophobicContact CD1-CG 4.21Å; I56-F210 HydrophobicContact CD1-CD1 3.8Å; I56-F210 HydrophobicContact CD1-CD2 3.94Å; I56-F210 HydrophobicContact CD1-CE1 3.48Å; I56-F210 VanDerWaalsContact CD1-CE1 3.48Å; I56-F210 HydrophobicContact CD1-CE2 3.63Å; I56-F210 HydrophobicContact CD1-CG 4.03Å; I56-F210 HydrophobicContact CD1-CZ 3.41Å; I56-F210 VanDerWaalsContact CD1-CZ 3.41Å; A65-F210 CarbonylContact O-C 3.39Å; A65-F210 VanDerWaalsContact O-CA 3.25Å; A65-F210 WeakPolarHBondContact O-CA 3.43Å; V66-F210 HydrophobicContact CB-CD1 4.44Å; V66-F210 HydrophobicContact CB-CE1 4.35Å; V66-F210 HydrophobicContact CG1-CD1 4.41Å; V66-F210 HydrophobicContact CG1-CE1 3.97Å; V66-F210 HydrophobicContact CG2-CD1 3.94Å; V66-F210 HydrophobicContact CG2-CE1 3.79Å; F168-F210 HydrophobicContact CD1-CE1 4.21Å; F168-F210 AromaticContact CD1-CZ 3.77Å; F168-F210 HydrophobicContact CD1-CZ 3.77Å; F168-F210 HydrophobicContact CD2-CZ 4.13Å; F168-F210 AromaticContact CE1-CE1 3.83Å; F168-F210 HydrophobicContact CE1-CE1 3.83Å; F168-F210 AromaticContact CE1-CZ 3.87Å; F168-F210 HydrophobicContact CE1-CZ 3.87Å; F168-F210 HydrophobicContact CE2-CE1 4.35Å; F168-F210 HydrophobicContact CE2-CZ 4.24Å; F168-F210 AromaticContact CG-CZ 3.92Å; F168-F210 HydrophobicContact CG-CZ 3.92Å; F168-F210 AromaticContact CZ-CE1 3.93Å; F168-F210 HydrophobicContact CZ-CE1 3.93Å; F168-F210 HydrophobicContact CZ-CZ 4.13Å; T196-F210 CarbonylContact C-O 3.57Å; T196-F210 WeakPolarHBondContact CA-O 3.19Å; T196-F210 VanDerWaalsContact CB-O 3.32Å; T196-F210 WeakPolarHBondContact CB-O 3.34Å; V197-F210 PolarHBondContact N-O 3.16Å; V197-F210 WeakPolarHBondContact O-CB 3.48Å; V197-F210 WeakPolarHBondContact O-CD2 3.5Å; V197-F210 PolarHBondContact O-N 3.04Å; F208-F210 AromaticContact CD2-CE2 3.51Å; F208-F210 HydrophobicContact CD2-CE2 3.51Å; F208-F210 AromaticContact CD2-CZ 3.62Å; F208-F210 HydrophobicContact CD2-CZ 3.62Å; F208-F210 AromaticContact CE2-CE2 3.62Å; F208-F210 HydrophobicContact CE2-CE2 3.62Å; F208-F210 AromaticContact CE2-CZ 3.79Å; F208-F210 HydrophobicContact CE2-CZ 3.79Å
211	L	94.2	Very high	91.5	Very high	43 Å²	43	48.4 Å²	48.4	23%	0.225	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.2	171.1	179.5	64.3	0	0	0	108.6	A65 Y67 G195 T196 L217	A65-L211 HydrophobicContact CB-CB 4.39Å; A65-L211 PolarHBondContact N-O 3.4Å; A65-L211 PolarHBondContact O-N 2.83Å; Y67-L211 HydrophobicContact CE2-CB 3.84Å; Y67-L211 HydrophobicContact CE2-CD2 4.35Å; G195-L211 WeakPolarHBondContact O-CD1 3.41Å; T196-L211 HydrophobicContact CG2-CB 4.23Å; T196-L211 HydrophobicContact CG2-CD1 4.4Å; L211-L217 HydrophobicContact CD2-CD2 3.91Å
212	E	93.8	Very high	91.2	Very high	39 Å²	39	45 Å²	45	18%	0.182	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	138.2	170.5	-178.6	172.1	-153.9	0	0	110.1	F35 S37 R39 H63 L64	F35-E212 WeakPolarHBondContact CB-OE2 3.45Å; F35-E212 HydrophobicContact CD1-CB 3.72Å; F35-E212 HydrophobicContact CE1-CB 4.22Å; S37-E212 WeakPolarHBondContact CB-OE1 3.44Å; S37-E212 WeakPolarHBondContact CB-OE2 3.46Å; S37-E212 PolarHBondContact N-OE2 3.01Å; S37-E212 PolarHBondContact OG-OE1 2.75Å; S37-E212 PolarHBondContact OG-OE2 3.01Å; S37-E212 VanDerWaalsContact OG-OE2 3.04Å; R39-E212 IonicContact NH2-OE1 2.84Å; H63-E212 WeakPolarHBondContact O-CA 3.28Å; L64-E212 HydrophobicContact CD2-CB 3.96Å; L64-E212 HydrophobicContact CD2-CG 4.4Å
213	H	91.6	Very high	90.9	Very high	20 Å²	20	49 Å²	49	9%	0.093	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	168.2	178.4	68.2	92.2	0	0	0	112.4	H63 S107 G215 L217	H63-H213 WeakPolarHBondContact CB-CE1 3.24Å; H63-H213 WeakPolarHBondContact CB-NE2 3.09Å; H63-H213 PolarHBondContact O-N 3.07Å; S107-H213 PolarHBondContact OG-CE1 3.39Å; S107-H213 PolarHBondContact OG-NE2 3.07Å; H213-G215 VanDerWaalsContact ND1-CA 3.32Å; H213-G215 WeakPolarHBondContact ND1-CA 3.49Å; H213-G215 PolarHBondContact ND1-N 3.29Å; H213-G215 PolarHBondContact O-N 3.13Å; H213-L217 HydrophobicContact CB-CB 4.01Å; H213-L217 HydrophobicContact CB-CD2 4.41Å; H213-L217 PolarHBondContact CE1-O 3.27Å; H213-L217 PolarHBondContact ND1-N 3.37Å; H213-L217 PolarHBondContact NE2-O 3.27Å
214	D	89.2	Confident	90.7	Very high	128 Å²	128	52.2 Å²	52.2	68%	0.684	29%	0.29	S	S	*	.	S	Bend	trans	-85.5	23.2	-176.5	64.1	-8.4	0	0	0	113.9	S216	D214-S216 VanDerWaalsContact C-N 3.27Å; D214-S216 PolarHBondContact O-N 3.15Å; D214-S216 WeakPolarHBondContact OD1-CB 3.26Å; D214-S216 PolarHBondContact OD1-N 2.88Å; D214-S216 PolarHBondContact OD1-OG 2.86Å
215	G	86.5	Confident	90.4	Very high	20 Å²	20	44 Å²	44	21%	0.206	26%	0.255	C	S	.	.	S	Bend	trans	80.2	-6.8	-171.6	0	0	0	0	0	115.3	H63 H213 L217 Q220	H63-G215 PolarHBondContact CD2-N 2.92Å; H213-G215 VanDerWaalsContact ND1-CA 3.32Å; H213-G215 WeakPolarHBondContact ND1-CA 3.49Å; H213-G215 PolarHBondContact ND1-N 3.29Å; H213-G215 PolarHBondContact O-N 3.13Å; G215-L217 VanDerWaalsContact C-N 3.32Å; G215-L217 PolarHBondContact O-N 2.87Å; G215-Q220 PolarHBondContact O-NE2 3.37Å; G215-Q220 PolarHBondContact O-OE1 2.9Å
216	S	85	Confident	90	Very high	81 Å²	81	42.5 Å²	42.5	57%	0.566	25%	0.252	S	S	*	.			trans	-77.6	-13.5	-180	68.1	0	0	0	0	115.3	D214 Q220	D214-S216 VanDerWaalsContact C-N 3.27Å; D214-S216 PolarHBondContact O-N 3.15Å; D214-S216 WeakPolarHBondContact OD1-CB 3.26Å; D214-S216 PolarHBondContact OD1-N 2.88Å; D214-S216 PolarHBondContact OD1-OG 2.86Å; S216-Q220 PolarHBondContact O-NE2 2.8Å
217	L	86.3	Confident	89.5	Confident	26 Å²	26	47.8 Å²	47.8	14%	0.136	28%	0.277	C	S	.	.	S	Bend	trans	-102.8	148.4	-178.1	-177.2	62.9	0	0	0	110.7	A65 P105 L211 H213 G215 Y444	A65-L217 HydrophobicContact CB-CD2 3.4Å; A65-L217 HydrophobicContact CB-CG 4.03Å; P105-L217 HydrophobicContact CG-CD1 3.71Å; P105-L217 HydrophobicContact CG-CD2 4.4Å; P105-L217 HydrophobicContact CG-CG 3.96Å; L211-L217 HydrophobicContact CD2-CD2 3.91Å; H213-L217 HydrophobicContact CB-CB 4.01Å; H213-L217 HydrophobicContact CB-CD2 4.41Å; H213-L217 PolarHBondContact CE1-O 3.27Å; H213-L217 PolarHBondContact ND1-N 3.37Å; H213-L217 PolarHBondContact NE2-O 3.27Å; G215-L217 VanDerWaalsContact C-N 3.32Å; G215-L217 PolarHBondContact O-N 2.87Å; L217-Y444 HydrophobicContact CD1-CD2 4.43Å; L217-Y444 HydrophobicContact CD1-CE2 3.62Å
218	G	86.1	Confident	89.3	Confident	10 Å²	10	46.3 Å²	46.3	10%	0.103	26%	0.262	C	S	.	.	S	Bend	trans	95.5	-171.4	-175.8	0	0	0	0	0	113.2	T104 P105 Q220	T104-G218 WeakPolarHBondContact CG2-O 3.43Å; P105-G218 WeakPolarHBondContact O-CA 3.48Å; G218-Q220 PolarHBondContact O-N 2.96Å
219	Y	87.6	Confident	88.6	Confident	55 Å²	55	47 Å²	47	22%	0.216	27%	0.267	C	S	.	.			trans	-70.9	119	177.2	-178	-100	0	0	0	110.4	W83 V221 F264	W83-Y219 HydrophobicContact CD2-CG 4.22Å; W83-Y219 AromaticContact CE2-CD2 3.88Å; W83-Y219 AromaticContact CE2-CG 3.8Å; W83-Y219 HydrophobicContact CH2-CD2 4.37Å; W83-Y219 AromaticContact CZ2-CD2 3.7Å; W83-Y219 HydrophobicContact CZ2-CD2 3.7Å; W83-Y219 HydrophobicContact CZ2-CG 4.02Å; W83-Y219 AromaticContact NE1-CG 3.94Å; Y219-V221 HydrophobicContact CD1-CG2 3.98Å; Y219-V221 HydrophobicContact CE1-CG2 3.97Å; Y219-F264 AromaticContact CD1-CD2 3.59Å; Y219-F264 HydrophobicContact CD1-CD2 3.59Å; Y219-F264 HydrophobicContact CD1-CE2 4.2Å; Y219-F264 HydrophobicContact CD1-CG 4.36Å; Y219-F264 HydrophobicContact CE1-CB 3.89Å; Y219-F264 AromaticContact CE1-CD2 3.36Å; Y219-F264 HydrophobicContact CE1-CD2 3.36Å; Y219-F264 HydrophobicContact CE1-CE2 4.05Å; Y219-F264 AromaticContact CE1-CG 3.74Å; Y219-F264 HydrophobicContact CE1-CG 3.74Å
220	Q	86.9	Confident	87.8	Confident	109 Å²	109	53.1 Å²	53.1	51%	0.509	30%	0.299	S	S	.	.			trans	-91.6	135.5	178.5	-60.5	-60.7	-48.2	0	0	110	G215 S216 G218	G215-Q220 PolarHBondContact O-NE2 3.37Å; G215-Q220 PolarHBondContact O-OE1 2.9Å; S216-Q220 PolarHBondContact O-NE2 2.8Å; G218-Q220 PolarHBondContact O-N 2.96Å
221	V	86.1	Confident	87.2	Confident	72 Å²	72	56 Å²	56	44%	0.436	31%	0.311	S	S	.	.			trans	-105	125.2	-175.5	-174.8	0	0	0	0	109	Y219 V225 F264	Y219-V221 HydrophobicContact CD1-CG2 3.98Å; Y219-V221 HydrophobicContact CE1-CG2 3.97Å; V221-V225 HydrophobicContact CG1-CB 3.53Å; V221-V225 HydrophobicContact CG1-CG1 3.77Å; V221-V225 HydrophobicContact CG1-CG2 3.94Å; V221-F264 HydrophobicContact CG1-CE2 4.42Å; V221-F264 HydrophobicContact CG1-CZ 4.02Å; V221-F264 HydrophobicContact CG2-CD2 4.15Å; V221-F264 HydrophobicContact CG2-CE2 3.35Å; V221-F264 HydrophobicContact CG2-CZ 3.76Å
222	A	87.7	Confident	86.7	Confident	25 Å²	25	54 Å²	54	21%	0.207	30%	0.301	C	S	.	.			trans	-72.7	147.9	174.5	0	0	0	0	0	110.5	E224 V225 I437	A222-E224 VanDerWaalsContact CB-OE2 3.28Å; A222-E224 WeakPolarHBondContact CB-OE2 3.43Å; A222-E224 PolarHBondContact O-N 2.86Å; A222-E224 VanDerWaalsContact O-N 3.11Å; A222-V225 HydrophobicContact CB-CG2 4.33Å; A222-V225 WeakPolarHBondContact O-CB 3.32Å; A222-V225 WeakPolarHBondContact O-CG2 3.17Å; A222-V225 PolarHBondContact O-N 2.71Å; A222-I437 HydrophobicContact CB-CG2 3.64Å
223	P	87.3	Confident	85.7	Confident	98 Å²	98	54.7 Å²	54.7	64%	0.636	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-34.3	-179	-26.5	34.8	0	0	0	113.7	V225 S226	P223-V225 PolarHBondContact O-N 3.42Å; P223-S226 WeakPolarHBondContact O-CB 3.48Å; P223-S226 PolarHBondContact O-N 2.88Å; P223-S226 VanDerWaalsContact O-N 3.14Å; P223-S226 PolarHBondContact O-OG 2.81Å
224	E	90.3	Very high	84.5	Confident	70 Å²	70	55.7 Å²	55.7	33%	0.327	32%	0.319	S	S	.	.	H	α-helix	trans	-62.5	-25.6	-179.9	-60.3	80.6	-175.1	0	0	112.7	A222 S226 H227 I228 I435 I437	A222-E224 VanDerWaalsContact CB-OE2 3.28Å; A222-E224 WeakPolarHBondContact CB-OE2 3.43Å; A222-E224 PolarHBondContact O-N 2.86Å; A222-E224 VanDerWaalsContact O-N 3.11Å; E224-S226 PolarHBondContact O-N 2.83Å; E224-H227 WeakPolarHBondContact O-CB 3.41Å; E224-H227 PolarHBondContact O-N 2.89Å; E224-H227 VanDerWaalsContact O-N 3.1Å; E224-I228 PolarHBondContact O-N 2.72Å; E224-I435 HydrophobicContact CB-CG2 4.02Å; E224-I437 HydrophobicContact CB-CG1 4.12Å
225	V	87.4	Confident	83	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-24.6	178.3	-177.3	0	0	0	0	112	V221 A222 P223 H227 I228 S229 L261 F264 I437	V221-V225 HydrophobicContact CG1-CB 3.53Å; V221-V225 HydrophobicContact CG1-CG1 3.77Å; V221-V225 HydrophobicContact CG1-CG2 3.94Å; A222-V225 HydrophobicContact CB-CG2 4.33Å; A222-V225 WeakPolarHBondContact O-CB 3.32Å; A222-V225 WeakPolarHBondContact O-CG2 3.17Å; A222-V225 PolarHBondContact O-N 2.71Å; P223-V225 PolarHBondContact O-N 3.42Å; V225-H227 VanDerWaalsContact C-N 3.33Å; V225-I228 PolarHBondContact O-N 3.34Å; V225-S229 PolarHBondContact O-N 2.8Å; V225-S229 PolarHBondContact O-OG 3.48Å; V225-L261 HydrophobicContact CG2-CD1 4.41Å; V225-F264 HydrophobicContact CG1-CD1 3.97Å; V225-F264 HydrophobicContact CG1-CE1 3.43Å; V225-F264 VanDerWaalsContact CG1-CE1 3.43Å; V225-F264 HydrophobicContact CG1-CZ 4.14Å; V225-I437 HydrophobicContact CG2-CD1 3.84Å
226	S	84.3	Confident	81.3	Confident	62 Å²	62	56 Å²	56	43%	0.434	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-40.9	172	66.9	0	0	0	0	111.6	P223 E224 I228 S229 L230	P223-S226 WeakPolarHBondContact O-CB 3.48Å; P223-S226 PolarHBondContact O-N 2.88Å; P223-S226 VanDerWaalsContact O-N 3.14Å; P223-S226 PolarHBondContact O-OG 2.81Å; E224-S226 PolarHBondContact O-N 2.83Å; S226-I228 VanDerWaalsContact C-N 3.35Å; S226-I228 PolarHBondContact O-N 2.84Å; S226-S229 WeakPolarHBondContact O-CB 3.25Å; S226-S229 PolarHBondContact O-N 3.38Å; S226-L230 WeakPolarHBondContact O-CG 3.34Å; S226-L230 PolarHBondContact O-N 3.34Å
227	H	85.3	Confident	79.3	Confident	112 Å²	112	57.2 Å²	57.2	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-39.3	176.2	-60.5	85.6	0	0	0	111.6	E224 V225 S229 L230 K231	E224-H227 WeakPolarHBondContact O-CB 3.41Å; E224-H227 PolarHBondContact O-N 2.89Å; E224-H227 VanDerWaalsContact O-N 3.1Å; V225-H227 VanDerWaalsContact C-N 3.33Å; H227-S229 VanDerWaalsContact C-N 3.32Å; H227-S229 PolarHBondContact O-N 3.41Å; H227-L230 PolarHBondContact O-N 3.37Å; H227-K231 PolarHBondContact O-N 3Å
228	I	89.5	Confident	77.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-60.4	-45.8	173.6	-60	171.6	0	0	0	110	E224 V225 S226 L230 K231 L232 L248 L265 L390 V392 I435 I437	E224-I228 PolarHBondContact O-N 2.72Å; V225-I228 PolarHBondContact O-N 3.34Å; S226-I228 VanDerWaalsContact C-N 3.35Å; S226-I228 PolarHBondContact O-N 2.84Å; I228-L230 VanDerWaalsContact C-N 3.35Å; I228-L230 PolarHBondContact O-N 3.35Å; I228-K231 PolarHBondContact O-N 2.79Å; I228-L232 HydrophobicContact CG2-CD1 3.87Å; I228-L232 HydrophobicContact CG2-CG 4.33Å; I228-L232 WeakPolarHBondContact O-CG 3.31Å; I228-L232 PolarHBondContact O-N 3.37Å; I228-L248 HydrophobicContact CG2-CD1 3.81Å; I228-L265 HydrophobicContact CG2-CD1 4.38Å; I228-L265 HydrophobicContact CG2-CD2 3.75Å; I228-L390 HydrophobicContact CG1-CD2 4.47Å; I228-L390 HydrophobicContact CG2-CD2 4.25Å; I228-V392 HydrophobicContact CD1-CB 4.43Å; I228-V392 HydrophobicContact CD1-CG1 3.88Å; I228-V392 HydrophobicContact CD1-CG2 3.62Å; I228-V392 HydrophobicContact CG1-CG2 4.31Å; I228-I435 HydrophobicContact CD1-CG2 4.34Å; I228-I435 HydrophobicContact CG1-CD1 3.68Å; I228-I435 HydrophobicContact CG1-CG2 4.36Å; I228-I437 HydrophobicContact CD1-CD1 3.86Å
229	S	81.7	Confident	75.1	Confident	15 Å²	15	65.7 Å²	65.7	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-61	-43.6	179.9	-56.7	0	0	0	0	111.4	V225 S226 H227 L232 S233	V225-S229 PolarHBondContact O-N 2.8Å; V225-S229 PolarHBondContact O-OG 3.48Å; S226-S229 WeakPolarHBondContact O-CB 3.25Å; S226-S229 PolarHBondContact O-N 3.38Å; H227-S229 VanDerWaalsContact C-N 3.32Å; H227-S229 PolarHBondContact O-N 3.41Å; S229-L232 PolarHBondContact O-N 2.98Å; S229-S233 PolarHBondContact O-N 3.45Å; S229-S233 PolarHBondContact O-OG 3.25Å; S229-S233 VanDerWaalsContact O-OG 3.09Å
230	L	80.9	Confident	72.9	Confident	128 Å²	128	68.5 Å²	68.5	67%	0.67	41%	0.408	S	S	*	.	H	α-helix	trans	-61	-45	175.7	-70.9	172.1	0	0	0	112.3	S226 H227 I228 L232 S233 S234	S226-L230 WeakPolarHBondContact O-CG 3.34Å; S226-L230 PolarHBondContact O-N 3.34Å; H227-L230 PolarHBondContact O-N 3.37Å; I228-L230 VanDerWaalsContact C-N 3.35Å; I228-L230 PolarHBondContact O-N 3.35Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.5Å; L230-S233 PolarHBondContact O-N 3.01Å; L230-S234 PolarHBondContact O-N 3.06Å
231	K	84.1	Confident	71	Confident	60 Å²	60	72.9 Å²	72.9	26%	0.261	42%	0.42	S	S	.	.	H	α-helix	trans	-62.6	-38.5	176.7	-74.8	-168.3	173.6	-168	0	112.2	H227 I228 S234 V245 D433	H227-K231 PolarHBondContact O-N 3Å; I228-K231 PolarHBondContact O-N 2.79Å; K231-S234 PolarHBondContact O-OG 3.04Å; K231-V245 HydrophobicContact CB-CG2 3.89Å; K231-V245 HydrophobicContact CD-CG2 4.4Å; K231-D433 IonicContact NZ-OD2 3.82Å; K231-D433 PolarHBondContact NZ-OD2 2.89Å
232	L	82.6	Confident	69.4	Low	2 Å²	2	77.7 Å²	77.7	1%	0.01	44%	0.443	C	S	.	.	H	α-helix	trans	-69.5	-35.9	176.7	-72.8	171.2	0	0	0	112.5	I228 S229 L230 S234 V245 L248 L265 I269 V273 R362	I228-L232 HydrophobicContact CG2-CD1 3.87Å; I228-L232 HydrophobicContact CG2-CG 4.33Å; I228-L232 WeakPolarHBondContact O-CG 3.31Å; I228-L232 PolarHBondContact O-N 3.37Å; S229-L232 PolarHBondContact O-N 2.98Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.5Å; L232-S234 VanDerWaalsContact C-N 3.26Å; L232-S234 PolarHBondContact O-N 2.95Å; L232-V245 HydrophobicContact CD2-CB 4.3Å; L232-V245 HydrophobicContact CD2-CG1 4.04Å; L232-L248 HydrophobicContact CD1-CD1 4.4Å; L232-L248 HydrophobicContact CD2-CD1 4.32Å; L232-L265 HydrophobicContact CD1-CD2 4.07Å; L232-I269 HydrophobicContact CD1-CD1 4.11Å; L232-I269 HydrophobicContact CD1-CG1 4.01Å; L232-I269 HydrophobicContact CD2-CD1 4.17Å; L232-I269 HydrophobicContact CD2-CG1 4.47Å; L232-V273 WeakPolarHBondContact O-CG1 3.48Å; L232-R362 PolarHBondContact O-NE 3.15Å; L232-R362 PolarHBondContact O-NH2 3.42Å
233	S	73.2	Confident	68	Low	53 Å²	53	81.9 Å²	81.9	37%	0.371	46%	0.462	S	S	.	.	H	α-helix	trans	-76.4	-8.1	-178.4	-63.2	0	0	0	0	114.5	S229 L230 V235	S229-S233 PolarHBondContact O-N 3.45Å; S229-S233 PolarHBondContact O-OG 3.25Å; S229-S233 VanDerWaalsContact O-OG 3.09Å; L230-S233 PolarHBondContact O-N 3.01Å; S233-V235 PolarHBondContact O-N 3.3Å
234	S	66	Low	67.2	Low	41 Å²	41	78.2 Å²	78.2	29%	0.287	44%	0.439	S	S	.	.			trans	-62.2	121.3	177.1	65.4	0	0	0	0	110.6	L230 K231 L232	L230-S234 PolarHBondContact O-N 3.06Å; K231-S234 PolarHBondContact O-OG 3.04Å; L232-S234 VanDerWaalsContact C-N 3.26Å; L232-S234 PolarHBondContact O-N 2.95Å
235	V	58	Low	67.1	Low	81 Å²	81	75.1 Å²	75.1	49%	0.491	43%	0.425	S	S	.	.			trans	-80.7	130.1	177.1	-180	0	0	0	0	108.3	S233 V237	S233-V235 PolarHBondContact O-N 3.3Å; V235-V237 VanDerWaalsContact C-N 3.33Å; V235-V237 PolarHBondContact O-N 3.06Å
236	P	50.6	Low	67.2	Low	73 Å²	73	81.1 Å²	81.1	47%	0.474	45%	0.447	S	S	.	.			trans	-70.3	90.5	173.8	27.2	-31	0	0	0	109.4	V238	P236-V238 PolarHBondContact O-N 3.5Å; P236-V238 VanDerWaalsContact O-N 3.1Å
237	V	42.5	Very low	67.7	Low	106 Å²	106	80 Å²	80	64%	0.642	43%	0.434	S	S	*	.			trans	-74.8	97.6	174.2	-179.3	0	0	0	0	108.9	V235 A239	V235-V237 VanDerWaalsContact C-N 3.33Å; V235-V237 PolarHBondContact O-N 3.06Å; V237-A239 PolarHBondContact O-N 3.14Å
238	V	44.5	Very low	68.3	Low	156 Å²	156	74.7 Å²	74.7	95%	0.945	41%	0.41	S	S	*	.	S	Bend	trans	48.2	-10.8	159.3	-171	0	0	0	0	119.1	P236	P236-V238 PolarHBondContact O-N 3.5Å; P236-V238 VanDerWaalsContact O-N 3.1Å
239	A	40.1	Very low	68.7	Low	58 Å²	58	74.7 Å²	74.7	48%	0.479	41%	0.41	S	S	.	.	S	Bend	trans	-131.5	144.2	170	0	0	0	0	0	107.8	V237 R241	V237-A239 PolarHBondContact O-N 3.14Å; A239-R241 VanDerWaalsContact C-N 3.32Å; A239-R241 PolarHBondContact O-N 3.18Å
240	P	42.4	Very low	69.4	Low	115 Å²	115	74 Å²	74	75%	0.747	41%	0.405	S	S	*	.			trans	-66.9	96.2	173.9	28.9	-30	0	0	0	107.4
241	R	46.1	Very low	70.2	Confident	200 Å²	200	67.9 Å²	67.9	76%	0.755	37%	0.373	S	S	*	.			trans	-72.9	134.7	156.9	-70.8	-168.7	179.3	-156.4	1.1	107	A239 D243 C244	A239-R241 VanDerWaalsContact C-N 3.32Å; A239-R241 PolarHBondContact O-N 3.18Å; R241-D243 PolarHBondContact O-N 3.33Å; R241-C244 PolarHBondContact O-N 2.84Å
242	D	52	Low	70.6	Confident	174 Å²	174	65 Å²	65	93%	0.93	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-11.8	176.6	-80.5	-35.1	0	0	0	113.7
243	D	58.3	Low	71	Confident	113 Å²	113	65.6 Å²	65.6	60%	0.604	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-5.4	-175.7	-81.2	-28.9	0	0	0	115.9	R241 V245	R241-D243 PolarHBondContact O-N 3.33Å; D243-V245 PolarHBondContact O-N 2.87Å
244	C	72.4	Confident	71.8	Confident	21 Å²	21	69.4 Å²	69.4	14%	0.142	37%	0.374	C	S	.	.			trans	-81.1	105.4	-177.5	179.5	0	0	0	0	111.5	R241 R246	R241-C244 PolarHBondContact O-N 2.84Å; C244-R246 PolarHBondContact O-N 2.81Å; C244-R246 VanDerWaalsContact O-N 3.15Å
245	V	86.6	Confident	72.8	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.03	39%	0.385	C	S	.	.			trans	-71.9	108.3	177.4	-179.4	0	0	0	0	110.7	K231 L232 D243 L248 R362 D389 L390	K231-V245 HydrophobicContact CB-CG2 3.89Å; K231-V245 HydrophobicContact CD-CG2 4.4Å; L232-V245 HydrophobicContact CD2-CB 4.3Å; L232-V245 HydrophobicContact CD2-CG1 4.04Å; D243-V245 PolarHBondContact O-N 2.87Å; V245-L248 HydrophobicContact CG1-CB 4.17Å; V245-R362 PolarHBondContact O-NE 3.45Å; V245-D389 HydrophobicContact CG1-CB 4.48Å; V245-L390 HydrophobicContact CG1-CB 3.86Å; V245-L390 HydrophobicContact CG1-CD2 4.42Å; V245-L390 HydrophobicContact CG2-CB 4.1Å; V245-L390 HydrophobicContact CG2-CD2 4.38Å
246	R	90.1	Very high	74.4	Confident	129 Å²	129	66.1 Å²	66.1	49%	0.487	36%	0.362	S	S	.	.			trans	-99.2	-38	173.1	-56.3	-169.2	-155.9	175.6	8.1	112	C244 R362 L363 D389	C244-R246 PolarHBondContact O-N 2.81Å; C244-R246 VanDerWaalsContact O-N 3.15Å; R246-R362 CarbonylContact O-C 3.51Å; R246-R362 VanDerWaalsContact O-CA 3.26Å; R246-R362 WeakPolarHBondContact O-CA 3.31Å; R246-L363 PolarHBondContact O-N 2.91Å; R246-D389 WeakPolarHBondContact CA-OD2 3.37Å; R246-D389 WeakPolarHBondContact CB-OD2 3.39Å; R246-D389 PolarHBondContact N-OD2 2.79Å
247	K	95.2	Very high	76.3	Confident	38 Å²	38	63.8 Å²	63.8	17%	0.165	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.3	-177.7	-62.5	176.9	-67.6	177	0	109.5	Y353 L363 V386 K387 D389 L390	K247-Y353 HydrophobicContact CD-CE1 4.4Å; K247-L363 WeakPolarHBondContact CA-O 3.48Å; K247-L363 HydrophobicContact CG-CB 4.13Å; K247-L363 HydrophobicContact CG-CD2 4.26Å; K247-V386 HydrophobicContact CD-CG1 4.37Å; K247-V386 WeakPolarHBondContact CD-O 3.44Å; K247-V386 WeakPolarHBondContact CE-O 3.4Å; K247-V386 PolarHBondContact NZ-O 2.89Å; K247-K387 WeakPolarHBondContact CE-O 3.36Å; K247-K387 PolarHBondContact NZ-O 2.85Å; K247-D389 PolarHBondContact N-OD2 2.84Å; K247-D389 PolarHBondContact O-N 3.44Å; K247-L390 PolarHBondContact O-N 3.4Å
248	L	97	Very high	78.8	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.4	179.5	-173.6	162.8	0	0	0	109.4	I228 L232 V245 I250 L265 L363 L364 V365 L390 V392	I228-L248 HydrophobicContact CG2-CD1 3.81Å; L232-L248 HydrophobicContact CD1-CD1 4.4Å; L232-L248 HydrophobicContact CD2-CD1 4.32Å; V245-L248 HydrophobicContact CG1-CB 4.17Å; L248-I250 HydrophobicContact CD2-CD1 4.18Å; L248-I250 HydrophobicContact CD2-CG1 3.44Å; L248-I250 VanDerWaalsContact CD2-CG1 3.44Å; L248-L265 HydrophobicContact CD1-CD1 4.01Å; L248-L265 HydrophobicContact CD2-CD1 4.02Å; L248-L363 PolarHBondContact N-O 2.69Å; L248-L364 HydrophobicContact CB-CD2 3.95Å; L248-L364 HydrophobicContact CD1-CD2 4.43Å; L248-L364 HydrophobicContact CD2-CD2 4.24Å; L248-L364 HydrophobicContact CG-CD2 4.45Å; L248-L364 CarbonylContact O-C 3.6Å; L248-L364 WeakPolarHBondContact O-CA 3.27Å; L248-V365 PolarHBondContact O-N 3.33Å; L248-L390 WeakPolarHBondContact CA-O 3.33Å; L248-L390 HydrophobicContact CD1-CD2 3.84Å; L248-L390 HydrophobicContact CD1-CG 4.49Å; L248-L390 HydrophobicContact CG-CB 4.4Å; L248-L390 HydrophobicContact CG-CD2 4.24Å; L248-L390 HydrophobicContact CG-CG 4.36Å; L248-V392 HydrophobicContact CD1-CG2 4.24Å; L248-V392 HydrophobicContact CD2-CG2 3.83Å; L248-V392 HydrophobicContact CG-CG2 4.13Å
249	L	98	Very high	81.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128.3	177.6	-178.2	149.9	0	0	0	110.6	C251 V365 T367 L379 I383 P388 L390 I391 V392	L249-C251 HydrophobicContact CD2-CB 3.88Å; L249-V365 HydrophobicContact CB-CB 4.24Å; L249-V365 HydrophobicContact CD1-CB 4.46Å; L249-V365 HydrophobicContact CD1-CG1 4.23Å; L249-V365 HydrophobicContact CG-CB 4.23Å; L249-V365 HydrophobicContact CG-CG1 4.36Å; L249-T367 HydrophobicContact CD1-CG2 4.13Å; L249-T367 HydrophobicContact CD2-CG2 3.86Å; L249-T367 HydrophobicContact CG-CG2 3.84Å; L249-L379 HydrophobicContact CD2-CD1 4.22Å; L249-I383 HydrophobicContact CD1-CG1 4.02Å; L249-P388 HydrophobicContact CB-CB 3.93Å; L249-P388 HydrophobicContact CB-CG 4.14Å; L249-L390 PolarHBondContact N-O 2.85Å; L249-I391 HydrophobicContact CD2-CG2 4.13Å; L249-I391 WeakPolarHBondContact O-CA 3.31Å; L249-V392 PolarHBondContact O-N 2.76Å
250	I	97.6	Very high	83.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.8	179.9	-54	171.5	0	0	0	108.9	L248 K258 L261 L262 L265 V365 T367 L394	L248-I250 HydrophobicContact CD2-CD1 4.18Å; L248-I250 HydrophobicContact CD2-CG1 3.44Å; L248-I250 VanDerWaalsContact CD2-CG1 3.44Å; I250-K258 HydrophobicContact CG2-CB 4.11Å; I250-K258 HydrophobicContact CG2-CG 4.15Å; I250-L261 HydrophobicContact CD1-CD2 4.44Å; I250-L261 HydrophobicContact CD1-CG 4.27Å; I250-L261 HydrophobicContact CG2-CD2 4.02Å; I250-L262 HydrophobicContact CD1-CB 3.98Å; I250-L262 HydrophobicContact CD1-CD1 4.12Å; I250-L265 HydrophobicContact CD1-CD1 4.08Å; I250-V365 PolarHBondContact N-O 3.12Å; I250-T367 WeakPolarHBondContact O-CG2 3.25Å; I250-T367 PolarHBondContact O-N 3.14Å; I250-T367 PolarHBondContact O-OG1 2.98Å; I250-T367 VanDerWaalsContact O-OG1 3.07Å; I250-L394 HydrophobicContact CG2-CD1 4.35Å
251	C	96.1	Very high	86.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	165.9	-179.4	72.4	0	0	0	0	112.3	L249 T367 M371 L379 V392 L394 L409	L249-C251 HydrophobicContact CD2-CB 3.88Å; C251-T367 WeakPolarHBondContact CA-OG1 3.32Å; C251-M371 HydrophobicContact CB-CE 4.41Å; C251-L379 HydrophobicContact CB-CD1 4.15Å; C251-L379 HydrophobicContact CB-CD2 4.08Å; C251-V392 PolarHBondContact N-O 3.1Å; C251-L394 PolarHBondContact O-N 3.32Å; C251-L409 WeakPolarHBondContact SG-CD1 3.49Å
252	G	93.9	Very high	88.6	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.			trans	145.7	165.9	-179.2	0	0	0	0	0	113.1	K258 M371 L394	G252-K258 WeakPolarHBondContact O-CD 3.35Å; G252-K258 PolarHBondContact O-NZ 3.29Å; G252-M371 PolarHBondContact N-SD 2.79Å; G252-L394 WeakPolarHBondContact CA-O 3.34Å
253	P	91.4	Very high	90.7	Very high	14 Å²	14	29.1 Å²	29.1	9%	0.091	16%	0.161	C	C	.	.	S	Bend	trans	-65.6	165.8	-173.6	27.1	-32.1	0	0	0	112	G255 A256 K258 M371 L394 L396	P253-G255 PolarHBondContact O-N 3.49Å; P253-A256 HydrophobicContact CG-CB 4.03Å; P253-A256 VanDerWaalsContact O-CB 3.28Å; P253-A256 WeakPolarHBondContact O-CB 3.5Å; P253-A256 PolarHBondContact O-N 3.34Å; P253-A256 VanDerWaalsContact O-N 3.17Å; P253-K258 PolarHBondContact O-NZ 3.14Å; P253-M371 HydrophobicContact CB-CG 4.12Å; P253-L394 WeakPolarHBondContact CD-O 3.36Å; P253-L396 HydrophobicContact CB-CD1 4.39Å; P253-L396 HydrophobicContact CG-CD1 3.88Å; P253-L396 HydrophobicContact CG-CG 3.86Å
254	K	88.8	Confident	92.5	Very high	133 Å²	133	24.4 Å²	24.4	58%	0.578	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	133.7	174	-174.8	177.9	-178.9	177.4	0	110.4	A256 G369	K254-A256 VanDerWaalsContact C-N 3.3Å; K254-A256 PolarHBondContact O-N 3.1Å; K254-G369 PolarHBondContact N-O 3.35Å; K254-G369 VanDerWaalsContact N-O 3.15Å
255	G	87.9	Confident	93.6	Very high	51 Å²	51	23.4 Å²	23.4	53%	0.526	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	0.7	179.5	0	0	0	0	0	115.1	P253 G257 V441	P253-G255 PolarHBondContact O-N 3.49Å; G255-G257 PolarHBondContact O-N 2.61Å; G255-V441 WeakPolarHBondContact O-CG2 3.48Å
256	A	90.3	Very high	94	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.008	13%	0.128	C	C	.	.	S	Bend	trans	-75.9	4.2	179	0	0	0	0	0	115.1	P253 K254 L394 L396 S439	P253-A256 HydrophobicContact CG-CB 4.03Å; P253-A256 VanDerWaalsContact O-CB 3.28Å; P253-A256 WeakPolarHBondContact O-CB 3.5Å; P253-A256 PolarHBondContact O-N 3.34Å; P253-A256 VanDerWaalsContact O-N 3.17Å; K254-A256 VanDerWaalsContact C-N 3.3Å; K254-A256 PolarHBondContact O-N 3.1Å; A256-L394 HydrophobicContact CB-CB 3.78Å; A256-L394 HydrophobicContact CB-CD1 4.44Å; A256-L394 WeakPolarHBondContact O-CD1 3.46Å; A256-L396 HydrophobicContact CB-CD2 4.07Å; A256-L396 HydrophobicContact CB-CG 4.44Å; A256-S439 VanDerWaalsContact O-CB 3.31Å; A256-S439 WeakPolarHBondContact O-CB 3.3Å; A256-S439 PolarHBondContact O-OG 3.11Å
257	G	91.7	Very high	94.2	Very high	25 Å²	25	17 Å²	17	26%	0.258	10%	0.104	S	C	.	.	S	Bend	trans	87.5	16.8	177.9	0	0	0	0	0	116.5	G255 S259 S260 L261	G255-G257 PolarHBondContact O-N 2.61Å; G257-S259 PolarHBondContact O-N 2.99Å; G257-S260 WeakPolarHBondContact O-CA 3.32Å; G257-S260 WeakPolarHBondContact O-CB 3.08Å; G257-S260 PolarHBondContact O-N 3.21Å; G257-L261 PolarHBondContact O-N 2.98Å
258	K	94.3	Very high	94	Very high	12 Å²	12	17 Å²	17	5%	0.052	10%	0.104	C	C	.	.	H	α-helix	trans	-48.9	-57.5	178.5	-66.4	-172.8	-64	-64.9	0	113.6	I250 G252 P253 S260 L261 L262 T367 L394	I250-K258 HydrophobicContact CG2-CB 4.11Å; I250-K258 HydrophobicContact CG2-CG 4.15Å; G252-K258 WeakPolarHBondContact O-CD 3.35Å; G252-K258 PolarHBondContact O-NZ 3.29Å; P253-K258 PolarHBondContact O-NZ 3.14Å; K258-S260 PolarHBondContact O-N 2.59Å; K258-L261 PolarHBondContact O-N 3.23Å; K258-L261 VanDerWaalsContact O-N 3.14Å; K258-L262 PolarHBondContact O-N 2.85Å; K258-T367 WeakPolarHBondContact CE-O 3.29Å; K258-L394 HydrophobicContact CB-CD1 4.33Å; K258-L394 HydrophobicContact CG-CD1 3.85Å
259	S	94.2	Very high	93.8	Very high	32 Å²	32	17 Å²	17	22%	0.224	10%	0.104	C	C	.	.	H	α-helix	trans	-63.6	-29.4	179.6	-40.5	0	0	0	0	112.5	G257 R263	G257-S259 PolarHBondContact O-N 2.99Å; S259-R263 WeakPolarHBondContact O-CG 3.17Å; S259-R263 PolarHBondContact O-N 2.9Å; S259-R263 VanDerWaalsContact O-N 3.11Å; S259-R263 PolarHBondContact O-NE 3.25Å; S259-R263 VanDerWaalsContact O-NE 3.1Å
260	S	94	Very high	93.4	Very high	25 Å²	25	17.5 Å²	17.5	18%	0.175	11%	0.107	C	C	.	.	H	α-helix	trans	-70.7	-40.8	175.3	-59.8	0	0	0	0	111.8	W83 G257 K258 R263 F264	W83-S260 PolarHBondContact NE1-O 2.84Å; W83-S260 VanDerWaalsContact NE1-O 3.17Å; G257-S260 WeakPolarHBondContact O-CA 3.32Å; G257-S260 WeakPolarHBondContact O-CB 3.08Å; G257-S260 PolarHBondContact O-N 3.21Å; K258-S260 PolarHBondContact O-N 2.59Å; S260-R263 PolarHBondContact O-N 3.08Å; S260-R263 PolarHBondContact OG-NH2 3.3Å; S260-F264 WeakPolarHBondContact O-CB 3.45Å; S260-F264 PolarHBondContact O-N 3.42Å
261	L	95.4	Very high	93	Very high	2 Å²	2	19 Å²	19	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-67.5	-39.9	173.8	179.9	63.1	0	0	0	111.3	V225 I250 G257 K258 R263 F264 L265 V392 L394 I437	V225-L261 HydrophobicContact CG2-CD1 4.41Å; I250-L261 HydrophobicContact CD1-CD2 4.44Å; I250-L261 HydrophobicContact CD1-CG 4.27Å; I250-L261 HydrophobicContact CG2-CD2 4.02Å; G257-L261 PolarHBondContact O-N 2.98Å; K258-L261 PolarHBondContact O-N 3.23Å; K258-L261 VanDerWaalsContact O-N 3.14Å; L261-R263 VanDerWaalsContact C-N 3.34Å; L261-R263 PolarHBondContact O-N 3.17Å; L261-F264 WeakPolarHBondContact O-CB 3.48Å; L261-F264 PolarHBondContact O-N 2.93Å; L261-L265 HydrophobicContact CD1-CD1 3.98Å; L261-L265 HydrophobicContact CD1-CD2 4.34Å; L261-L265 HydrophobicContact CD1-CG 3.86Å; L261-L265 HydrophobicContact CD2-CD1 4.34Å; L261-L265 HydrophobicContact CG-CD1 3.85Å; L261-L265 HydrophobicContact CG-CG 4.15Å; L261-L265 WeakPolarHBondContact O-CB 3.39Å; L261-L265 WeakPolarHBondContact O-CG 3.49Å; L261-L265 PolarHBondContact O-N 3.16Å; L261-V392 HydrophobicContact CD2-CB 4.35Å; L261-V392 HydrophobicContact CD2-CG1 3.64Å; L261-L394 HydrophobicContact CD2-CD1 4.48Å; L261-L394 HydrophobicContact CD2-CD2 4.01Å; L261-I437 HydrophobicContact CD2-CD1 4.42Å
262	L	96.3	Very high	92.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-54.3	-50.4	173.5	178.5	75.8	0	0	0	111.2	I250 K258 L265 S266 V284 E293 L364 N366	I250-L262 HydrophobicContact CD1-CB 3.98Å; I250-L262 HydrophobicContact CD1-CD1 4.12Å; K258-L262 PolarHBondContact O-N 2.85Å; L262-L265 PolarHBondContact O-N 3.06Å; L262-S266 VanDerWaalsContact O-CB 3.31Å; L262-S266 WeakPolarHBondContact O-CB 3.37Å; L262-S266 PolarHBondContact O-N 3.13Å; L262-S266 PolarHBondContact O-OG 3.36Å; L262-V284 HydrophobicContact CD1-CG1 3.9Å; L262-V284 HydrophobicContact CD2-CG1 4.11Å; L262-V284 HydrophobicContact CG-CG1 4.49Å; L262-E293 HydrophobicContact CD2-CB 4.2Å; L262-E293 HydrophobicContact CD2-CG 4.01Å; L262-L364 HydrophobicContact CD1-CB 3.6Å; L262-L364 HydrophobicContact CD1-CD1 3.99Å; L262-L364 HydrophobicContact CD1-CG 4.45Å; L262-N366 HydrophobicContact CD1-CB 4.39Å; L262-N366 HydrophobicContact CD2-CB 4.01Å
263	R	95.7	Very high	91.4	Very high	9 Å²	9	21.4 Å²	21.4	3%	0.034	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-46.1	176.2	-76.9	175.4	-87.5	141	-3.6	111.8	S259 S260 L261 S266 N267 E293 L309	S259-R263 WeakPolarHBondContact O-CG 3.17Å; S259-R263 PolarHBondContact O-N 2.9Å; S259-R263 VanDerWaalsContact O-N 3.11Å; S259-R263 PolarHBondContact O-NE 3.25Å; S259-R263 VanDerWaalsContact O-NE 3.1Å; S260-R263 PolarHBondContact O-N 3.08Å; S260-R263 PolarHBondContact OG-NH2 3.3Å; L261-R263 VanDerWaalsContact C-N 3.34Å; L261-R263 PolarHBondContact O-N 3.17Å; R263-S266 PolarHBondContact O-N 3.29Å; R263-N267 WeakPolarHBondContact O-CB 3.5Å; R263-N267 PolarHBondContact O-N 2.87Å; R263-N267 PolarHBondContact O-ND2 2.56Å; R263-N267 PolarHBondContact O-OD1 3.04Å; R263-E293 VanDerWaalsContact CD-OE1 3.26Å; R263-E293 WeakPolarHBondContact CD-OE1 3.5Å; R263-E293 WeakPolarHBondContact CG-OE1 3.18Å; R263-E293 IonicContact NE-OE1 2.75Å; R263-E293 IonicContact NE-OE2 2.62Å; R263-L309 HydrophobicContact CG-CB 4.23Å; R263-L309 HydrophobicContact CG-CD1 4.06Å
264	F	95.1	Very high	90.4	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.066	16%	0.157	C	C	.	.	H	α-helix	trans	-57.8	-50.7	177.4	-177.9	-83.5	0	0	0	112.4	G84 Y219 V221 V225 S260 L261 N267 K268	G84-F264 VanDerWaalsContact CA-CD2 3.41Å; Y219-F264 AromaticContact CD1-CD2 3.59Å; Y219-F264 HydrophobicContact CD1-CD2 3.59Å; Y219-F264 HydrophobicContact CD1-CE2 4.2Å; Y219-F264 HydrophobicContact CD1-CG 4.36Å; Y219-F264 HydrophobicContact CE1-CB 3.89Å; Y219-F264 AromaticContact CE1-CD2 3.36Å; Y219-F264 HydrophobicContact CE1-CD2 3.36Å; Y219-F264 HydrophobicContact CE1-CE2 4.05Å; Y219-F264 AromaticContact CE1-CG 3.74Å; Y219-F264 HydrophobicContact CE1-CG 3.74Å; V221-F264 HydrophobicContact CG1-CE2 4.42Å; V221-F264 HydrophobicContact CG1-CZ 4.02Å; V221-F264 HydrophobicContact CG2-CD2 4.15Å; V221-F264 HydrophobicContact CG2-CE2 3.35Å; V221-F264 HydrophobicContact CG2-CZ 3.76Å; V225-F264 HydrophobicContact CG1-CD1 3.97Å; V225-F264 HydrophobicContact CG1-CE1 3.43Å; V225-F264 VanDerWaalsContact CG1-CE1 3.43Å; V225-F264 HydrophobicContact CG1-CZ 4.14Å; S260-F264 WeakPolarHBondContact O-CB 3.45Å; S260-F264 PolarHBondContact O-N 3.42Å; L261-F264 WeakPolarHBondContact O-CB 3.48Å; L261-F264 PolarHBondContact O-N 2.93Å; F264-N267 PolarHBondContact O-N 3.12Å; F264-K268 WeakPolarHBondContact O-CB 3.5Å; F264-K268 PolarHBondContact O-N 2.58Å
265	L	95.2	Very high	89.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.4	-37	-179.6	-66.4	176.8	0	0	0	111.8	I228 L232 L248 I250 L261 L262 N267 K268 I269 L364	I228-L265 HydrophobicContact CG2-CD1 4.38Å; I228-L265 HydrophobicContact CG2-CD2 3.75Å; L232-L265 HydrophobicContact CD1-CD2 4.07Å; L248-L265 HydrophobicContact CD1-CD1 4.01Å; L248-L265 HydrophobicContact CD2-CD1 4.02Å; I250-L265 HydrophobicContact CD1-CD1 4.08Å; L261-L265 HydrophobicContact CD1-CD1 3.98Å; L261-L265 HydrophobicContact CD1-CD2 4.34Å; L261-L265 HydrophobicContact CD1-CG 3.86Å; L261-L265 HydrophobicContact CD2-CD1 4.34Å; L261-L265 HydrophobicContact CG-CD1 3.85Å; L261-L265 HydrophobicContact CG-CG 4.15Å; L261-L265 WeakPolarHBondContact O-CB 3.39Å; L261-L265 WeakPolarHBondContact O-CG 3.49Å; L261-L265 PolarHBondContact O-N 3.16Å; L262-L265 PolarHBondContact O-N 3.06Å; L265-N267 VanDerWaalsContact C-N 3.33Å; L265-N267 PolarHBondContact O-N 3.14Å; L265-K268 PolarHBondContact O-N 2.84Å; L265-I269 WeakPolarHBondContact O-CB 3.5Å; L265-I269 WeakPolarHBondContact O-CG1 3.44Å; L265-I269 PolarHBondContact O-N 3.09Å; L265-L364 HydrophobicContact CB-CD1 4.06Å; L265-L364 HydrophobicContact CB-CD2 4.46Å
266	S	95	Very high	88.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.3	-48.5	173.8	-60.1	0	0	0	0	110.7	L262 R263 I269 L270 L364	L262-S266 VanDerWaalsContact O-CB 3.31Å; L262-S266 WeakPolarHBondContact O-CB 3.37Å; L262-S266 PolarHBondContact O-N 3.13Å; L262-S266 PolarHBondContact O-OG 3.36Å; R263-S266 PolarHBondContact O-N 3.29Å; S266-I269 PolarHBondContact O-N 3.36Å; S266-L270 WeakPolarHBondContact O-CB 3.44Å; S266-L270 VanDerWaalsContact O-CG 3.24Å; S266-L270 WeakPolarHBondContact O-CG 3.36Å; S266-L270 PolarHBondContact O-N 3.22Å; S266-L364 WeakPolarHBondContact OG-CD1 3.48Å
267	N	94.6	Very high	87.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-47.2	178.3	-65.5	-14	0	0	0	111.2	W83 R263 F264 L265 I269 L270 T271 P308 L309	W83-N267 PolarHBondContact O-ND2 2.95Å; R263-N267 WeakPolarHBondContact O-CB 3.5Å; R263-N267 PolarHBondContact O-N 2.87Å; R263-N267 PolarHBondContact O-ND2 2.56Å; R263-N267 PolarHBondContact O-OD1 3.04Å; F264-N267 PolarHBondContact O-N 3.12Å; L265-N267 VanDerWaalsContact C-N 3.33Å; L265-N267 PolarHBondContact O-N 3.14Å; N267-I269 PolarHBondContact O-N 3.33Å; N267-L270 PolarHBondContact O-N 2.74Å; N267-T271 WeakPolarHBondContact O-CG2 3.4Å; N267-T271 PolarHBondContact O-N 3.04Å; N267-T271 PolarHBondContact O-OG1 3.4Å; N267-P308 VanDerWaalsContact OD1-CA 3.26Å; N267-P308 WeakPolarHBondContact OD1-CA 3.38Å; N267-L309 PolarHBondContact ND2-O 3.17Å; N267-L309 PolarHBondContact OD1-N 3.49Å
268	K	92	Very high	86.6	Confident	37 Å²	37	36 Å²	36	16%	0.161	18%	0.182	C	C	.	.	H	α-helix	trans	-58.9	-45.6	178.8	-165.7	69.8	170.5	170.4	0	112.1	G84 N86 F264 L265 L270 T271 D272	G84-K268 WeakPolarHBondContact O-CA 3.49Å; G84-K268 WeakPolarHBondContact O-CD 3.05Å; N86-K268 PolarHBondContact ND2-NZ 3.46Å; F264-K268 WeakPolarHBondContact O-CB 3.5Å; F264-K268 PolarHBondContact O-N 2.58Å; L265-K268 PolarHBondContact O-N 2.84Å; K268-L270 VanDerWaalsContact C-N 3.35Å; K268-L270 PolarHBondContact O-N 2.7Å; K268-T271 PolarHBondContact O-N 3.02Å; K268-T271 PolarHBondContact O-OG1 3.26Å; K268-D272 HydrophobicContact CD-CB 4.49Å; K268-D272 WeakPolarHBondContact CD-OD2 3.24Å; K268-D272 WeakPolarHBondContact CE-OD2 3.46Å; K268-D272 IonicContact NZ-OD2 3.72Å; K268-D272 PolarHBondContact NZ-OD2 2.69Å; K268-D272 WeakPolarHBondContact O-CB 3.38Å; K268-D272 PolarHBondContact O-N 3.25Å
269	I	91.6	Very high	85.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-42.8	178.4	-71.4	168.8	0	0	0	111	L232 L265 S266 N267 Y275 V282 L364	L232-I269 HydrophobicContact CD1-CD1 4.11Å; L232-I269 HydrophobicContact CD1-CG1 4.01Å; L232-I269 HydrophobicContact CD2-CD1 4.17Å; L232-I269 HydrophobicContact CD2-CG1 4.47Å; L265-I269 WeakPolarHBondContact O-CB 3.5Å; L265-I269 WeakPolarHBondContact O-CG1 3.44Å; L265-I269 PolarHBondContact O-N 3.09Å; S266-I269 PolarHBondContact O-N 3.36Å; N267-I269 PolarHBondContact O-N 3.33Å; I269-Y275 HydrophobicContact CG2-CE2 3.71Å; I269-V282 HydrophobicContact CD1-CG2 4.07Å; I269-V282 HydrophobicContact CG2-CB 4.14Å; I269-V282 HydrophobicContact CG2-CG2 4.28Å; I269-L364 HydrophobicContact CD1-CD1 4.18Å; I269-L364 HydrophobicContact CD1-CD2 3.88Å; I269-L364 HydrophobicContact CD1-CG 4.2Å
270	L	91.3	Very high	85.4	Confident	12 Å²	12	44.1 Å²	44.1	6%	0.063	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-34.8	-179.1	-71.8	169.5	0	0	0	112.7	S266 N267 K268 K280 V282 V305	S266-L270 WeakPolarHBondContact O-CB 3.44Å; S266-L270 VanDerWaalsContact O-CG 3.24Å; S266-L270 WeakPolarHBondContact O-CG 3.36Å; S266-L270 PolarHBondContact O-N 3.22Å; N267-L270 PolarHBondContact O-N 2.74Å; K268-L270 VanDerWaalsContact C-N 3.35Å; K268-L270 PolarHBondContact O-N 2.7Å; L270-K280 WeakPolarHBondContact O-CD 3.43Å; L270-V282 HydrophobicContact CD1-CG1 4.31Å; L270-V282 HydrophobicContact CD2-CG1 4.42Å; L270-V282 HydrophobicContact CG-CG1 4.22Å; L270-V305 HydrophobicContact CD1-CG1 4.06Å
271	T	89	Confident	85.4	Confident	31 Å²	31	43.4 Å²	43.4	19%	0.19	21%	0.21	C	C	.	.	H	α-helix	trans	-90.9	-44.8	-175.1	58	0	0	0	0	113.6	N86 I87 N267 K268 P308	N86-T271 PolarHBondContact N-OG1 3.38Å; N86-T271 WeakPolarHBondContact O-CB 3.35Å; N86-T271 VanDerWaalsContact O-CG2 3.32Å; N86-T271 WeakPolarHBondContact O-CG2 3.36Å; I87-T271 HydrophobicContact CD1-CG2 3.77Å; N267-T271 WeakPolarHBondContact O-CG2 3.4Å; N267-T271 PolarHBondContact O-N 3.04Å; N267-T271 PolarHBondContact O-OG1 3.4Å; K268-T271 PolarHBondContact O-N 3.02Å; K268-T271 PolarHBondContact O-OG1 3.26Å; T271-P308 HydrophobicContact CG2-CG 4.16Å
272	D	82.9	Confident	85.3	Confident	48 Å²	48	43.3 Å²	43.3	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-101.7	-29	-163.2	-67.6	21.9	0	0	0	112.8	N86 K268	N86-D272 VanDerWaalsContact CB-OD1 3.28Å; N86-D272 WeakPolarHBondContact CB-OD1 3.35Å; N86-D272 VanDerWaalsContact ND2-CG 3.3Å; N86-D272 PolarHBondContact ND2-OD1 2.77Å; N86-D272 VanDerWaalsContact ND2-OD1 3.09Å; N86-D272 PolarHBondContact ND2-OD2 2.98Å; K268-D272 HydrophobicContact CD-CB 4.49Å; K268-D272 WeakPolarHBondContact CD-OD2 3.24Å; K268-D272 WeakPolarHBondContact CE-OD2 3.46Å; K268-D272 IonicContact NZ-OD2 3.72Å; K268-D272 PolarHBondContact NZ-OD2 2.69Å; K268-D272 WeakPolarHBondContact O-CB 3.38Å; K268-D272 PolarHBondContact O-N 3.25Å
273	V	73.7	Confident	85.4	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	21%	0.21	C	C	.	.	S	Bend	trans	-89.9	128.5	-167.9	-167.6	0	0	0	0	109.9	L232 Y275 R362	L232-V273 WeakPolarHBondContact O-CG1 3.48Å; V273-Y275 PolarHBondContact O-N 2.88Å; V273-R362 VanDerWaalsContact CG1-CZ 3.44Å
274	E	69	Low	85.5	Confident	143 Å²	143	42.9 Å²	42.9	67%	0.668	21%	0.208	S	C	*	.			trans	-62.9	135.1	169.1	-73.4	-169.5	167	0	0	109.7
275	Y	68.4	Low	85.7	Confident	30 Å²	30	42.2 Å²	42.2	12%	0.118	21%	0.205	C	C	.	.			trans	-117.1	133.9	-175.3	-120.4	-86.6	0	0	0	109.5	I269 V273 L277 C281 P361 R362	I269-Y275 HydrophobicContact CG2-CE2 3.71Å; V273-Y275 PolarHBondContact O-N 2.88Å; Y275-L277 HydrophobicContact CD1-CB 4Å; Y275-L277 HydrophobicContact CD1-CD1 4.16Å; Y275-L277 HydrophobicContact CD1-CG 4.24Å; Y275-L277 HydrophobicContact CE1-CD1 4.05Å; Y275-L277 PolarHBondContact O-N 3.02Å; Y275-C281 WeakPolarHBondContact CE2-O 3.38Å; Y275-C281 PolarHBondContact OH-O 2.57Å; Y275-P361 HydrophobicContact CE1-CB 4.14Å; Y275-P361 WeakPolarHBondContact OH-CA 3.35Å; Y275-R362 PolarHBondContact OH-N 3.34Å
276	P	68.4	Low	85.8	Confident	88 Å²	88	42.2 Å²	42.2	57%	0.571	21%	0.205	S	C	*	.	S	Bend	trans	-71.1	-16	174.4	30	-35.9	0	0	0	112.2	P359	P276-P359 HydrophobicContact CB-CB 4.26Å; P276-P359 HydrophobicContact CB-CG 3.93Å; P276-P359 HydrophobicContact CG-CB 3.88Å; P276-P359 HydrophobicContact CG-CG 3.92Å
277	L	68.6	Low	85.9	Confident	52 Å²	52	42.2 Å²	42.2	27%	0.272	21%	0.205	S	C	.	.	S	Bend	trans	-83.5	144.8	179	-69.5	172.2	0	0	0	111.6	Y275 E279 P359 P361	Y275-L277 HydrophobicContact CD1-CB 4Å; Y275-L277 HydrophobicContact CD1-CD1 4.16Å; Y275-L277 HydrophobicContact CD1-CG 4.24Å; Y275-L277 HydrophobicContact CE1-CD1 4.05Å; Y275-L277 PolarHBondContact O-N 3.02Å; L277-E279 WeakPolarHBondContact CB-O 3.29Å; L277-E279 PolarHBondContact O-N 3.13Å; L277-P359 HydrophobicContact CD2-CG 3.73Å; L277-P359 VanDerWaalsContact CD2-O 3.32Å; L277-P359 WeakPolarHBondContact CD2-O 3.25Å; L277-P359 HydrophobicContact CG-CG 4.13Å; L277-P361 HydrophobicContact CD1-CB 4.38Å
278	K	73.3	Confident	86	Confident	216 Å²	216	43.3 Å²	43.3	94%	0.939	21%	0.211	S	C	*	.	S	Bend	trans	-58.6	-36.8	174.1	-171.3	179.3	179.2	-176	0	112.3
279	E	79.4	Confident	86.2	Confident	121 Å²	121	41.5 Å²	41.5	57%	0.565	20%	0.203	S	C	*	.	S	Bend	trans	-108.2	121.7	173.8	-69.8	-174.1	-167.3	0	0	110.3	L277 C281 K306	L277-E279 WeakPolarHBondContact CB-O 3.29Å; L277-E279 PolarHBondContact O-N 3.13Å; E279-C281 PolarHBondContact O-N 3.24Å; E279-K306 IonicContact OE2-NZ 3.78Å; E279-K306 PolarHBondContact OE2-NZ 3.07Å
280	K	85.5	Confident	86.4	Confident	95 Å²	95	42 Å²	42	41%	0.413	21%	0.208	S	C	.	.			trans	-67.9	126.7	174.4	-65.7	-165	177.7	-166.4	0	110.1	L270	L270-K280 WeakPolarHBondContact O-CD 3.43Å
281	C	92.7	Very high	86.5	Confident	10 Å²	10	44.4 Å²	44.4	7%	0.068	22%	0.219	C	C	.	.			trans	-153.8	162.4	172.3	62.1	0	0	0	0	111.1	Y275 E279 V305 K306	Y275-C281 WeakPolarHBondContact CE2-O 3.38Å; Y275-C281 PolarHBondContact OH-O 2.57Å; E279-C281 PolarHBondContact O-N 3.24Å; C281-V305 CarbonylContact C-O 3.57Å; C281-V305 WeakPolarHBondContact CA-O 3.29Å; C281-V305 WeakPolarHBondContact CB-O 3.36Å; C281-K306 HydrophobicContact CB-CG 4.23Å
282	V	94.4	Very high	86.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.8	169.6	60.4	0	0	0	0	108.9	I269 L270 V305 R362 L364	I269-V282 HydrophobicContact CD1-CG2 4.07Å; I269-V282 HydrophobicContact CG2-CB 4.14Å; I269-V282 HydrophobicContact CG2-CG2 4.28Å; L270-V282 HydrophobicContact CD1-CG1 4.31Å; L270-V282 HydrophobicContact CD2-CG1 4.42Å; L270-V282 HydrophobicContact CG-CG1 4.22Å; V282-V305 HydrophobicContact CG1-CB 3.79Å; V282-V305 HydrophobicContact CG1-CG2 4.44Å; V282-V305 PolarHBondContact N-O 3Å; V282-V305 PolarHBondContact O-N 3.1Å; V282-R362 WeakPolarHBondContact CG2-O 3.14Å; V282-L364 HydrophobicContact CG2-CD1 3.93Å; V282-L364 HydrophobicContact CG2-CG 3.84Å
283	A	97	Very high	87.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.6	172.3	0	0	0	0	0	109.3	L302 C303 L304 Y353 P361 R362 L363 L364	A283-L302 HydrophobicContact CB-CD1 4.47Å; A283-C303 CarbonylContact C-O 3.51Å; A283-C303 WeakPolarHBondContact CA-O 3.39Å; A283-L304 HydrophobicContact CB-CD2 3.88Å; A283-Y353 HydrophobicContact CB-CD2 4.05Å; A283-Y353 HydrophobicContact CB-CE2 4.04Å; A283-P361 HydrophobicContact CB-CB 4.43Å; A283-P361 HydrophobicContact CB-CG 3.92Å; A283-R362 PolarHBondContact N-O 2.92Å; A283-L363 HydrophobicContact CB-CD1 3.87Å; A283-L363 CarbonylContact O-C 3.57Å; A283-L363 WeakPolarHBondContact O-CA 3.07Å; A283-L364 PolarHBondContact O-N 3.33Å
284	V	98.4	Very high	88.5	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.9	174.1	-175.9	0	0	0	0	109.3	L262 F294 L302 C303 V305 L364	L262-V284 HydrophobicContact CD1-CG1 3.9Å; L262-V284 HydrophobicContact CD2-CG1 4.11Å; L262-V284 HydrophobicContact CG-CG1 4.49Å; V284-F294 HydrophobicContact CB-CE2 3.78Å; V284-F294 HydrophobicContact CG1-CD2 4.46Å; V284-F294 HydrophobicContact CG1-CE2 3.76Å; V284-F294 HydrophobicContact CG2-CE2 3.98Å; V284-F294 HydrophobicContact CG2-CZ 4.38Å; V284-L302 WeakPolarHBondContact O-CA 3.42Å; V284-C303 PolarHBondContact N-O 3.03Å; V284-C303 PolarHBondContact O-N 3.21Å; V284-V305 HydrophobicContact CG2-CG2 3.99Å; V284-L364 CarbonylContact C-O 3.56Å; V284-L364 VanDerWaalsContact CA-O 3.31Å; V284-L364 WeakPolarHBondContact CA-O 3.23Å; V284-L364 HydrophobicContact CG2-CB 4.45Å
285	L	98.8	Very high	89.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	113.4	166.7	176.2	67.2	0	0	0	108	I300 S301 L302 L346 V349 Y350 L363 L364 V365 N366 V386	L285-I300 HydrophobicContact CD1-CG2 4.43Å; L285-S301 WeakPolarHBondContact CA-O 3.43Å; L285-L302 HydrophobicContact CB-CD1 4.26Å; L285-L346 HydrophobicContact CD1-CD1 4.44Å; L285-L346 HydrophobicContact CD2-CD1 4.04Å; L285-V349 HydrophobicContact CD1-CB 4.42Å; L285-V349 HydrophobicContact CD1-CG1 3.68Å; L285-Y350 HydrophobicContact CD2-CD2 3.97Å; L285-L363 HydrophobicContact CB-CD1 3.93Å; L285-L364 PolarHBondContact N-O 3.12Å; L285-V365 HydrophobicContact CB-CG1 4.46Å; L285-V365 HydrophobicContact CB-CG2 4.25Å; L285-V365 HydrophobicContact CD2-CG1 4.09Å; L285-V365 HydrophobicContact CD2-CG2 4.28Å; L285-V365 HydrophobicContact CG-CG1 4.41Å; L285-V365 WeakPolarHBondContact O-CA 3.49Å; L285-N366 PolarHBondContact O-N 3.42Å; L285-V386 HydrophobicContact CD2-CG2 4.12Å
286	D	97.9	Very high	91.1	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	107.3	179.7	-162.4	-7.5	0	0	0	111.2	D288 P292 E293 I300 S301 N366	D286-D288 PolarHBondContact OD1-N 3.47Å; D286-D288 VanDerWaalsContact OD1-N 3.12Å; D286-P292 VanDerWaalsContact OD2-CA 3.23Å; D286-P292 WeakPolarHBondContact OD2-CA 3.37Å; D286-P292 WeakPolarHBondContact OD2-CB 3.38Å; D286-E293 WeakPolarHBondContact OD2-CB 3.49Å; D286-E293 PolarHBondContact OD2-N 2.88Å; D286-I300 WeakPolarHBondContact O-CG2 3.33Å; D286-S301 PolarHBondContact N-O 2.91Å; D286-S301 PolarHBondContact O-N 2.9Å; D286-N366 PolarHBondContact OD1-ND2 2.84Å
287	C	97.6	Very high	92.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.138	C	C	.	.			trans	-95.7	-5.5	-179.5	-51.9	0	0	0	0	112.4	I289 Y342 L346 N366	C287-I289 PolarHBondContact O-N 3.15Å; C287-Y342 WeakPolarHBondContact CB-OH 3.26Å; C287-Y342 PolarHBondContact O-OH 3.16Å; C287-L346 VanDerWaalsContact SG-CD1 3.51Å; C287-N366 WeakPolarHBondContact CB-O 3.4Å; C287-N366 PolarHBondContact N-O 2.86Å
288	D	96.6	Very high	93.7	Very high	23 Å²	23	26.7 Å²	26.7	12%	0.123	13%	0.125	C	C	.	.			trans	-86	91.3	178.4	-166.5	-27.1	0	0	0	111.1	D286 G290 Q291 P292	D286-D288 PolarHBondContact OD1-N 3.47Å; D286-D288 VanDerWaalsContact OD1-N 3.12Å; D288-G290 PolarHBondContact O-N 2.98Å; D288-G290 WeakPolarHBondContact OD1-CA 3.34Å; D288-G290 PolarHBondContact OD1-N 2.91Å; D288-Q291 PolarHBondContact OD1-N 3.18Å; D288-P292 WeakPolarHBondContact O-CA 3.36Å; D288-P292 WeakPolarHBondContact O-CB 3.43Å; D288-P292 VanDerWaalsContact O-CD 3.23Å; D288-P292 WeakPolarHBondContact O-CD 3.47Å; D288-P292 VanDerWaalsContact O-N 3.13Å
289	I	96.3	Very high	94.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.081	C	C	.	.	S	Bend	trans	-68.9	-14.2	177.2	66.4	173.1	0	0	0	113.6	C287 G298 I300 V330 C332 P335 Y342	C287-I289 PolarHBondContact O-N 3.15Å; I289-G298 PolarHBondContact O-N 3.17Å; I289-I300 HydrophobicContact CG2-CD1 4.38Å; I289-I300 HydrophobicContact CG2-CG1 3.54Å; I289-V330 HydrophobicContact CD1-CB 4.33Å; I289-V330 HydrophobicContact CD1-CG1 4.01Å; I289-V330 HydrophobicContact CG2-CB 4.37Å; I289-V330 HydrophobicContact CG2-CG2 3.91Å; I289-C332 VanDerWaalsContact CD1-O 3.3Å; I289-C332 WeakPolarHBondContact CD1-O 3.11Å; I289-P335 HydrophobicContact CD1-CG 3.9Å; I289-P335 HydrophobicContact CG1-CG 4.08Å; I289-Y342 HydrophobicContact CD1-CD2 4.29Å; I289-Y342 HydrophobicContact CG2-CD2 4.32Å; I289-Y342 HydrophobicContact CG2-CE2 4.09Å
290	G	95.4	Very high	95.8	Very high	10 Å²	10	10.7 Å²	10.7	10%	0.103	5%	0.054	C	C	.	.	S	Bend	trans	-85.7	-38	-176.7	0	0	0	0	0	112.9	D288 N297 R462	D288-G290 PolarHBondContact O-N 2.98Å; D288-G290 WeakPolarHBondContact OD1-CA 3.34Å; D288-G290 PolarHBondContact OD1-N 2.91Å; G290-N297 PolarHBondContact O-OD1 3.42Å; G290-R462 VanDerWaalsContact O-CD 3.23Å; G290-R462 WeakPolarHBondContact O-CD 3.44Å; G290-R462 VanDerWaalsContact O-CG 3.31Å; G290-R462 WeakPolarHBondContact O-CG 3.23Å
291	Q	94.2	Very high	96.4	Very high	62 Å²	62	6.1 Å²	6.1	29%	0.29	3%	0.034	S	C	.	.	S	Bend	trans	-144.7	66.9	176.6	-60.9	-169.2	-85.4	0	0	111.2	D288	D288-Q291 PolarHBondContact OD1-N 3.18Å
292	P	95.6	Very high	96.7	Very high	4 Å²	4	5.7 Å²	5.7	3%	0.026	3%	0.031	C	C	.	.			trans	-65.1	161	178.8	25.6	-33.9	0	0	0	113	D286 D288 T295 P296 M465	D286-P292 VanDerWaalsContact OD2-CA 3.23Å; D286-P292 WeakPolarHBondContact OD2-CA 3.37Å; D286-P292 WeakPolarHBondContact OD2-CB 3.38Å; D288-P292 WeakPolarHBondContact O-CA 3.36Å; D288-P292 WeakPolarHBondContact O-CB 3.43Å; D288-P292 VanDerWaalsContact O-CD 3.23Å; D288-P292 WeakPolarHBondContact O-CD 3.47Å; D288-P292 VanDerWaalsContact O-N 3.13Å; P292-T295 WeakPolarHBondContact CG-O 3.1Å; P292-P296 WeakPolarHBondContact CG-O 3.37Å; P292-M465 WeakPolarHBondContact O-CE 3.38Å
293	E	95.1	Very high	96.9	Very high	1 Å²	1	5.7 Å²	5.7	1%	0.005	3%	0.031	C	C	.	.	S	Bend	trans	-88	-37.9	-176.2	-173.2	69.3	-150.1	0	0	112.7	L262 R263 D286 H316 M465	L262-E293 HydrophobicContact CD2-CB 4.2Å; L262-E293 HydrophobicContact CD2-CG 4.01Å; R263-E293 VanDerWaalsContact CD-OE1 3.26Å; R263-E293 WeakPolarHBondContact CD-OE1 3.5Å; R263-E293 WeakPolarHBondContact CG-OE1 3.18Å; R263-E293 IonicContact NE-OE1 2.75Å; R263-E293 IonicContact NE-OE2 2.62Å; D286-E293 WeakPolarHBondContact OD2-CB 3.49Å; D286-E293 PolarHBondContact OD2-N 2.88Å; E293-H316 IonicContact OE1-CE1 2.78Å; E293-H316 PolarHBondContact OE1-CE1 2.75Å; E293-H316 IonicContact OE1-ND1 2.98Å; E293-H316 PolarHBondContact OE1-ND1 3.39Å; E293-M465 WeakPolarHBondContact O-CE 3.49Å
294	F	95.8	Very high	96.8	Very high	7 Å²	7	6.7 Å²	6.7	3%	0.031	4%	0.036	C	C	.	.	S	Bend	trans	-124.1	-10.4	-170	-55.2	-66.4	0	0	0	115.3	V284 C303 V305 L309 H316 T317 V322	V284-F294 HydrophobicContact CB-CE2 3.78Å; V284-F294 HydrophobicContact CG1-CD2 4.46Å; V284-F294 HydrophobicContact CG1-CE2 3.76Å; V284-F294 HydrophobicContact CG2-CE2 3.98Å; V284-F294 HydrophobicContact CG2-CZ 4.38Å; F294-C303 HydrophobicContact CD2-CB 4.08Å; F294-C303 HydrophobicContact CG-CB 4.43Å; F294-V305 HydrophobicContact CE1-CG2 3.96Å; F294-V305 HydrophobicContact CE2-CG2 4.1Å; F294-V305 HydrophobicContact CZ-CG2 3.54Å; F294-L309 HydrophobicContact CE1-CD1 3.91Å; F294-L309 HydrophobicContact CE1-CD2 4Å; F294-L309 HydrophobicContact CZ-CD1 3.77Å; F294-H316 HydrophobicContact CD1-CB 4.01Å; F294-H316 HydrophobicContact CE1-CB 4.2Å; F294-T317 WeakPolarHBondContact O-CG2 3.41Å; F294-V322 HydrophobicContact CB-CG1 4.2Å; F294-V322 HydrophobicContact CD1-CB 4.46Å; F294-V322 HydrophobicContact CD1-CG1 3.82Å; F294-V322 HydrophobicContact CD1-CG2 3.9Å; F294-V322 HydrophobicContact CE1-CG1 4.41Å; F294-V322 HydrophobicContact CE1-CG2 3.99Å; F294-V322 HydrophobicContact CG-CG1 4.01Å
295	T	96.1	Very high	96.7	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.036	C	C	.	.	S	Bend	trans	-125.9	164.7	-178.1	56	0	0	0	0	110.8	P292 I299 I324 M465	P292-T295 WeakPolarHBondContact CG-O 3.1Å; T295-I299 HydrophobicContact CG2-CG2 4.1Å; T295-I324 HydrophobicContact CG2-CD1 4.02Å; T295-M465 WeakPolarHBondContact O-CE 3.49Å; T295-M465 VanDerWaalsContact O-CG 3.31Å; T295-M465 WeakPolarHBondContact O-CG 3.5Å
296	P	96	Very high	96.4	Very high	4 Å²	4	10.7 Å²	10.7	3%	0.026	5%	0.054	C	C	.	.			trans	-59.3	161.8	164.3	-25.3	35.6	0	0	0	112.8	P292 I299 M466 Y469 L624	P292-P296 WeakPolarHBondContact CG-O 3.37Å; P296-I299 HydrophobicContact CB-CD1 4.26Å; P296-I299 HydrophobicContact CG-CD1 4.44Å; P296-M466 HydrophobicContact CB-CE 4.04Å; P296-M466 HydrophobicContact CB-SD 4.09Å; P296-Y469 HydrophobicContact CG-CD1 4.08Å; P296-Y469 HydrophobicContact CG-CD2 3.5Å; P296-Y469 VanDerWaalsContact CG-CD2 3.5Å; P296-Y469 HydrophobicContact CG-CE2 4.14Å; P296-Y469 HydrophobicContact CG-CG 3.47Å; P296-Y469 VanDerWaalsContact CG-CG 3.47Å; P296-L624 HydrophobicContact CB-CD1 3.48Å; P296-L624 VanDerWaalsContact CB-CD1 3.48Å; P296-L624 HydrophobicContact CG-CD1 3.69Å
297	N	95.7	Very high	96.2	Very high	7 Å²	7	13.4 Å²	13.4	4%	0.037	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	149.1	179.3	-37.2	-71.9	0	0	0	111.6	G290 I333 R462	G290-N297 PolarHBondContact O-OD1 3.42Å; N297-I333 HydrophobicContact CB-CG2 4.21Å; N297-R462 HydrophobicContact CB-CG 4.49Å; N297-R462 WeakPolarHBondContact ND2-CA 3.44Å; N297-R462 VanDerWaalsContact ND2-CB 3.3Å; N297-R462 WeakPolarHBondContact ND2-CB 3.4Å; N297-R462 PolarHBondContact ND2-O 3.35Å; N297-R462 VanDerWaalsContact ND2-O 3.09Å; N297-R462 VanDerWaalsContact OD1-CG 3.29Å; N297-R462 WeakPolarHBondContact OD1-CG 3.26Å
298	G	96.7	Very high	96	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	15.7	-178.1	0	0	0	0	0	114.7	I289 F329 V330 G331 C332	I289-G298 PolarHBondContact O-N 3.17Å; G298-F329 WeakPolarHBondContact O-CD2 3.44Å; G298-V330 PolarHBondContact O-N 3.13Å; G298-G331 PolarHBondContact O-N 3.38Å; G298-C332 WeakPolarHBondContact CA-O 3.43Å
299	I	98.2	Very high	95.9	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.6	-179	-64.5	170.4	0	0	0	109.2	T295 P296 Q327 C328 F329 L624	T295-I299 HydrophobicContact CG2-CG2 4.1Å; P296-I299 HydrophobicContact CB-CD1 4.26Å; P296-I299 HydrophobicContact CG-CD1 4.44Å; I299-Q327 HydrophobicContact CG2-CB 3.74Å; I299-C328 WeakPolarHBondContact CA-O 3.43Å; I299-F329 HydrophobicContact CG1-CD2 3.84Å; I299-L624 HydrophobicContact CD1-CD1 4.38Å; I299-L624 HydrophobicContact CD1-CD2 4.35Å; I299-L624 HydrophobicContact CD1-CG 4.43Å
300	I	98.5	Very high	95.9	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.3	161.5	-61.1	175.6	0	0	0	106.8	L285 D286 I289 Q327 C328 V330 Y342 C345 L346 V349	L285-I300 HydrophobicContact CD1-CG2 4.43Å; D286-I300 WeakPolarHBondContact O-CG2 3.33Å; I289-I300 HydrophobicContact CG2-CD1 4.38Å; I289-I300 HydrophobicContact CG2-CG1 3.54Å; I300-Q327 CarbonylContact O-C 3.6Å; I300-Q327 VanDerWaalsContact O-CA 3.27Å; I300-Q327 WeakPolarHBondContact O-CA 3.45Å; I300-C328 PolarHBondContact N-O 2.89Å; I300-C328 PolarHBondContact O-N 3.17Å; I300-V330 HydrophobicContact CD1-CG2 3.84Å; I300-V330 HydrophobicContact CG1-CG2 3.76Å; I300-Y342 HydrophobicContact CD1-CD2 3.76Å; I300-Y342 HydrophobicContact CD1-CE2 3.63Å; I300-Y342 HydrophobicContact CG1-CE2 4.22Å; I300-C345 HydrophobicContact CD1-CB 3.89Å; I300-L346 HydrophobicContact CD1-CB 4.12Å; I300-L346 HydrophobicContact CG2-CD1 4.47Å; I300-V349 HydrophobicContact CB-CG2 4.24Å; I300-V349 HydrophobicContact CG2-CB 4.02Å; I300-V349 HydrophobicContact CG2-CG1 4.13Å; I300-V349 HydrophobicContact CG2-CG2 3.94Å
301	S	98.5	Very high	95.8	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.6	-176.5	64.4	0	0	0	0	113.6	L285 D286 R326	L285-S301 WeakPolarHBondContact CA-O 3.43Å; D286-S301 PolarHBondContact N-O 2.91Å; D286-S301 PolarHBondContact O-N 2.9Å; S301-R326 WeakPolarHBondContact CA-O 3.17Å
302	L	98.7	Very high	95.8	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.9	165.9	179.3	71.9	0	0	0	108.5	A283 V284 L285 L325 R326 V349 A352 Y353 L363	A283-L302 HydrophobicContact CB-CD1 4.47Å; V284-L302 WeakPolarHBondContact O-CA 3.42Å; L285-L302 HydrophobicContact CB-CD1 4.26Å; L302-L325 HydrophobicContact CD2-CB 4.29Å; L302-L325 HydrophobicContact CD2-CD1 4Å; L302-L325 HydrophobicContact CG-CB 4.49Å; L302-L325 HydrophobicContact CG-CD1 4.36Å; L302-L325 PolarHBondContact O-N 2.82Å; L302-R326 PolarHBondContact N-O 3.01Å; L302-R326 PolarHBondContact O-N 3.11Å; L302-V349 HydrophobicContact CB-CG1 3.69Å; L302-A352 HydrophobicContact CD2-CB 3.71Å; L302-Y353 VanDerWaalsContact CD2-N 3.32Å; L302-L363 HydrophobicContact CD1-CD1 4.08Å
303	C	97.5	Very high	95.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.9	-177.6	-57.1	0	0	0	0	111.5	A283 V284 F294 V322 N323	A283-C303 CarbonylContact C-O 3.51Å; A283-C303 WeakPolarHBondContact CA-O 3.39Å; V284-C303 PolarHBondContact N-O 3.03Å; V284-C303 PolarHBondContact O-N 3.21Å; F294-C303 HydrophobicContact CD2-CB 4.08Å; F294-C303 HydrophobicContact CG-CB 4.43Å; C303-V322 HydrophobicContact CB-CG1 3.75Å; C303-N323 CarbonylContact C-O 3.57Å; C303-N323 VanDerWaalsContact CA-O 3.31Å; C303-N323 WeakPolarHBondContact CA-O 3.43Å
304	L	96.1	Very high	95.8	Very high	22 Å²	22	11.8 Å²	11.8	12%	0.115	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.4	164.1	-59.9	-177.6	0	0	0	109.4	A283 V322 N323 L325 P361	A283-L304 HydrophobicContact CB-CD2 3.88Å; L304-V322 WeakPolarHBondContact O-CA 3.29Å; L304-N323 HydrophobicContact CB-CB 4.41Å; L304-N323 PolarHBondContact N-O 2.83Å; L304-N323 PolarHBondContact O-N 2.7Å; L304-L325 HydrophobicContact CD1-CD1 3.92Å; L304-L325 HydrophobicContact CD1-CD2 4.02Å; L304-L325 HydrophobicContact CD1-CG 4.2Å; L304-L325 HydrophobicContact CD2-CD1 3.88Å; L304-L325 HydrophobicContact CG-CD1 3.62Å; L304-L325 HydrophobicContact CG-CD2 4.25Å; L304-L325 HydrophobicContact CG-CG 3.9Å; L304-P361 HydrophobicContact CD2-CG 3.94Å
305	V	95.7	Very high	95.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125	175.9	-174.7	0	0	0	0	108.6	L270 C281 V282 V284 F294 L307 L309 V322	L270-V305 HydrophobicContact CD1-CG1 4.06Å; C281-V305 CarbonylContact C-O 3.57Å; C281-V305 WeakPolarHBondContact CA-O 3.29Å; C281-V305 WeakPolarHBondContact CB-O 3.36Å; V282-V305 HydrophobicContact CG1-CB 3.79Å; V282-V305 HydrophobicContact CG1-CG2 4.44Å; V282-V305 PolarHBondContact N-O 3Å; V282-V305 PolarHBondContact O-N 3.1Å; V284-V305 HydrophobicContact CG2-CG2 3.99Å; F294-V305 HydrophobicContact CE1-CG2 3.96Å; F294-V305 HydrophobicContact CE2-CG2 4.1Å; F294-V305 HydrophobicContact CZ-CG2 3.54Å; V305-L307 WeakPolarHBondContact CG1-O 3.05Å; V305-L309 HydrophobicContact CG1-CD1 4.3Å; V305-L309 HydrophobicContact CG1-CD2 3.77Å; V305-L309 HydrophobicContact CG1-CG 4Å; V305-V322 HydrophobicContact CG2-CG2 4.42Å
306	K	93	Very high	95.6	Very high	84 Å²	84	12 Å²	12	37%	0.365	6%	0.063	S	C	.	.			trans	-106.3	-22.2	-175.8	-61.7	-167.4	177.8	-163.4	0	114.5	E279 C281 N321	E279-K306 IonicContact OE2-NZ 3.78Å; E279-K306 PolarHBondContact OE2-NZ 3.07Å; C281-K306 HydrophobicContact CB-CG 4.23Å; K306-N321 PolarHBondContact N-O 3.11Å
307	L	92.2	Very high	95.1	Very high	57 Å²	57	13.5 Å²	13.5	30%	0.298	7%	0.072	S	C	.	.	S	Bend	trans	-130	154.4	179.2	-67.4	-174.7	0	0	0	111.4	F95 V305 N321	F95-L307 HydrophobicContact CE1-CD2 4.3Å; V305-L307 WeakPolarHBondContact CG1-O 3.05Å; L307-N321 HydrophobicContact CB-CB 3.83Å; L307-N321 WeakPolarHBondContact CB-ND2 3.31Å; L307-N321 HydrophobicContact CD1-CB 4.28Å; L307-N321 WeakPolarHBondContact CD1-ND2 3.36Å; L307-N321 WeakPolarHBondContact CD1-OD1 3.28Å; L307-N321 HydrophobicContact CG-CB 4.06Å
308	P	94.1	Very high	94.7	Very high	20 Å²	20	15.3 Å²	15.3	13%	0.13	8%	0.081	C	C	.	.			trans	-53.9	141.2	177.7	-27.7	36	0	0	0	114	I87 F95 N267 T271 F310	I87-P308 HydrophobicContact CD1-CG 4.18Å; F95-P308 HydrophobicContact CE1-CG 4.22Å; N267-P308 VanDerWaalsContact OD1-CA 3.26Å; N267-P308 WeakPolarHBondContact OD1-CA 3.38Å; T271-P308 HydrophobicContact CG2-CG 4.16Å; P308-F310 HydrophobicContact CB-CD1 4.2Å; P308-F310 HydrophobicContact CB-CD2 4.28Å; P308-F310 HydrophobicContact CB-CE1 3.6Å; P308-F310 HydrophobicContact CB-CE2 3.72Å; P308-F310 HydrophobicContact CB-CZ 3.35Å; P308-F310 HydrophobicContact CG-CE2 4.41Å; P308-F310 HydrophobicContact CG-CZ 4.09Å; P308-F310 PolarHBondContact O-N 3.43Å
309	L	95.4	Very high	93.8	Very high	9 Å²	9	17.3 Å²	17.3	5%	0.047	10%	0.095	C	C	.	.			trans	-91.6	89	-178.2	-61.1	179.4	0	0	0	110	R263 N267 F294 V305 H316	R263-L309 HydrophobicContact CG-CB 4.23Å; R263-L309 HydrophobicContact CG-CD1 4.06Å; N267-L309 PolarHBondContact ND2-O 3.17Å; N267-L309 PolarHBondContact OD1-N 3.49Å; F294-L309 HydrophobicContact CE1-CD1 3.91Å; F294-L309 HydrophobicContact CE1-CD2 4Å; F294-L309 HydrophobicContact CZ-CD1 3.77Å; V305-L309 HydrophobicContact CG1-CD1 4.3Å; V305-L309 HydrophobicContact CG1-CD2 3.77Å; V305-L309 HydrophobicContact CG1-CG 4Å; L309-H316 HydrophobicContact CD2-CB 4.48Å
310	F	95.1	Very high	92.7	Very high	5 Å²	5	23.9 Å²	23.9	2%	0.022	14%	0.136	C	C	.	.			trans	-104.1	60.7	180	-58.1	-35.9	0	0	0	112.7	F72 I82 I87 F95 L97 Y98 L106 P308	F72-F310 HydrophobicContact CE1-CD2 4.03Å; F72-F310 AromaticContact CE1-CE2 3.82Å; F72-F310 HydrophobicContact CE1-CE2 3.82Å; F72-F310 HydrophobicContact CZ-CE2 4.17Å; I82-F310 HydrophobicContact CB-CD1 4.27Å; I82-F310 HydrophobicContact CB-CE1 3.76Å; I82-F310 HydrophobicContact CB-CZ 3.97Å; I82-F310 HydrophobicContact CG2-CD1 3.82Å; I82-F310 HydrophobicContact CG2-CE1 3.85Å; I82-F310 HydrophobicContact CG2-CG 4.34Å; I82-F310 HydrophobicContact CG2-CZ 4.35Å; I82-F310 VanDerWaalsContact O-CE1 3.3Å; I82-F310 WeakPolarHBondContact O-CE1 3.31Å; I87-F310 HydrophobicContact CD1-CE2 4.44Å; I87-F310 HydrophobicContact CD1-CZ 4.02Å; I87-F310 HydrophobicContact CG1-CE2 4.49Å; I87-F310 HydrophobicContact CG1-CZ 4.07Å; F95-F310 HydrophobicContact CB-CD2 4Å; F95-F310 HydrophobicContact CB-CE2 4.1Å; F95-F310 HydrophobicContact CD1-CE2 4.26Å; F95-F310 HydrophobicContact CG-CD2 4.46Å; F95-F310 HydrophobicContact CG-CE2 4.09Å; L97-F310 HydrophobicContact CD2-CB 3.4Å; L97-F310 HydrophobicContact CD2-CD2 3.57Å; L97-F310 HydrophobicContact CD2-CE2 4.47Å; L97-F310 HydrophobicContact CD2-CG 3.65Å; Y98-F310 PolarHBondContact N-O 3.35Å; L106-F310 HydrophobicContact CD1-CB 4.04Å; L106-F310 WeakPolarHBondContact CD1-O 3.49Å; P308-F310 HydrophobicContact CB-CD1 4.2Å; P308-F310 HydrophobicContact CB-CD2 4.28Å; P308-F310 HydrophobicContact CB-CE1 3.6Å; P308-F310 HydrophobicContact CB-CE2 3.72Å; P308-F310 HydrophobicContact CB-CZ 3.35Å; P308-F310 HydrophobicContact CG-CE2 4.41Å; P308-F310 HydrophobicContact CG-CZ 4.09Å; P308-F310 PolarHBondContact O-N 3.43Å
311	G	94.6	Very high	91.9	Very high	5 Å²	5	26 Å²	26	5%	0.052	15%	0.147	C	C	.	.	S	Bend	trans	-178.2	-176.5	176.7	0	0	0	0	0	112.5	Y98 H316	Y98-G311 WeakPolarHBondContact O-CA 3.49Å; G311-H316 PolarHBondContact O-NE2 3.44Å; G311-H316 VanDerWaalsContact O-NE2 3.16Å
312	P	94.2	Very high	91.6	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.019	16%	0.155	C	C	.	.			trans	-78.9	162.3	170.2	33.4	-36.5	0	0	0	111.8	Y98 H103 Y314 T315	Y98-P312 WeakPolarHBondContact O-CD 3.35Å; H103-P312 WeakPolarHBondContact CE1-CB 3.41Å; H103-P312 VanDerWaalsContact ND1-CB 3.29Å; H103-P312 WeakPolarHBondContact ND1-CB 3.46Å; P312-Y314 VanDerWaalsContact C-N 3.31Å; P312-Y314 HydrophobicContact CB-CD1 3.95Å; P312-Y314 HydrophobicContact CB-CE1 3.54Å; P312-Y314 HydrophobicContact CG-CD1 3.92Å; P312-Y314 HydrophobicContact CG-CE1 3.29Å; P312-Y314 HydrophobicContact CG-CE2 3.98Å; P312-Y314 HydrophobicContact CG-CG 4.49Å; P312-Y314 PolarHBondContact O-N 3.42Å; P312-Y314 VanDerWaalsContact O-N 3.13Å; P312-T315 WeakPolarHBondContact CD-OG1 3.48Å; P312-T315 HydrophobicContact CG-CG2 3.75Å; P312-T315 WeakPolarHBondContact O-CB 3.08Å; P312-T315 PolarHBondContact O-N 2.83Å; P312-T315 PolarHBondContact O-OG1 3.14Å
313	P	95.3	Very high	91.4	Very high	20 Å²	20	31.1 Å²	31.1	13%	0.13	18%	0.175	C	C	.	.	H	α-helix	trans	-47.5	-46.5	-175.5	-33.3	36.9	0	0	0	115	T315 H316 M465	P313-T315 PolarHBondContact O-N 2.86Å; P313-H316 WeakPolarHBondContact O-CB 3.35Å; P313-H316 PolarHBondContact O-N 2.9Å; P313-M465 HydrophobicContact CB-CE 3.72Å
314	Y	95.3	Very high	91.3	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-13.9	-178.2	65.3	-95.3	0	0	0	113.8	S100 S102 L176 P312 T317 L464 T468	S100-Y314 WeakPolarHBondContact CB-OH 3.43Å; S100-Y314 PolarHBondContact OG-OH 2.78Å; S102-Y314 WeakPolarHBondContact OG-CE1 3.43Å; S102-Y314 PolarHBondContact OG-OH 2.93Å; L176-Y314 HydrophobicContact CD2-CD2 4.09Å; L176-Y314 HydrophobicContact CD2-CE2 3.96Å; P312-Y314 VanDerWaalsContact C-N 3.31Å; P312-Y314 HydrophobicContact CB-CD1 3.95Å; P312-Y314 HydrophobicContact CB-CE1 3.54Å; P312-Y314 HydrophobicContact CG-CD1 3.92Å; P312-Y314 HydrophobicContact CG-CE1 3.29Å; P312-Y314 HydrophobicContact CG-CE2 3.98Å; P312-Y314 HydrophobicContact CG-CG 4.49Å; P312-Y314 PolarHBondContact O-N 3.42Å; P312-Y314 VanDerWaalsContact O-N 3.13Å; Y314-T317 PolarHBondContact O-OG1 2.54Å; Y314-T317 VanDerWaalsContact O-OG1 3.11Å; Y314-L464 HydrophobicContact CD1-CB 4.09Å; Y314-L464 HydrophobicContact CD1-CD1 4.1Å; Y314-L464 HydrophobicContact CE1-CD1 3.89Å; Y314-L464 HydrophobicContact CG-CB 4.16Å; Y314-T468 WeakPolarHBondContact O-CG2 3.28Å
315	T	95	Very high	91.3	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-90.9	-16.9	175.4	66.1	0	0	0	0	113.2	Y98 L176 P312 P313 T317 L318	Y98-T315 HydrophobicContact CD2-CG2 4.02Å; Y98-T315 HydrophobicContact CG-CG2 3.89Å; L176-T315 HydrophobicContact CD1-CG2 4.28Å; L176-T315 HydrophobicContact CD2-CG2 4.24Å; P312-T315 WeakPolarHBondContact CD-OG1 3.48Å; P312-T315 HydrophobicContact CG-CG2 3.75Å; P312-T315 WeakPolarHBondContact O-CB 3.08Å; P312-T315 PolarHBondContact O-N 2.83Å; P312-T315 PolarHBondContact O-OG1 3.14Å; P313-T315 PolarHBondContact O-N 2.86Å; T315-T317 VanDerWaalsContact C-N 3.33Å; T315-L318 WeakPolarHBondContact O-CB 3.47Å; T315-L318 PolarHBondContact O-N 2.99Å
316	H	92.7	Very high	91.5	Very high	8 Å²	8	39 Å²	39	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-74.2	-28.2	-178.1	-58.7	165	0	0	0	112.1	E293 F294 L309 G311 P313 L318 S319	E293-H316 IonicContact OE1-CE1 2.78Å; E293-H316 PolarHBondContact OE1-CE1 2.75Å; E293-H316 IonicContact OE1-ND1 2.98Å; E293-H316 PolarHBondContact OE1-ND1 3.39Å; F294-H316 HydrophobicContact CD1-CB 4.01Å; F294-H316 HydrophobicContact CE1-CB 4.2Å; L309-H316 HydrophobicContact CD2-CB 4.48Å; G311-H316 PolarHBondContact O-NE2 3.44Å; G311-H316 VanDerWaalsContact O-NE2 3.16Å; P313-H316 WeakPolarHBondContact O-CB 3.35Å; P313-H316 PolarHBondContact O-N 2.9Å; H316-L318 PolarHBondContact O-N 3.18Å; H316-S319 WeakPolarHBondContact O-CB 3.36Å; H316-S319 PolarHBondContact O-N 2.78Å; H316-S319 VanDerWaalsContact O-N 3.16Å
317	T	85	Confident	91.7	Very high	36 Å²	36	35.9 Å²	35.9	22%	0.221	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.3	173	59.6	0	0	0	0	113.5	F294 Y314 T315 S319 M465	F294-T317 WeakPolarHBondContact O-CG2 3.41Å; Y314-T317 PolarHBondContact O-OG1 2.54Å; Y314-T317 VanDerWaalsContact O-OG1 3.11Å; T315-T317 VanDerWaalsContact C-N 3.33Å; T317-S319 VanDerWaalsContact C-N 3.32Å; T317-M465 HydrophobicContact CG2-CE 4.47Å; T317-M465 HydrophobicContact CG2-SD 3.77Å
318	L	88	Confident	92	Very high	44 Å²	44	33.2 Å²	33.2	23%	0.23	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.9	175.8	-57.1	178.8	0	0	0	112.8	V175 L176 T315 H316 T468	V175-L318 HydrophobicContact CB-CD2 3.88Å; V175-L318 HydrophobicContact CG1-CD2 3.68Å; V175-L318 HydrophobicContact CG2-CD2 4.09Å; L176-L318 HydrophobicContact CD1-CD1 3.88Å; L176-L318 HydrophobicContact CD2-CD1 3.82Å; L176-L318 HydrophobicContact CG-CD1 3.63Å; T315-L318 WeakPolarHBondContact O-CB 3.47Å; T315-L318 PolarHBondContact O-N 2.99Å; H316-L318 PolarHBondContact O-N 3.18Å; L318-T468 HydrophobicContact CD1-CG2 4.21Å; L318-T468 HydrophobicContact CD2-CG2 3.53Å; L318-T468 HydrophobicContact CG-CG2 3.84Å
319	S	76.3	Confident	92.2	Very high	42 Å²	42	32.4 Å²	32.4	29%	0.294	18%	0.179	S	C	.	.			trans	-100.2	135.7	-173.6	-176.2	0	0	0	0	110.6	H316 T317 N321	H316-S319 WeakPolarHBondContact O-CB 3.36Å; H316-S319 PolarHBondContact O-N 2.78Å; H316-S319 VanDerWaalsContact O-N 3.16Å; T317-S319 VanDerWaalsContact C-N 3.32Å; S319-N321 PolarHBondContact O-N 2.92Å; S319-N321 VanDerWaalsContact O-N 3.15Å; S319-N321 WeakPolarHBondContact OG-CB 3.32Å; S319-N321 PolarHBondContact OG-N 3.29Å; S319-N321 PolarHBondContact OG-ND2 2.85Å
320	T	75.2	Confident	92.3	Very high	139 Å²	139	32.3 Å²	32.3	85%	0.853	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	0.6	171.5	52.3	0	0	0	0	113	V322	T320-V322 VanDerWaalsContact C-N 3.33Å
321	N	82.8	Confident	92.2	Very high	45 Å²	45	32.3 Å²	32.3	24%	0.241	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-2.5	-171.8	-52.4	-28.5	0	0	0	113.4	K306 L307 S319	K306-N321 PolarHBondContact N-O 3.11Å; L307-N321 HydrophobicContact CB-CB 3.83Å; L307-N321 WeakPolarHBondContact CB-ND2 3.31Å; L307-N321 HydrophobicContact CD1-CB 4.28Å; L307-N321 WeakPolarHBondContact CD1-ND2 3.36Å; L307-N321 WeakPolarHBondContact CD1-OD1 3.28Å; L307-N321 HydrophobicContact CG-CB 4.06Å; S319-N321 PolarHBondContact O-N 2.92Å; S319-N321 VanDerWaalsContact O-N 3.15Å; S319-N321 WeakPolarHBondContact OG-CB 3.32Å; S319-N321 PolarHBondContact OG-N 3.29Å; S319-N321 PolarHBondContact OG-ND2 2.85Å
322	V	91.6	Very high	92.2	Very high	27 Å²	27	32.4 Å²	32.4	16%	0.164	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.3	175.5	-176.7	0	0	0	0	107.9	F294 C303 L304 V305 T320	F294-V322 HydrophobicContact CB-CG1 4.2Å; F294-V322 HydrophobicContact CD1-CB 4.46Å; F294-V322 HydrophobicContact CD1-CG1 3.82Å; F294-V322 HydrophobicContact CD1-CG2 3.9Å; F294-V322 HydrophobicContact CE1-CG1 4.41Å; F294-V322 HydrophobicContact CE1-CG2 3.99Å; F294-V322 HydrophobicContact CG-CG1 4.01Å; C303-V322 HydrophobicContact CB-CG1 3.75Å; L304-V322 WeakPolarHBondContact O-CA 3.29Å; V305-V322 HydrophobicContact CG2-CG2 4.42Å; T320-V322 VanDerWaalsContact C-N 3.33Å
323	N	94	Very high	92.2	Very high	81 Å²	81	35.2 Å²	35.2	43%	0.433	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.6	174.5	-178.4	21.7	0	0	0	109.6	C303 L304 L325	C303-N323 CarbonylContact C-O 3.57Å; C303-N323 VanDerWaalsContact CA-O 3.31Å; C303-N323 WeakPolarHBondContact CA-O 3.43Å; L304-N323 HydrophobicContact CB-CB 4.41Å; L304-N323 PolarHBondContact N-O 2.83Å; L304-N323 PolarHBondContact O-N 2.7Å; N323-L325 PolarHBondContact O-N 2.9Å
324	I	95.7	Very high	92.1	Very high	65 Å²	65	35.5 Å²	35.5	33%	0.333	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.4	175.8	-57.2	172.9	0	0	0	107.8	T295 Q327	T295-I324 HydrophobicContact CG2-CD1 4.02Å; I324-Q327 HydrophobicContact CG2-CB 3.99Å; I324-Q327 HydrophobicContact CG2-CG 3.98Å
325	L	96.8	Very high	92	Very high	56 Å²	56	35.6 Å²	35.6	29%	0.293	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-36.3	179.9	-67.6	-178.9	0	0	0	112.7	L302 L304 N323 L356	L302-L325 HydrophobicContact CD2-CB 4.29Å; L302-L325 HydrophobicContact CD2-CD1 4Å; L302-L325 HydrophobicContact CG-CB 4.49Å; L302-L325 HydrophobicContact CG-CD1 4.36Å; L302-L325 PolarHBondContact O-N 2.82Å; L304-L325 HydrophobicContact CD1-CD1 3.92Å; L304-L325 HydrophobicContact CD1-CD2 4.02Å; L304-L325 HydrophobicContact CD1-CG 4.2Å; L304-L325 HydrophobicContact CD2-CD1 3.88Å; L304-L325 HydrophobicContact CG-CD1 3.62Å; L304-L325 HydrophobicContact CG-CD2 4.25Å; L304-L325 HydrophobicContact CG-CG 3.9Å; N323-L325 PolarHBondContact O-N 2.9Å; L325-L356 HydrophobicContact CD1-CD1 4.1Å; L325-L356 HydrophobicContact CD1-CD2 3.91Å; L325-L356 HydrophobicContact CD1-CG 4.41Å
326	R	98.5	Very high	91.9	Very high	66 Å²	66	37.6 Å²	37.6	25%	0.249	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	137.8	-179.3	179.7	157	-64.4	177.4	6.1	109.8	S301 L302 F348 V349 A352 E620	S301-R326 WeakPolarHBondContact CA-O 3.17Å; L302-R326 PolarHBondContact N-O 3.01Å; L302-R326 PolarHBondContact O-N 3.11Å; R326-F348 WeakPolarHBondContact CD-O 3.31Å; R326-F348 HydrophobicContact CG-CD1 4.29Å; R326-F348 HydrophobicContact CG-CE1 3.81Å; R326-F348 HydrophobicContact CG-CZ 4.34Å; R326-F348 PolarHBondContact NH1-O 3.36Å; R326-V349 HydrophobicContact CG-CB 4.44Å; R326-V349 HydrophobicContact CG-CG2 4.21Å; R326-A352 HydrophobicContact CB-CB 3.64Å; R326-A352 HydrophobicContact CG-CB 4.29Å; R326-E620 WeakPolarHBondContact CG-OE2 3.44Å; R326-E620 IonicContact NE-OE2 2.93Å
327	Q	98.4	Very high	91.7	Very high	19 Å²	19	39.9 Å²	39.9	9%	0.089	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	147.2	172.5	59.9	178.7	1.6	0	0	111.7	I299 I300 I324 E620 C621	I299-Q327 HydrophobicContact CG2-CB 3.74Å; I300-Q327 CarbonylContact O-C 3.6Å; I300-Q327 VanDerWaalsContact O-CA 3.27Å; I300-Q327 WeakPolarHBondContact O-CA 3.45Å; I324-Q327 HydrophobicContact CG2-CB 3.99Å; I324-Q327 HydrophobicContact CG2-CG 3.98Å; Q327-E620 PolarHBondContact N-OE1 3.28Å; Q327-C621 HydrophobicContact CG-CB 4.13Å; Q327-C621 WeakPolarHBondContact CG-O 3.3Å; Q327-C621 PolarHBondContact NE2-O 3.15Å; Q327-C621 PolarHBondContact O-N 3.41Å
328	C	98.6	Very high	92	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.6	-178.7	-168.7	0	0	0	0	109.9	I299 I300 V330 C345 F348 V349 C619	I299-C328 WeakPolarHBondContact CA-O 3.43Å; I300-C328 PolarHBondContact N-O 2.89Å; I300-C328 PolarHBondContact O-N 3.17Å; C328-V330 PolarHBondContact O-N 3.45Å; C328-C345 HydrophobicContact CB-CB 4.11Å; C328-C345 PolarHBondContact SG-SG 2.89Å; C328-F348 HydrophobicContact CB-CD1 3.95Å; C328-F348 HydrophobicContact CB-CE1 4.3Å; C328-V349 HydrophobicContact CB-CG2 3.73Å; C328-C619 PolarHBondContact SG-O 2.66Å; C328-C619 VanDerWaalsContact SG-O 3.42Å
329	F	98.2	Very high	92.3	Very high	3 Å²	3	38 Å²	38	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	107.7	178	-174.2	-116.9	0	0	0	109.8	G298 I299 G331 M562 A592 C621 L624 L655 V659	G298-F329 WeakPolarHBondContact O-CD2 3.44Å; I299-F329 HydrophobicContact CG1-CD2 3.84Å; F329-G331 VanDerWaalsContact C-N 3.32Å; F329-G331 VanDerWaalsContact CE1-CA 3.44Å; F329-M562 HydrophobicContact CD1-SD 3.79Å; F329-M562 HydrophobicContact CE1-SD 3.93Å; F329-A592 HydrophobicContact CB-CB 3.82Å; F329-A592 HydrophobicContact CD1-CB 3.3Å; F329-A592 HydrophobicContact CD2-CB 3.91Å; F329-A592 HydrophobicContact CE1-CB 3.66Å; F329-A592 HydrophobicContact CE2-CB 4.24Å; F329-A592 HydrophobicContact CG-CB 3.4Å; F329-A592 VanDerWaalsContact CG-CB 3.4Å; F329-A592 HydrophobicContact CZ-CB 4.11Å; F329-C621 HydrophobicContact CB-CB 4.01Å; F329-L624 HydrophobicContact CD2-CD2 4.12Å; F329-L624 HydrophobicContact CE2-CD2 4.02Å; F329-L655 HydrophobicContact CD1-CB 4.25Å; F329-V659 HydrophobicContact CE2-CG2 4.28Å; F329-V659 HydrophobicContact CZ-CG2 4.28Å
330	V	97.3	Very high	93.2	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.036	21%	0.214	C	C	.	.			trans	-75	-29.8	174.7	-173.4	0	0	0	0	110.4	I289 G298 I300 C328 C332 F341 C345 M562	I289-V330 HydrophobicContact CD1-CB 4.33Å; I289-V330 HydrophobicContact CD1-CG1 4.01Å; I289-V330 HydrophobicContact CG2-CB 4.37Å; I289-V330 HydrophobicContact CG2-CG2 3.91Å; G298-V330 PolarHBondContact O-N 3.13Å; I300-V330 HydrophobicContact CD1-CG2 3.84Å; I300-V330 HydrophobicContact CG1-CG2 3.76Å; C328-V330 PolarHBondContact O-N 3.45Å; V330-C332 VanDerWaalsContact C-N 3.35Å; V330-C332 PolarHBondContact O-N 3.49Å; V330-F341 HydrophobicContact CG1-CD1 4.28Å; V330-C345 HydrophobicContact CG2-CB 4.04Å; V330-M562 VanDerWaalsContact O-CE 3.26Å; V330-M562 WeakPolarHBondContact O-CE 3.26Å
331	G	93.9	Very high	94.1	Very high	5 Å²	5	31.8 Å²	31.8	5%	0.052	18%	0.175	C	C	.	.			trans	77.5	15.9	174.7	0	0	0	0	0	114.7	G298 F329 G657 N658	G298-G331 PolarHBondContact O-N 3.38Å; F329-G331 VanDerWaalsContact C-N 3.32Å; F329-G331 VanDerWaalsContact CE1-CA 3.44Å; G331-G657 CarbonylContact O-C 3.36Å; G331-G657 VanDerWaalsContact O-CA 3.22Å; G331-G657 WeakPolarHBondContact O-CA 3.45Å; G331-N658 WeakPolarHBondContact O-CA 3.1Å; G331-N658 PolarHBondContact O-N 3.32Å
332	C	93.8	Very high	94.8	Very high	7 Å²	7	29.6 Å²	29.6	5%	0.047	16%	0.163	C	C	.	.	S	Bend	trans	-145	165.1	171.6	63.2	0	0	0	0	110.4	I289 G298 V330 T334 D337	I289-C332 VanDerWaalsContact CD1-O 3.3Å; I289-C332 WeakPolarHBondContact CD1-O 3.11Å; G298-C332 WeakPolarHBondContact CA-O 3.43Å; V330-C332 VanDerWaalsContact C-N 3.35Å; V330-C332 PolarHBondContact O-N 3.49Å; C332-T334 PolarHBondContact SG-O 3.07Å; C332-D337 HydrophobicContact CB-CB 4Å; C332-D337 WeakPolarHBondContact CB-OD2 3.24Å
333	I	93.8	Very high	95.1	Very high	62 Å²	62	29.7 Å²	29.7	32%	0.318	16%	0.162	S	C	.	.	S	Bend	trans	-99	4	177.3	62.8	166.1	0	0	0	113.1	N297 V659	N297-I333 HydrophobicContact CB-CG2 4.21Å; I333-V659 HydrophobicContact CG2-CG2 4.33Å
334	T	93.7	Very high	95.2	Very high	27 Å²	27	31.5 Å²	31.5	17%	0.166	17%	0.166	C	C	.	.	S	Bend	trans	-143	125.9	177.7	-179.8	0	0	0	0	110.5	C332 S336 D337 W370	C332-T334 PolarHBondContact SG-O 3.07Å; T334-S336 VanDerWaalsContact CG2-OG 3.3Å; T334-S336 WeakPolarHBondContact CG2-OG 3.36Å; T334-S336 PolarHBondContact O-N 2.74Å; T334-S336 VanDerWaalsContact O-N 3.08Å; T334-S336 PolarHBondContact OG1-OG 2.92Å; T334-D337 HydrophobicContact CG2-CB 4.48Å; T334-D337 WeakPolarHBondContact CG2-OD1 3.27Å; T334-D337 PolarHBondContact O-N 2.89Å; T334-D337 VanDerWaalsContact O-N 3.14Å; T334-W370 WeakPolarHBondContact OG1-CH2 3.3Å; T334-W370 WeakPolarHBondContact OG1-CZ2 3.47Å
335	P	93.2	Very high	95.4	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.032	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.9	177	-28.4	38.1	0	0	0	114	I289 D337 D338 P339 Y342 M368 L378	I289-P335 HydrophobicContact CD1-CG 3.9Å; I289-P335 HydrophobicContact CG1-CG 4.08Å; P335-D337 PolarHBondContact O-N 3.48Å; P335-D338 CarbonylContact O-C 3.59Å; P335-D338 PolarHBondContact O-N 2.84Å; P335-P339 VanDerWaalsContact O-CA 3.31Å; P335-P339 WeakPolarHBondContact O-CA 3.44Å; P335-P339 WeakPolarHBondContact O-CG 3.16Å; P335-P339 VanDerWaalsContact O-N 3.15Å; P335-Y342 HydrophobicContact CB-CD1 4.17Å; P335-Y342 HydrophobicContact CB-CD2 3.86Å; P335-Y342 HydrophobicContact CB-CE2 4.23Å; P335-Y342 HydrophobicContact CB-CG 3.83Å; P335-Y342 HydrophobicContact CG-CD2 3.79Å; P335-Y342 HydrophobicContact CG-CE2 3.76Å; P335-Y342 HydrophobicContact CG-CG 4.27Å; P335-M368 HydrophobicContact CB-CE 3.95Å; P335-M368 HydrophobicContact CB-SD 4.33Å; P335-M368 HydrophobicContact CG-CE 3.5Å; P335-M368 VanDerWaalsContact CG-CE 3.5Å; P335-M368 HydrophobicContact CG-SD 3.81Å; P335-L378 HydrophobicContact CB-CD1 3.67Å
336	S	91.8	Very high	95.4	Very high	46 Å²	46	25.8 Å²	25.8	32%	0.322	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.5	176.2	60.2	0	0	0	0	114.6	T334 W370	T334-S336 VanDerWaalsContact CG2-OG 3.3Å; T334-S336 WeakPolarHBondContact CG2-OG 3.36Å; T334-S336 PolarHBondContact O-N 2.74Å; T334-S336 VanDerWaalsContact O-N 3.08Å; T334-S336 PolarHBondContact OG1-OG 2.92Å; S336-W370 WeakPolarHBondContact OG-CH2 3.39Å
337	D	89.4	Confident	95.4	Very high	56 Å²	56	24.8 Å²	24.8	30%	0.299	14%	0.14	S	C	.	.	S	Bend	trans	-67	-43.4	-179.9	-72.9	0.4	0	0	0	110.2	C332 T334 P335 P564	C332-D337 HydrophobicContact CB-CB 4Å; C332-D337 WeakPolarHBondContact CB-OD2 3.24Å; T334-D337 HydrophobicContact CG2-CB 4.48Å; T334-D337 WeakPolarHBondContact CG2-OD1 3.27Å; T334-D337 PolarHBondContact O-N 2.89Å; T334-D337 VanDerWaalsContact O-N 3.14Å; P335-D337 PolarHBondContact O-N 3.48Å; D337-P564 WeakPolarHBondContact O-CB 3.29Å; D337-P564 WeakPolarHBondContact O-CG 3.27Å
338	D	91.6	Very high	95.4	Very high	20 Å²	20	26 Å²	26	11%	0.107	15%	0.145	C	C	.	.			trans	-149.2	84.7	174.6	-167.6	-24.7	0	0	0	110.7	P335 S340 F341 Y342 P564 D565	P335-D338 CarbonylContact O-C 3.59Å; P335-D338 PolarHBondContact O-N 2.84Å; D338-S340 VanDerWaalsContact C-N 3.33Å; D338-S340 PolarHBondContact O-N 2.83Å; D338-F341 HydrophobicContact CB-CB 4.01Å; D338-F341 PolarHBondContact O-N 3.38Å; D338-F341 WeakPolarHBondContact OD1-CB 3.4Å; D338-F341 PolarHBondContact OD1-N 3.17Å; D338-F341 WeakPolarHBondContact OD2-CB 3.3Å; D338-Y342 PolarHBondContact O-N 3.28Å; D338-P564 HydrophobicContact CB-CB 4.4Å; D338-D565 PolarHBondContact OD2-N 2.61Å
339	P	94.1	Very high	95.4	Very high	19 Å²	19	26 Å²	26	12%	0.123	15%	0.145	C	C	.	.	H	α-helix	trans	-65.7	-36.3	-173.3	-20.8	32.4	0	0	0	112.8	P335 Y342 L343 L374 L378 W420	P335-P339 VanDerWaalsContact O-CA 3.31Å; P335-P339 WeakPolarHBondContact O-CA 3.44Å; P335-P339 WeakPolarHBondContact O-CG 3.16Å; P335-P339 VanDerWaalsContact O-N 3.15Å; P339-Y342 PolarHBondContact O-N 2.79Å; P339-L343 WeakPolarHBondContact O-CG 3.46Å; P339-L343 PolarHBondContact O-N 2.86Å; P339-L374 HydrophobicContact CB-CD1 4.24Å; P339-L374 HydrophobicContact CG-CD1 4.23Å; P339-L374 HydrophobicContact CG-CD2 3.81Å; P339-L378 HydrophobicContact CB-CD1 4.42Å; P339-L378 HydrophobicContact CB-CD2 4.12Å; P339-W420 HydrophobicContact CB-CH2 3.62Å; P339-W420 HydrophobicContact CB-CZ2 3.76Å; P339-W420 HydrophobicContact CB-CZ3 4.09Å; P339-W420 HydrophobicContact CG-CH2 3.87Å; P339-W420 HydrophobicContact CG-CZ2 4.36Å; P339-W420 HydrophobicContact CG-CZ3 4.45Å
340	S	94.4	Very high	95.5	Very high	45 Å²	45	26.7 Å²	26.7	32%	0.315	15%	0.147	S	C	.	.	H	α-helix	trans	-63.7	-45.1	177.3	-72.4	0	0	0	0	111.3	D338 L343 K344 W420	D338-S340 VanDerWaalsContact C-N 3.33Å; D338-S340 PolarHBondContact O-N 2.83Å; S340-L343 PolarHBondContact O-N 2.75Å; S340-K344 WeakPolarHBondContact O-CG 3.48Å; S340-K344 PolarHBondContact O-N 3.28Å; S340-W420 WeakPolarHBondContact OG-CZ2 3.37Å; S340-W420 PolarHBondContact OG-NE1 3.3Å
341	F	95.3	Very high	95.5	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-39.9	177.3	-174.5	-112.7	0	0	0	112.2	V330 D338 L343 K344 C345 M562 N616 P617 V618	V330-F341 HydrophobicContact CG1-CD1 4.28Å; D338-F341 HydrophobicContact CB-CB 4.01Å; D338-F341 PolarHBondContact O-N 3.38Å; D338-F341 WeakPolarHBondContact OD1-CB 3.4Å; D338-F341 PolarHBondContact OD1-N 3.17Å; D338-F341 WeakPolarHBondContact OD2-CB 3.3Å; F341-L343 PolarHBondContact O-N 3.49Å; F341-K344 PolarHBondContact O-N 3.09Å; F341-C345 WeakPolarHBondContact CE1-SG 3.42Å; F341-C345 VanDerWaalsContact CZ-SG 3.52Å; F341-C345 PolarHBondContact O-N 2.85Å; F341-C345 PolarHBondContact O-SG 3.44Å; F341-M562 HydrophobicContact CD1-CE 4.26Å; F341-M562 HydrophobicContact CE1-CE 3.4Å; F341-M562 HydrophobicContact CZ-CE 3.85Å; F341-N616 HydrophobicContact CD1-CB 4.4Å; F341-N616 HydrophobicContact CD2-CB 3.78Å; F341-N616 HydrophobicContact CE1-CB 4.23Å; F341-N616 HydrophobicContact CE2-CB 3.6Å; F341-N616 VanDerWaalsContact CE2-O 3.27Å; F341-N616 WeakPolarHBondContact CE2-O 3.47Å; F341-N616 HydrophobicContact CG-CB 4.19Å; F341-N616 HydrophobicContact CZ-CB 3.84Å; F341-P617 VanDerWaalsContact CZ-O 3.29Å; F341-P617 WeakPolarHBondContact CZ-O 3.47Å; F341-V618 HydrophobicContact CD2-CG2 4.11Å; F341-V618 HydrophobicContact CE2-CG2 3.65Å
342	Y	96.9	Very high	95.7	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54.4	-48.1	173.2	169.8	-90.9	0	0	0	112.2	C287 I289 I300 P335 D338 P339 K344 C345 L346 M368 L378	C287-Y342 WeakPolarHBondContact CB-OH 3.26Å; C287-Y342 PolarHBondContact O-OH 3.16Å; I289-Y342 HydrophobicContact CD1-CD2 4.29Å; I289-Y342 HydrophobicContact CG2-CD2 4.32Å; I289-Y342 HydrophobicContact CG2-CE2 4.09Å; I300-Y342 HydrophobicContact CD1-CD2 3.76Å; I300-Y342 HydrophobicContact CD1-CE2 3.63Å; I300-Y342 HydrophobicContact CG1-CE2 4.22Å; P335-Y342 HydrophobicContact CB-CD1 4.17Å; P335-Y342 HydrophobicContact CB-CD2 3.86Å; P335-Y342 HydrophobicContact CB-CE2 4.23Å; P335-Y342 HydrophobicContact CB-CG 3.83Å; P335-Y342 HydrophobicContact CG-CD2 3.79Å; P335-Y342 HydrophobicContact CG-CE2 3.76Å; P335-Y342 HydrophobicContact CG-CG 4.27Å; D338-Y342 PolarHBondContact O-N 3.28Å; P339-Y342 PolarHBondContact O-N 2.79Å; Y342-K344 PolarHBondContact O-N 3.06Å; Y342-C345 WeakPolarHBondContact O-CB 3.43Å; Y342-C345 PolarHBondContact O-N 2.88Å; Y342-L346 PolarHBondContact O-N 3.38Å; Y342-M368 HydrophobicContact CD1-CE 4.47Å; Y342-M368 HydrophobicContact CE1-CE 3.59Å; Y342-M368 HydrophobicContact CE2-CE 4.09Å; Y342-M368 WeakPolarHBondContact OH-CE 3.31Å; Y342-L378 HydrophobicContact CD1-CD1 4.38Å; Y342-L378 HydrophobicContact CD1-CD2 4.38Å
343	L	97.1	Very high	95.9	Very high	28 Å²	28	30.2 Å²	30.2	15%	0.147	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-36.3	178.6	-69.6	175.6	0	0	0	112.8	P339 S340 F341 L346 S347 L378 E381 W420	P339-L343 WeakPolarHBondContact O-CG 3.46Å; P339-L343 PolarHBondContact O-N 2.86Å; S340-L343 PolarHBondContact O-N 2.75Å; F341-L343 PolarHBondContact O-N 3.49Å; L343-L346 HydrophobicContact CD2-CD2 4.41Å; L343-L346 WeakPolarHBondContact O-CB 3.32Å; L343-L346 PolarHBondContact O-N 3.06Å; L343-S347 PolarHBondContact O-N 2.97Å; L343-L378 HydrophobicContact CD1-CD2 3.84Å; L343-L378 HydrophobicContact CD2-CD2 3.84Å; L343-L378 HydrophobicContact CG-CD2 3.77Å; L343-E381 HydrophobicContact CD1-CB 4.22Å; L343-E381 HydrophobicContact CD1-CG 3.92Å; L343-E381 HydrophobicContact CD2-CB 3.6Å; L343-E381 HydrophobicContact CD2-CG 4.21Å; L343-W420 HydrophobicContact CD1-CB 4.04Å; L343-W420 VanDerWaalsContact CD1-CD1 3.44Å; L343-W420 HydrophobicContact CD1-CD2 4.39Å; L343-W420 HydrophobicContact CD1-CG 3.7Å
344	K	97.6	Very high	96.1	Very high	120 Å²	120	30.2 Å²	30.2	52%	0.522	17%	0.168	S	C	.	.	H	α-helix	trans	-65.3	-42.4	174.3	-67.1	172.9	-176.8	176.3	0	111.8	S340 F341 Y342 L346 S347 F348 V618	S340-K344 WeakPolarHBondContact O-CG 3.48Å; S340-K344 PolarHBondContact O-N 3.28Å; F341-K344 PolarHBondContact O-N 3.09Å; Y342-K344 PolarHBondContact O-N 3.06Å; K344-L346 VanDerWaalsContact C-N 3.33Å; K344-S347 PolarHBondContact O-N 3.49Å; K344-F348 PolarHBondContact O-N 3.47Å; K344-V618 HydrophobicContact CB-CG2 3.66Å; K344-V618 HydrophobicContact CD-CG2 4.27Å
345	C	98.2	Very high	96.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-42.5	175.8	-66.1	0	0	0	0	111.2	I300 C328 V330 F341 Y342 F348 V349	I300-C345 HydrophobicContact CD1-CB 3.89Å; C328-C345 HydrophobicContact CB-CB 4.11Å; C328-C345 PolarHBondContact SG-SG 2.89Å; V330-C345 HydrophobicContact CG2-CB 4.04Å; F341-C345 WeakPolarHBondContact CE1-SG 3.42Å; F341-C345 VanDerWaalsContact CZ-SG 3.52Å; F341-C345 PolarHBondContact O-N 2.85Å; F341-C345 PolarHBondContact O-SG 3.44Å; Y342-C345 WeakPolarHBondContact O-CB 3.43Å; Y342-C345 PolarHBondContact O-N 2.88Å; C345-F348 PolarHBondContact O-N 2.78Å; C345-V349 WeakPolarHBondContact O-CG2 3.09Å; C345-V349 PolarHBondContact O-N 3.22Å
346	L	98.3	Very high	96.4	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-58.5	-49.1	175.2	174.5	66.3	0	0	0	111.8	L285 C287 I300 Y342 L343 K344 F348 V349 Y350 Q382 L385	L285-L346 HydrophobicContact CD1-CD1 4.44Å; L285-L346 HydrophobicContact CD2-CD1 4.04Å; C287-L346 VanDerWaalsContact SG-CD1 3.51Å; I300-L346 HydrophobicContact CD1-CB 4.12Å; I300-L346 HydrophobicContact CG2-CD1 4.47Å; Y342-L346 PolarHBondContact O-N 3.38Å; L343-L346 HydrophobicContact CD2-CD2 4.41Å; L343-L346 WeakPolarHBondContact O-CB 3.32Å; L343-L346 PolarHBondContact O-N 3.06Å; K344-L346 VanDerWaalsContact C-N 3.33Å; L346-F348 PolarHBondContact O-N 3.03Å; L346-V349 PolarHBondContact O-N 3.46Å; L346-Y350 WeakPolarHBondContact O-CB 3.01Å; L346-Y350 PolarHBondContact O-N 3.49Å; L346-Q382 HydrophobicContact CD2-CB 4.33Å; L346-Q382 HydrophobicContact CD2-CG 3.35Å; L346-L385 HydrophobicContact CD2-CD2 3.85Å; L346-L385 HydrophobicContact CG-CD2 3.65Å
347	S	98.5	Very high	96.3	Very high	44 Å²	44	39 Å²	39	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-57.7	-48.4	177.1	-168.1	0	0	0	0	111.4	L343 K344 V349 Y350 D351	L343-S347 PolarHBondContact O-N 2.97Å; K344-S347 PolarHBondContact O-N 3.49Å; S347-V349 VanDerWaalsContact C-N 3.32Å; S347-V349 PolarHBondContact O-N 2.91Å; S347-Y350 PolarHBondContact O-N 2.85Å; S347-D351 VanDerWaalsContact O-CG 3.25Å; S347-D351 PolarHBondContact O-N 2.96Å
348	F	98.6	Very high	96.3	Very high	45 Å²	45	42 Å²	42	20%	0.197	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-40.9	-180	169.1	-100.6	0	0	0	113.3	R326 C328 K344 C345 L346 V618 E620	R326-F348 WeakPolarHBondContact CD-O 3.31Å; R326-F348 HydrophobicContact CG-CD1 4.29Å; R326-F348 HydrophobicContact CG-CE1 3.81Å; R326-F348 HydrophobicContact CG-CZ 4.34Å; R326-F348 PolarHBondContact NH1-O 3.36Å; C328-F348 HydrophobicContact CB-CD1 3.95Å; C328-F348 HydrophobicContact CB-CE1 4.3Å; K344-F348 PolarHBondContact O-N 3.47Å; C345-F348 PolarHBondContact O-N 2.78Å; L346-F348 PolarHBondContact O-N 3.03Å; F348-V618 HydrophobicContact CB-CG1 3.37Å; F348-V618 HydrophobicContact CD1-CG1 4.22Å; F348-V618 HydrophobicContact CD2-CG1 4.2Å; F348-V618 HydrophobicContact CG-CG1 3.68Å; F348-E620 HydrophobicContact CZ-CB 4.49Å
349	V	98.8	Very high	96.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.1	-43.1	177.3	176.1	0	0	0	0	111	L285 I300 L302 R326 C328 C345 L346 S347 D351 A352	L285-V349 HydrophobicContact CD1-CB 4.42Å; L285-V349 HydrophobicContact CD1-CG1 3.68Å; I300-V349 HydrophobicContact CB-CG2 4.24Å; I300-V349 HydrophobicContact CG2-CB 4.02Å; I300-V349 HydrophobicContact CG2-CG1 4.13Å; I300-V349 HydrophobicContact CG2-CG2 3.94Å; L302-V349 HydrophobicContact CB-CG1 3.69Å; R326-V349 HydrophobicContact CG-CB 4.44Å; R326-V349 HydrophobicContact CG-CG2 4.21Å; C328-V349 HydrophobicContact CB-CG2 3.73Å; C345-V349 WeakPolarHBondContact O-CG2 3.09Å; C345-V349 PolarHBondContact O-N 3.22Å; L346-V349 PolarHBondContact O-N 3.46Å; S347-V349 VanDerWaalsContact C-N 3.32Å; S347-V349 PolarHBondContact O-N 2.91Å; V349-D351 VanDerWaalsContact C-N 3.29Å; V349-D351 PolarHBondContact O-N 3.43Å; V349-A352 WeakPolarHBondContact O-CB 3.12Å; V349-A352 PolarHBondContact O-N 3.11Å; V349-A352 VanDerWaalsContact O-N 3.17Å
350	Y	98.7	Very high	96	Very high	18 Å²	18	45.4 Å²	45.4	7%	0.071	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-33.8	179	-178.2	-114.8	0	0	0	112.8	L285 L346 S347 A352 Y353 V354 L363 L385 V386	L285-Y350 HydrophobicContact CD2-CD2 3.97Å; L346-Y350 WeakPolarHBondContact O-CB 3.01Å; L346-Y350 PolarHBondContact O-N 3.49Å; S347-Y350 PolarHBondContact O-N 2.85Å; Y350-A352 PolarHBondContact O-N 2.67Å; Y350-A352 VanDerWaalsContact O-N 3.13Å; Y350-Y353 HydrophobicContact CD2-CD1 4.48Å; Y350-Y353 AromaticContact CE2-CD1 3.8Å; Y350-Y353 HydrophobicContact CE2-CD1 3.8Å; Y350-Y353 HydrophobicContact CE2-CG 4.47Å; Y350-Y353 WeakPolarHBondContact O-CA 3.4Å; Y350-Y353 WeakPolarHBondContact O-CB 3.33Å; Y350-Y353 PolarHBondContact O-N 3.34Å; Y350-V354 HydrophobicContact CD1-CG2 3.9Å; Y350-V354 HydrophobicContact CE1-CG2 3.53Å; Y350-V354 PolarHBondContact O-N 3.05Å; Y350-L363 HydrophobicContact CD2-CD2 4.49Å; Y350-L363 HydrophobicContact CE2-CD2 3.86Å; Y350-L385 HydrophobicContact CD1-CD1 4.05Å; Y350-L385 HydrophobicContact CD1-CD2 4.23Å; Y350-L385 HydrophobicContact CD1-CG 3.81Å; Y350-L385 HydrophobicContact CE1-CG 4.33Å; Y350-L385 WeakPolarHBondContact CE1-O 3.25Å; Y350-L385 HydrophobicContact CG-CD2 4.36Å; Y350-L385 HydrophobicContact CG-CG 4.38Å; Y350-V386 HydrophobicContact CD2-CG2 4.25Å; Y350-V386 HydrophobicContact CE2-CB 4.47Å; Y350-V386 HydrophobicContact CE2-CG1 4.37Å; Y350-V386 HydrophobicContact CE2-CG2 4.11Å; Y350-V386 PolarHBondContact OH-O 3.45Å
351	D	98.5	Very high	95.8	Very high	67 Å²	67	43.6 Å²	43.6	36%	0.358	23%	0.233	S	C	.	.	H	α-helix	trans	-56.5	-30.2	175.7	-74.4	-19.1	0	0	0	112.4	S347 V349 Y353 V354 N355	S347-D351 VanDerWaalsContact O-CG 3.25Å; S347-D351 PolarHBondContact O-N 2.96Å; V349-D351 VanDerWaalsContact C-N 3.29Å; V349-D351 PolarHBondContact O-N 3.43Å; D351-Y353 VanDerWaalsContact C-N 3.29Å; D351-Y353 PolarHBondContact O-N 2.76Å; D351-V354 PolarHBondContact O-N 3.05Å; D351-N355 WeakPolarHBondContact O-CB 3.3Å; D351-N355 PolarHBondContact O-N 2.96Å; D351-N355 PolarHBondContact O-ND2 3.35Å
352	A	98.3	Very high	95.7	Very high	13 Å²	13	44.3 Å²	44.3	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-35.9	174.1	0	0	0	0	0	112.3	L302 R326 V349 Y350 L356	L302-A352 HydrophobicContact CD2-CB 3.71Å; R326-A352 HydrophobicContact CB-CB 3.64Å; R326-A352 HydrophobicContact CG-CB 4.29Å; V349-A352 WeakPolarHBondContact O-CB 3.12Å; V349-A352 PolarHBondContact O-N 3.11Å; V349-A352 VanDerWaalsContact O-N 3.17Å; Y350-A352 PolarHBondContact O-N 2.67Å; Y350-A352 VanDerWaalsContact O-N 3.13Å; A352-L356 PolarHBondContact O-N 3.11Å
353	Y	98.2	Very high	95.7	Very high	12 Å²	12	44.4 Å²	44.4	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-70.1	-43.4	175.3	175.8	-97.4	0	0	0	111.3	K247 A283 L302 Y350 D351 N355 L356 K360 P361 L363	K247-Y353 HydrophobicContact CD-CE1 4.4Å; A283-Y353 HydrophobicContact CB-CD2 4.05Å; A283-Y353 HydrophobicContact CB-CE2 4.04Å; L302-Y353 VanDerWaalsContact CD2-N 3.32Å; Y350-Y353 HydrophobicContact CD2-CD1 4.48Å; Y350-Y353 AromaticContact CE2-CD1 3.8Å; Y350-Y353 HydrophobicContact CE2-CD1 3.8Å; Y350-Y353 HydrophobicContact CE2-CG 4.47Å; Y350-Y353 WeakPolarHBondContact O-CA 3.4Å; Y350-Y353 WeakPolarHBondContact O-CB 3.33Å; Y350-Y353 PolarHBondContact O-N 3.34Å; D351-Y353 VanDerWaalsContact C-N 3.29Å; D351-Y353 PolarHBondContact O-N 2.76Å; Y353-N355 PolarHBondContact O-N 2.76Å; Y353-L356 HydrophobicContact CD2-CD1 3.95Å; Y353-L356 HydrophobicContact CE2-CD1 4.5Å; Y353-L356 WeakPolarHBondContact O-CB 3.07Å; Y353-L356 PolarHBondContact O-N 2.86Å; Y353-L356 VanDerWaalsContact O-N 3.14Å; Y353-K360 HydrophobicContact CE1-CD 4.12Å; Y353-K360 HydrophobicContact CE2-CB 4.43Å; Y353-K360 HydrophobicContact CE2-CD 4.5Å; Y353-K360 WeakPolarHBondContact O-CE 3.41Å; Y353-P361 WeakPolarHBondContact CE2-O 3.2Å; Y353-P361 PolarHBondContact OH-O 3.03Å; Y353-P361 VanDerWaalsContact OH-O 3.13Å; Y353-L363 HydrophobicContact CD1-CD2 3.93Å; Y353-L363 HydrophobicContact CD2-CB 4.42Å; Y353-L363 HydrophobicContact CD2-CD1 4.06Å; Y353-L363 HydrophobicContact CD2-CD2 4.37Å; Y353-L363 HydrophobicContact CE1-CB 4.33Å; Y353-L363 HydrophobicContact CE1-CD2 3.9Å; Y353-L363 HydrophobicContact CE2-CB 3.76Å; Y353-L363 HydrophobicContact CE2-CD1 4.22Å; Y353-L363 HydrophobicContact CE2-CD2 4.34Å; Y353-L363 HydrophobicContact CE2-CG 4.33Å; Y353-L363 HydrophobicContact CG-CD1 4.46Å; Y353-L363 HydrophobicContact CG-CD2 4.17Å
354	V	97.6	Very high	95.7	Very high	63 Å²	63	43.1 Å²	43.1	38%	0.382	23%	0.229	S	C	.	.	H	α-helix	trans	-57.9	-38.9	178.2	176.6	0	0	0	0	111.1	Y350 D351 L356 K360	Y350-V354 HydrophobicContact CD1-CG2 3.9Å; Y350-V354 HydrophobicContact CE1-CG2 3.53Å; Y350-V354 PolarHBondContact O-N 3.05Å; D351-V354 PolarHBondContact O-N 3.05Å; V354-L356 VanDerWaalsContact C-N 3.34Å; V354-L356 PolarHBondContact O-N 3.44Å; V354-K360 WeakPolarHBondContact O-CE 3.33Å; V354-K360 PolarHBondContact O-NZ 3.2Å
355	N	97.2	Very high	95.8	Very high	124 Å²	124	37.4 Å²	37.4	66%	0.663	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	1	-178.6	-69	-50.7	0	0	0	114.8	D351 Y353	D351-N355 WeakPolarHBondContact O-CB 3.3Å; D351-N355 PolarHBondContact O-N 2.96Å; D351-N355 PolarHBondContact O-ND2 3.35Å; Y353-N355 PolarHBondContact O-N 2.76Å
356	L	94.8	Very high	95.8	Very high	34 Å²	34	37.4 Å²	37.4	18%	0.178	20%	0.204	C	C	.	.	S	Bend	trans	-63.9	144.7	171.9	-76.2	174.2	0	0	0	111	L325 A352 Y353 V354 K360 P361	L325-L356 HydrophobicContact CD1-CD1 4.1Å; L325-L356 HydrophobicContact CD1-CD2 3.91Å; L325-L356 HydrophobicContact CD1-CG 4.41Å; A352-L356 PolarHBondContact O-N 3.11Å; Y353-L356 HydrophobicContact CD2-CD1 3.95Å; Y353-L356 HydrophobicContact CE2-CD1 4.5Å; Y353-L356 WeakPolarHBondContact O-CB 3.07Å; Y353-L356 PolarHBondContact O-N 2.86Å; Y353-L356 VanDerWaalsContact O-N 3.14Å; V354-L356 VanDerWaalsContact C-N 3.34Å; V354-L356 PolarHBondContact O-N 3.44Å; L356-K360 HydrophobicContact CB-CD 4.44Å; L356-K360 HydrophobicContact CB-CG 4.03Å; L356-K360 WeakPolarHBondContact O-CE 3.27Å; L356-P361 HydrophobicContact CD1-CG 4.22Å
357	P	91.2	Very high	95.7	Very high	104 Å²	104	37.3 Å²	37.3	68%	0.675	20%	0.204	S	C	*	.	P	Polyproline II helix	trans	-65.1	147.7	174.4	28	-34.2	0	0	0	111.1	P359	P357-P359 CarbonylContact O-C 3.59Å
358	E	89.2	Confident	95.4	Very high	118 Å²	118	35.5 Å²	35.5	55%	0.551	19%	0.191	S	C	*	.	S	Bend	trans	-76.8	147.8	171.6	-65.2	-62.3	161	0	0	111.1	K360	E358-K360 WeakPolarHBondContact OE1-CE 3.45Å; E358-K360 IonicContact OE1-NZ 3.29Å; E358-K360 PolarHBondContact OE1-NZ 2.94Å; E358-K360 PolarHBondContact OE2-N 3.16Å
359	P	88	Confident	95	Very high	56 Å²	56	34 Å²	34	36%	0.364	19%	0.187	S	C	.	.	S	Bend	cis	-74.8	129.1	-4.6	29.3	-31.3	0	0	0	111.9	P276 L277 P357	P276-P359 HydrophobicContact CB-CB 4.26Å; P276-P359 HydrophobicContact CB-CG 3.93Å; P276-P359 HydrophobicContact CG-CB 3.88Å; P276-P359 HydrophobicContact CG-CG 3.92Å; L277-P359 HydrophobicContact CD2-CG 3.73Å; L277-P359 VanDerWaalsContact CD2-O 3.32Å; L277-P359 WeakPolarHBondContact CD2-O 3.25Å; L277-P359 HydrophobicContact CG-CG 4.13Å; P357-P359 CarbonylContact O-C 3.59Å
360	K	90.1	Very high	94.5	Very high	55 Å²	55	39 Å²	39	24%	0.239	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-68.8	147.3	177.8	-70.4	179.4	179.4	113.1	0	112.2	Y353 V354 L356 E358	Y353-K360 HydrophobicContact CE1-CD 4.12Å; Y353-K360 HydrophobicContact CE2-CB 4.43Å; Y353-K360 HydrophobicContact CE2-CD 4.5Å; Y353-K360 WeakPolarHBondContact O-CE 3.41Å; V354-K360 WeakPolarHBondContact O-CE 3.33Å; V354-K360 PolarHBondContact O-NZ 3.2Å; L356-K360 HydrophobicContact CB-CD 4.44Å; L356-K360 HydrophobicContact CB-CG 4.03Å; L356-K360 WeakPolarHBondContact O-CE 3.27Å; E358-K360 WeakPolarHBondContact OE1-CE 3.45Å; E358-K360 IonicContact OE1-NZ 3.29Å; E358-K360 PolarHBondContact OE1-NZ 2.94Å; E358-K360 PolarHBondContact OE2-N 3.16Å
361	P	91.9	Very high	93.9	Very high	8 Å²	8	38.9 Å²	38.9	5%	0.052	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-65.3	151.1	167.5	29.8	-34.6	0	0	0	111.6	Y275 L277 A283 L304 Y353 L356 L363	Y275-P361 HydrophobicContact CE1-CB 4.14Å; Y275-P361 WeakPolarHBondContact OH-CA 3.35Å; L277-P361 HydrophobicContact CD1-CB 4.38Å; A283-P361 HydrophobicContact CB-CB 4.43Å; A283-P361 HydrophobicContact CB-CG 3.92Å; L304-P361 HydrophobicContact CD2-CG 3.94Å; Y353-P361 WeakPolarHBondContact CE2-O 3.2Å; Y353-P361 PolarHBondContact OH-O 3.03Å; Y353-P361 VanDerWaalsContact OH-O 3.13Å; L356-P361 HydrophobicContact CD1-CG 4.22Å; P361-L363 PolarHBondContact O-N 2.62Å
362	R	92.2	Very high	93.4	Very high	21 Å²	21	41.6 Å²	41.6	8%	0.079	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-54.4	137.7	169.1	-68.2	-168.2	175.7	81.8	-0.4	109.7	L232 V245 R246 V273 Y275 V282 A283	L232-R362 PolarHBondContact O-NE 3.15Å; L232-R362 PolarHBondContact O-NH2 3.42Å; V245-R362 PolarHBondContact O-NE 3.45Å; R246-R362 CarbonylContact O-C 3.51Å; R246-R362 VanDerWaalsContact O-CA 3.26Å; R246-R362 WeakPolarHBondContact O-CA 3.31Å; V273-R362 VanDerWaalsContact CG1-CZ 3.44Å; Y275-R362 PolarHBondContact OH-N 3.34Å; V282-R362 WeakPolarHBondContact CG2-O 3.14Å; A283-R362 PolarHBondContact N-O 2.92Å
363	L	96.5	Very high	93	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122	-179.7	-179.5	64	0	0	0	110.2	R246 K247 L248 A283 L285 L302 Y350 Y353 P361 V365 V386	R246-L363 PolarHBondContact O-N 2.91Å; K247-L363 WeakPolarHBondContact CA-O 3.48Å; K247-L363 HydrophobicContact CG-CB 4.13Å; K247-L363 HydrophobicContact CG-CD2 4.26Å; L248-L363 PolarHBondContact N-O 2.69Å; A283-L363 HydrophobicContact CB-CD1 3.87Å; A283-L363 CarbonylContact O-C 3.57Å; A283-L363 WeakPolarHBondContact O-CA 3.07Å; L285-L363 HydrophobicContact CB-CD1 3.93Å; L302-L363 HydrophobicContact CD1-CD1 4.08Å; Y350-L363 HydrophobicContact CD2-CD2 4.49Å; Y350-L363 HydrophobicContact CE2-CD2 3.86Å; Y353-L363 HydrophobicContact CD1-CD2 3.93Å; Y353-L363 HydrophobicContact CD2-CB 4.42Å; Y353-L363 HydrophobicContact CD2-CD1 4.06Å; Y353-L363 HydrophobicContact CD2-CD2 4.37Å; Y353-L363 HydrophobicContact CE1-CB 4.33Å; Y353-L363 HydrophobicContact CE1-CD2 3.9Å; Y353-L363 HydrophobicContact CE2-CB 3.76Å; Y353-L363 HydrophobicContact CE2-CD1 4.22Å; Y353-L363 HydrophobicContact CE2-CD2 4.34Å; Y353-L363 HydrophobicContact CE2-CG 4.33Å; Y353-L363 HydrophobicContact CG-CD1 4.46Å; Y353-L363 HydrophobicContact CG-CD2 4.17Å; P361-L363 PolarHBondContact O-N 2.62Å; L363-V365 HydrophobicContact CD2-CG2 3.87Å; L363-V365 HydrophobicContact CG-CG2 3.84Å; L363-V386 HydrophobicContact CD2-CG1 4.35Å
364	L	98.1	Very high	92.6	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130	163.6	-58.3	-178.9	0	0	0	109	L248 L262 L265 S266 I269 V282 A283 V284 L285	L248-L364 HydrophobicContact CB-CD2 3.95Å; L248-L364 HydrophobicContact CD1-CD2 4.43Å; L248-L364 HydrophobicContact CD2-CD2 4.24Å; L248-L364 HydrophobicContact CG-CD2 4.45Å; L248-L364 CarbonylContact O-C 3.6Å; L248-L364 WeakPolarHBondContact O-CA 3.27Å; L262-L364 HydrophobicContact CD1-CB 3.6Å; L262-L364 HydrophobicContact CD1-CD1 3.99Å; L262-L364 HydrophobicContact CD1-CG 4.45Å; L265-L364 HydrophobicContact CB-CD1 4.06Å; L265-L364 HydrophobicContact CB-CD2 4.46Å; S266-L364 WeakPolarHBondContact OG-CD1 3.48Å; I269-L364 HydrophobicContact CD1-CD1 4.18Å; I269-L364 HydrophobicContact CD1-CD2 3.88Å; I269-L364 HydrophobicContact CD1-CG 4.2Å; V282-L364 HydrophobicContact CG2-CD1 3.93Å; V282-L364 HydrophobicContact CG2-CG 3.84Å; A283-L364 PolarHBondContact O-N 3.33Å; V284-L364 CarbonylContact C-O 3.56Å; V284-L364 VanDerWaalsContact CA-O 3.31Å; V284-L364 WeakPolarHBondContact CA-O 3.23Å; V284-L364 HydrophobicContact CG2-CB 4.45Å; L285-L364 PolarHBondContact N-O 3.12Å
365	V	98.6	Very high	92.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.5	177.2	-174.3	0	0	0	0	109.5	L248 L249 I250 L285 L363 T367 V386	L248-V365 PolarHBondContact O-N 3.33Å; L249-V365 HydrophobicContact CB-CB 4.24Å; L249-V365 HydrophobicContact CD1-CB 4.46Å; L249-V365 HydrophobicContact CD1-CG1 4.23Å; L249-V365 HydrophobicContact CG-CB 4.23Å; L249-V365 HydrophobicContact CG-CG1 4.36Å; I250-V365 PolarHBondContact N-O 3.12Å; L285-V365 HydrophobicContact CB-CG1 4.46Å; L285-V365 HydrophobicContact CB-CG2 4.25Å; L285-V365 HydrophobicContact CD2-CG1 4.09Å; L285-V365 HydrophobicContact CD2-CG2 4.28Å; L285-V365 HydrophobicContact CG-CG1 4.41Å; L285-V365 WeakPolarHBondContact O-CA 3.49Å; L363-V365 HydrophobicContact CD2-CG2 3.87Å; L363-V365 HydrophobicContact CG-CG2 3.84Å; V365-T367 HydrophobicContact CG1-CG2 4.48Å; V365-V386 HydrophobicContact CG2-CG1 3.93Å; V365-V386 HydrophobicContact CG2-CG2 4.41Å
366	N	97.9	Very high	92	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.7	173.1	-179.5	47.3	0	0	0	109.8	L262 L285 D286 C287	L262-N366 HydrophobicContact CD1-CB 4.39Å; L262-N366 HydrophobicContact CD2-CB 4.01Å; L285-N366 PolarHBondContact O-N 3.42Å; D286-N366 PolarHBondContact OD1-ND2 2.84Å; C287-N366 WeakPolarHBondContact CB-O 3.4Å; C287-N366 PolarHBondContact N-O 2.86Å
367	T	96.8	Very high	92	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.			trans	-104.3	160.8	-179	76.3	0	0	0	0	112.9	L249 I250 C251 K258 V365 L379	L249-T367 HydrophobicContact CD1-CG2 4.13Å; L249-T367 HydrophobicContact CD2-CG2 3.86Å; L249-T367 HydrophobicContact CG-CG2 3.84Å; I250-T367 WeakPolarHBondContact O-CG2 3.25Å; I250-T367 PolarHBondContact O-N 3.14Å; I250-T367 PolarHBondContact O-OG1 2.98Å; I250-T367 VanDerWaalsContact O-OG1 3.07Å; C251-T367 WeakPolarHBondContact CA-OG1 3.32Å; K258-T367 WeakPolarHBondContact CE-O 3.29Å; V365-T367 HydrophobicContact CG1-CG2 4.48Å; T367-L379 HydrophobicContact CG2-CD1 3.78Å
368	M	93.3	Very high	92.2	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.03	18%	0.175	C	C	.	.			trans	-60.3	156.8	169	72.4	-177.5	81.7	0	0	112.4	P335 Y342 W370 L378	P335-M368 HydrophobicContact CB-CE 3.95Å; P335-M368 HydrophobicContact CB-SD 4.33Å; P335-M368 HydrophobicContact CG-CE 3.5Å; P335-M368 VanDerWaalsContact CG-CE 3.5Å; P335-M368 HydrophobicContact CG-SD 3.81Å; Y342-M368 HydrophobicContact CD1-CE 4.47Å; Y342-M368 HydrophobicContact CE1-CE 3.59Å; Y342-M368 HydrophobicContact CE2-CE 4.09Å; Y342-M368 WeakPolarHBondContact OH-CE 3.31Å; M368-W370 VanDerWaalsContact C-N 3.28Å; M368-W370 HydrophobicContact CG-CB 4.23Å; M368-W370 PolarHBondContact O-N 3.01Å; M368-W370 HydrophobicContact SD-CB 4.14Å; M368-W370 HydrophobicContact SD-CG 4.35Å; M368-L378 HydrophobicContact CE-CB 4.09Å; M368-L378 HydrophobicContact CE-CD1 4.02Å; M368-L378 HydrophobicContact SD-CD1 4.36Å
369	G	89.5	Confident	92.5	Very high	12 Å²	12	27.3 Å²	27.3	12%	0.124	15%	0.149	C	C	.	.	S	Bend	trans	-83	17.3	-179.5	0	0	0	0	0	116.7	K254	K254-G369 PolarHBondContact N-O 3.35Å; K254-G369 VanDerWaalsContact N-O 3.15Å
370	W	88.3	Confident	92.8	Very high	107 Å²	107	24.7 Å²	24.7	41%	0.405	13%	0.132	S	C	.	.			trans	-97.4	110.2	-176.5	-69.9	30.8	0	0	0	110.3	T334 S336 M368 G375	T334-W370 WeakPolarHBondContact OG1-CH2 3.3Å; T334-W370 WeakPolarHBondContact OG1-CZ2 3.47Å; S336-W370 WeakPolarHBondContact OG-CH2 3.39Å; M368-W370 VanDerWaalsContact C-N 3.28Å; M368-W370 HydrophobicContact CG-CB 4.23Å; M368-W370 PolarHBondContact O-N 3.01Å; M368-W370 HydrophobicContact SD-CB 4.14Å; M368-W370 HydrophobicContact SD-CG 4.35Å; W370-G375 CarbonylContact O-C 3.36Å
371	M	86.5	Confident	93.1	Very high	15 Å²	15	23.2 Å²	23.2	7%	0.074	13%	0.126	C	C	.	.			trans	-111.5	18.3	-170	-69.1	-48.9	-70.5	0	0	112.6	C251 G252 P253 L379 V406	C251-M371 HydrophobicContact CB-CE 4.41Å; G252-M371 PolarHBondContact N-SD 2.79Å; P253-M371 HydrophobicContact CB-CG 4.12Å; M371-L379 HydrophobicContact CE-CD2 3.82Å; M371-L379 HydrophobicContact SD-CD2 4.03Å; M371-V406 HydrophobicContact CB-CG2 3.45Å; M371-V406 VanDerWaalsContact CB-CG2 3.45Å; M371-V406 HydrophobicContact CE-CB 4.13Å; M371-V406 HydrophobicContact CE-CG2 3.42Å; M371-V406 VanDerWaalsContact CE-CG2 3.42Å; M371-V406 HydrophobicContact CG-CG2 4.16Å; M371-V406 WeakPolarHBondContact O-CG2 3.47Å; M371-V406 HydrophobicContact SD-CG2 4.47Å
372	Q	87.2	Confident	93.3	Very high	123 Å²	123	22.9 Å²	22.9	58%	0.575	12%	0.124	S	C	*	.	S	Bend	trans	-150.5	157.3	-178.1	62.2	176.2	22.1	0	0	111.3	L374 G375 R403	Q372-L374 PolarHBondContact O-N 3.36Å; Q372-G375 PolarHBondContact O-N 3.46Å; Q372-G375 VanDerWaalsContact O-N 3.13Å; Q372-R403 PolarHBondContact OE1-O 3.33Å; Q372-R403 VanDerWaalsContact OE1-O 3.11Å
373	G	89.4	Confident	93.5	Very high	55 Å²	55	22 Å²	22	57%	0.567	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	-132.1	178.6	0	0	0	0	0	111.8	G375 L376 T377	G373-G375 PolarHBondContact O-N 2.87Å; G373-G375 VanDerWaalsContact O-N 3.12Å; G373-L376 WeakPolarHBondContact O-CB 3.45Å; G373-L376 PolarHBondContact O-N 3.32Å; G373-T377 PolarHBondContact O-N 3.12Å
374	L	91.1	Very high	93.5	Very high	56 Å²	56	22.6 Å²	22.6	29%	0.293	12%	0.124	S	C	.	.	H	α-helix	trans	-50.3	-38.8	178.1	178.3	61.9	0	0	0	113.7	P339 Q372 L376 T377 L378 W420	P339-L374 HydrophobicContact CB-CD1 4.24Å; P339-L374 HydrophobicContact CG-CD1 4.23Å; P339-L374 HydrophobicContact CG-CD2 3.81Å; Q372-L374 PolarHBondContact O-N 3.36Å; L374-L376 VanDerWaalsContact C-N 3.28Å; L374-L376 PolarHBondContact O-N 2.92Å; L374-T377 PolarHBondContact O-N 3.03Å; L374-L378 HydrophobicContact CD1-CD1 4.45Å; L374-L378 HydrophobicContact CD1-CG 4.23Å; L374-L378 HydrophobicContact CG-CD1 4.22Å; L374-L378 HydrophobicContact CG-CG 4.4Å; L374-L378 WeakPolarHBondContact O-CG 3.49Å; L374-L378 PolarHBondContact O-N 3.17Å; L374-W420 HydrophobicContact CD1-CE3 3.88Å; L374-W420 HydrophobicContact CD1-CH2 4.24Å; L374-W420 HydrophobicContact CD1-CZ3 3.37Å
375	G	91.5	Very high	93.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.7	-35.8	-179.8	0	0	0	0	0	113.2	W370 Q372 G373 L378 L379	W370-G375 CarbonylContact O-C 3.36Å; Q372-G375 PolarHBondContact O-N 3.46Å; Q372-G375 VanDerWaalsContact O-N 3.13Å; G373-G375 PolarHBondContact O-N 2.87Å; G373-G375 VanDerWaalsContact O-N 3.12Å; G375-L378 PolarHBondContact O-N 3.23Å; G375-L379 WeakPolarHBondContact O-CB 3.33Å; G375-L379 PolarHBondContact O-N 3.38Å
376	L	91.1	Very high	93.4	Very high	32 Å²	32	25.1 Å²	25.1	17%	0.168	14%	0.137	C	C	.	.	H	α-helix	trans	-71.7	-40.1	178	-170.2	53.4	0	0	0	111.4	G373 L374 L378 L379 L380 V406 L409 M417	G373-L376 WeakPolarHBondContact O-CB 3.45Å; G373-L376 PolarHBondContact O-N 3.32Å; L374-L376 VanDerWaalsContact C-N 3.28Å; L374-L376 PolarHBondContact O-N 2.92Å; L376-L378 PolarHBondContact O-N 2.88Å; L376-L379 HydrophobicContact CD1-CD2 4.27Å; L376-L379 WeakPolarHBondContact O-CB 3.21Å; L376-L379 PolarHBondContact O-N 2.89Å; L376-L380 PolarHBondContact O-N 3.43Å; L376-V406 HydrophobicContact CD1-CG1 3.57Å; L376-V406 HydrophobicContact CD1-CG2 4.43Å; L376-V406 HydrophobicContact CD2-CG1 4Å; L376-V406 HydrophobicContact CG-CG1 4.44Å; L376-L409 HydrophobicContact CD1-CD2 4.37Å; L376-M417 HydrophobicContact CD1-CE 3.73Å; L376-M417 HydrophobicContact CD1-SD 4.34Å; L376-M417 HydrophobicContact CD2-CE 3.64Å; L376-M417 HydrophobicContact CG-CE 3.76Å; L376-M417 HydrophobicContact CG-SD 4.25Å
377	T	93.7	Very high	93.3	Very high	23 Å²	23	30.4 Å²	30.4	14%	0.141	16%	0.16	C	C	.	.	H	α-helix	trans	-58.6	-46.1	171	-60.2	0	0	0	0	111.4	G373 L374 L379 L380 E381 D418 T419 W420	G373-T377 PolarHBondContact O-N 3.12Å; L374-T377 PolarHBondContact O-N 3.03Å; T377-L379 VanDerWaalsContact C-N 3.3Å; T377-L379 PolarHBondContact O-N 2.79Å; T377-L380 WeakPolarHBondContact O-CB 3.37Å; T377-L380 PolarHBondContact O-N 3.27Å; T377-E381 WeakPolarHBondContact O-CG 3.34Å; T377-E381 PolarHBondContact O-N 3.05Å; T377-D418 WeakPolarHBondContact CG2-O 3.31Å; T377-D418 PolarHBondContact OG1-O 3.26Å; T377-D418 VanDerWaalsContact OG1-O 3.1Å; T377-T419 VanDerWaalsContact CG2-C 3.4Å; T377-W420 HydrophobicContact CG2-CB 3.94Å; T377-W420 HydrophobicContact CG2-CE3 4.22Å
378	L	95.2	Very high	93.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-30.5	176.6	-67.1	178.9	0	0	0	113.2	P335 P339 Y342 L343 M368 L374 G375 L376 Q382	P335-L378 HydrophobicContact CB-CD1 3.67Å; P339-L378 HydrophobicContact CB-CD1 4.42Å; P339-L378 HydrophobicContact CB-CD2 4.12Å; Y342-L378 HydrophobicContact CD1-CD1 4.38Å; Y342-L378 HydrophobicContact CD1-CD2 4.38Å; L343-L378 HydrophobicContact CD1-CD2 3.84Å; L343-L378 HydrophobicContact CD2-CD2 3.84Å; L343-L378 HydrophobicContact CG-CD2 3.77Å; M368-L378 HydrophobicContact CE-CB 4.09Å; M368-L378 HydrophobicContact CE-CD1 4.02Å; M368-L378 HydrophobicContact SD-CD1 4.36Å; L374-L378 HydrophobicContact CD1-CD1 4.45Å; L374-L378 HydrophobicContact CD1-CG 4.23Å; L374-L378 HydrophobicContact CG-CD1 4.22Å; L374-L378 HydrophobicContact CG-CG 4.4Å; L374-L378 WeakPolarHBondContact O-CG 3.49Å; L374-L378 PolarHBondContact O-N 3.17Å; G375-L378 PolarHBondContact O-N 3.23Å; L376-L378 PolarHBondContact O-N 2.88Å; L378-Q382 WeakPolarHBondContact O-CG 3.4Å; L378-Q382 PolarHBondContact O-N 2.97Å; L378-Q382 VanDerWaalsContact O-N 3.13Å; L378-Q382 PolarHBondContact O-NE2 2.94Å
379	L	95.4	Very high	93.4	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-68.6	-41.1	173	178.2	61	0	0	0	111.3	L249 C251 T367 M371 G375 L376 T377 Q382 I383 L409	L249-L379 HydrophobicContact CD2-CD1 4.22Å; C251-L379 HydrophobicContact CB-CD1 4.15Å; C251-L379 HydrophobicContact CB-CD2 4.08Å; T367-L379 HydrophobicContact CG2-CD1 3.78Å; M371-L379 HydrophobicContact CE-CD2 3.82Å; M371-L379 HydrophobicContact SD-CD2 4.03Å; G375-L379 WeakPolarHBondContact O-CB 3.33Å; G375-L379 PolarHBondContact O-N 3.38Å; L376-L379 HydrophobicContact CD1-CD2 4.27Å; L376-L379 WeakPolarHBondContact O-CB 3.21Å; L376-L379 PolarHBondContact O-N 2.89Å; T377-L379 VanDerWaalsContact C-N 3.3Å; T377-L379 PolarHBondContact O-N 2.79Å; L379-Q382 WeakPolarHBondContact O-CB 3.33Å; L379-Q382 PolarHBondContact O-N 3.48Å; L379-I383 HydrophobicContact CG-CD1 4.21Å; L379-I383 WeakPolarHBondContact O-CG1 3.35Å; L379-I383 PolarHBondContact O-N 2.93Å; L379-L409 HydrophobicContact CD2-CD1 3.8Å
380	L	95.3	Very high	93.6	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-44.6	174.3	174.3	60.3	0	0	0	111.4	L376 T377 Q382 I383 L384 L414 M417 T419 I425 F430	L376-L380 PolarHBondContact O-N 3.43Å; T377-L380 WeakPolarHBondContact O-CB 3.37Å; T377-L380 PolarHBondContact O-N 3.27Å; L380-Q382 VanDerWaalsContact C-N 3.29Å; L380-Q382 PolarHBondContact O-N 3.46Å; L380-I383 WeakPolarHBondContact O-CB 3.44Å; L380-I383 PolarHBondContact O-N 2.9Å; L380-I383 VanDerWaalsContact O-N 3.08Å; L380-L384 HydrophobicContact CD1-CD1 4.18Å; L380-L384 HydrophobicContact CD1-CG 4.12Å; L380-L384 HydrophobicContact CG-CD1 4.01Å; L380-L384 HydrophobicContact CG-CG 4.42Å; L380-L384 WeakPolarHBondContact O-CG 3.19Å; L380-L384 PolarHBondContact O-N 3.07Å; L380-L414 HydrophobicContact CD1-CB 4.29Å; L380-L414 HydrophobicContact CD1-CD2 4.04Å; L380-M417 HydrophobicContact CD2-CB 3.75Å; L380-T419 HydrophobicContact CD2-CG2 3.58Å; L380-T419 HydrophobicContact CG-CG2 4.38Å; L380-I425 HydrophobicContact CD2-CD1 4.15Å; L380-F430 HydrophobicContact CD1-CE1 4.26Å; L380-F430 HydrophobicContact CD1-CZ 4.16Å
381	E	96	Very high	94	Very high	25 Å²	25	27.1 Å²	27.1	12%	0.117	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-38.4	174.9	-65.8	-58.3	148.1	0	0	112.4	L343 T377 L384 L385 W420	L343-E381 HydrophobicContact CD1-CB 4.22Å; L343-E381 HydrophobicContact CD1-CG 3.92Å; L343-E381 HydrophobicContact CD2-CB 3.6Å; L343-E381 HydrophobicContact CD2-CG 4.21Å; T377-E381 WeakPolarHBondContact O-CG 3.34Å; T377-E381 PolarHBondContact O-N 3.05Å; E381-L384 PolarHBondContact O-N 3.34Å; E381-L385 WeakPolarHBondContact O-CB 3.44Å; E381-L385 PolarHBondContact O-N 2.85Å; E381-W420 HydrophobicContact CG-CB 3.62Å; E381-W420 WeakPolarHBondContact OE1-CB 3.33Å; E381-W420 PolarHBondContact OE1-N 2.96Å
382	Q	96.5	Very high	94.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-43.6	172.5	-79.4	162.6	79.7	0	0	111.9	L346 L378 L379 L380 L385 V386	L346-Q382 HydrophobicContact CD2-CB 4.33Å; L346-Q382 HydrophobicContact CD2-CG 3.35Å; L378-Q382 WeakPolarHBondContact O-CG 3.4Å; L378-Q382 PolarHBondContact O-N 2.97Å; L378-Q382 VanDerWaalsContact O-N 3.13Å; L378-Q382 PolarHBondContact O-NE2 2.94Å; L379-Q382 WeakPolarHBondContact O-CB 3.33Å; L379-Q382 PolarHBondContact O-N 3.48Å; L380-Q382 VanDerWaalsContact C-N 3.29Å; L380-Q382 PolarHBondContact O-N 3.46Å; Q382-L385 PolarHBondContact O-N 2.72Å; Q382-V386 WeakPolarHBondContact O-CB 3.47Å; Q382-V386 WeakPolarHBondContact O-CG2 3.49Å; Q382-V386 PolarHBondContact O-N 2.88Å
383	I	96.7	Very high	94.9	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-64.1	-44.4	178	-67.5	164.4	0	0	0	110.5	L249 L379 L380 L385 K387 P388 I391 L409 L414 F430	L249-I383 HydrophobicContact CD1-CG1 4.02Å; L379-I383 HydrophobicContact CG-CD1 4.21Å; L379-I383 WeakPolarHBondContact O-CG1 3.35Å; L379-I383 PolarHBondContact O-N 2.93Å; L380-I383 WeakPolarHBondContact O-CB 3.44Å; L380-I383 PolarHBondContact O-N 2.9Å; L380-I383 VanDerWaalsContact O-N 3.08Å; I383-L385 VanDerWaalsContact C-N 3.35Å; I383-L385 PolarHBondContact O-N 3.34Å; I383-K387 WeakPolarHBondContact O-CA 3.49Å; I383-K387 PolarHBondContact O-N 2.98Å; I383-P388 HydrophobicContact CG2-CG 4.37Å; I383-P388 WeakPolarHBondContact O-CD 3.49Å; I383-I391 HydrophobicContact CD1-CD1 3.78Å; I383-I391 HydrophobicContact CG1-CD1 4.01Å; I383-I391 HydrophobicContact CG2-CD1 4.31Å; I383-L409 HydrophobicContact CD1-CD1 4.4Å; I383-L414 HydrophobicContact CD1-CD1 4.43Å; I383-L414 HydrophobicContact CD1-CD2 3.98Å; I383-L414 HydrophobicContact CG2-CD1 4.19Å; I383-F430 HydrophobicContact CG2-CD1 4.18Å; I383-F430 HydrophobicContact CG2-CE1 4.14Å
384	L	96.1	Very high	95	Very high	13 Å²	13	18.5 Å²	18.5	7%	0.068	9%	0.093	C	C	.	.	H	α-helix	trans	-63.2	-39.8	178.8	-71.5	169.5	0	0	0	112.3	L380 E381 K387 T419 I425 E428 F430	L380-L384 HydrophobicContact CD1-CD1 4.18Å; L380-L384 HydrophobicContact CD1-CG 4.12Å; L380-L384 HydrophobicContact CG-CD1 4.01Å; L380-L384 HydrophobicContact CG-CG 4.42Å; L380-L384 WeakPolarHBondContact O-CG 3.19Å; L380-L384 PolarHBondContact O-N 3.07Å; E381-L384 PolarHBondContact O-N 3.34Å; L384-K387 WeakPolarHBondContact O-CG 3.37Å; L384-T419 HydrophobicContact CD1-CG2 4.39Å; L384-I425 HydrophobicContact CD1-CG2 3.87Å; L384-I425 HydrophobicContact CD2-CG2 4.31Å; L384-E428 HydrophobicContact CD2-CB 4.14Å; L384-E428 HydrophobicContact CD2-CG 3.87Å; L384-F430 HydrophobicContact CD2-CE1 3.75Å; L384-F430 HydrophobicContact CD2-CZ 3.77Å; L384-F430 HydrophobicContact CG-CE1 4.47Å
385	L	96.9	Very high	94.9	Very high	54 Å²	54	18.1 Å²	18.1	28%	0.283	9%	0.088	S	C	.	.	H	α-helix	trans	-70.2	-51.8	177.5	179.2	68.6	0	0	0	111.8	L346 Y350 E381 Q382 I383	L346-L385 HydrophobicContact CD2-CD2 3.85Å; L346-L385 HydrophobicContact CG-CD2 3.65Å; Y350-L385 HydrophobicContact CD1-CD1 4.05Å; Y350-L385 HydrophobicContact CD1-CD2 4.23Å; Y350-L385 HydrophobicContact CD1-CG 3.81Å; Y350-L385 HydrophobicContact CE1-CG 4.33Å; Y350-L385 WeakPolarHBondContact CE1-O 3.25Å; Y350-L385 HydrophobicContact CG-CD2 4.36Å; Y350-L385 HydrophobicContact CG-CG 4.38Å; E381-L385 WeakPolarHBondContact O-CB 3.44Å; E381-L385 PolarHBondContact O-N 2.85Å; Q382-L385 PolarHBondContact O-N 2.72Å; I383-L385 VanDerWaalsContact C-N 3.35Å; I383-L385 PolarHBondContact O-N 3.34Å
386	V	97.4	Very high	94.7	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-76.5	-33.6	-172.7	172.7	0	0	0	0	112	K247 L285 Y350 L363 V365 Q382	K247-V386 HydrophobicContact CD-CG1 4.37Å; K247-V386 WeakPolarHBondContact CD-O 3.44Å; K247-V386 WeakPolarHBondContact CE-O 3.4Å; K247-V386 PolarHBondContact NZ-O 2.89Å; L285-V386 HydrophobicContact CD2-CG2 4.12Å; Y350-V386 HydrophobicContact CD2-CG2 4.25Å; Y350-V386 HydrophobicContact CE2-CB 4.47Å; Y350-V386 HydrophobicContact CE2-CG1 4.37Å; Y350-V386 HydrophobicContact CE2-CG2 4.11Å; Y350-V386 PolarHBondContact OH-O 3.45Å; L363-V386 HydrophobicContact CD2-CG1 4.35Å; V365-V386 HydrophobicContact CG2-CG1 3.93Å; V365-V386 HydrophobicContact CG2-CG2 4.41Å; Q382-V386 WeakPolarHBondContact O-CB 3.47Å; Q382-V386 WeakPolarHBondContact O-CG2 3.49Å; Q382-V386 PolarHBondContact O-N 2.88Å
387	K	96.3	Very high	94	Very high	111 Å²	111	21.7 Å²	21.7	48%	0.483	11%	0.109	S	C	.	.			trans	49.1	63.2	-170.8	-58.7	-171.3	173.8	-168.6	0	111.7	K247 I383 L384 E428	K247-K387 WeakPolarHBondContact CE-O 3.36Å; K247-K387 PolarHBondContact NZ-O 2.85Å; I383-K387 WeakPolarHBondContact O-CA 3.49Å; I383-K387 PolarHBondContact O-N 2.98Å; L384-K387 WeakPolarHBondContact O-CG 3.37Å; K387-E428 IonicContact NZ-OE2 3.83Å
388	P	96.2	Very high	92.7	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.039	14%	0.142	C	C	.	.			trans	-59.8	159.3	-176.7	28	-35.1	0	0	0	111.6	L249 I383 I391 H432	L249-P388 HydrophobicContact CB-CB 3.93Å; L249-P388 HydrophobicContact CB-CG 4.14Å; I383-P388 HydrophobicContact CG2-CG 4.37Å; I383-P388 WeakPolarHBondContact O-CD 3.49Å; P388-I391 HydrophobicContact CB-CG1 4.39Å; P388-I391 HydrophobicContact CG-CD1 4.06Å; P388-I391 HydrophobicContact CG-CG1 3.76Å; P388-H432 VanDerWaalsContact O-CB 3.31Å; P388-H432 WeakPolarHBondContact O-CB 3.36Å
389	D	94.4	Very high	90.8	Very high	50 Å²	50	26.1 Å²	26.1	27%	0.267	15%	0.154	S	C	.	.	S	Bend	trans	-91.9	-28.1	171.2	-45.6	-51.3	0	0	0	110.3	V245 R246 K247 H432 D433	V245-D389 HydrophobicContact CG1-CB 4.48Å; R246-D389 WeakPolarHBondContact CA-OD2 3.37Å; R246-D389 WeakPolarHBondContact CB-OD2 3.39Å; R246-D389 PolarHBondContact N-OD2 2.79Å; K247-D389 PolarHBondContact N-OD2 2.84Å; K247-D389 PolarHBondContact O-N 3.44Å; D389-H432 VanDerWaalsContact O-CA 3.29Å; D389-H432 WeakPolarHBondContact O-CA 3.07Å; D389-D433 PolarHBondContact O-N 3.28Å
390	L	95.2	Very high	88.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.8	177.5	177.4	62.4	0	0	0	110.8	I228 V245 K247 L248 L249 V392 D433 I435	I228-L390 HydrophobicContact CG1-CD2 4.47Å; I228-L390 HydrophobicContact CG2-CD2 4.25Å; V245-L390 HydrophobicContact CG1-CB 3.86Å; V245-L390 HydrophobicContact CG1-CD2 4.42Å; V245-L390 HydrophobicContact CG2-CB 4.1Å; V245-L390 HydrophobicContact CG2-CD2 4.38Å; K247-L390 PolarHBondContact O-N 3.4Å; L248-L390 WeakPolarHBondContact CA-O 3.33Å; L248-L390 HydrophobicContact CD1-CD2 3.84Å; L248-L390 HydrophobicContact CD1-CG 4.49Å; L248-L390 HydrophobicContact CG-CB 4.4Å; L248-L390 HydrophobicContact CG-CD2 4.24Å; L248-L390 HydrophobicContact CG-CG 4.36Å; L249-L390 PolarHBondContact N-O 2.85Å; L390-V392 HydrophobicContact CD2-CG2 4.29Å; L390-V392 HydrophobicContact CG-CG2 4.26Å; L390-D433 HydrophobicContact CD1-CB 3.78Å; L390-I435 HydrophobicContact CD1-CB 4.46Å; L390-I435 HydrophobicContact CD1-CD1 3.9Å; L390-I435 HydrophobicContact CD1-CG1 3.93Å; L390-I435 HydrophobicContact CD2-CD1 4.25Å
391	I	96.2	Very high	86.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.2	168.5	-60	-173.6	0	0	0	109	L249 I383 P388 L409 H432 D433 V434 I435	L249-I391 HydrophobicContact CD2-CG2 4.13Å; L249-I391 WeakPolarHBondContact O-CA 3.31Å; I383-I391 HydrophobicContact CD1-CD1 3.78Å; I383-I391 HydrophobicContact CG1-CD1 4.01Å; I383-I391 HydrophobicContact CG2-CD1 4.31Å; P388-I391 HydrophobicContact CB-CG1 4.39Å; P388-I391 HydrophobicContact CG-CD1 4.06Å; P388-I391 HydrophobicContact CG-CG1 3.76Å; I391-L409 HydrophobicContact CD1-CB 4.49Å; I391-L409 HydrophobicContact CG2-CD1 4.29Å; I391-H432 WeakPolarHBondContact CD1-CD2 3.44Å; I391-H432 WeakPolarHBondContact CD1-NE2 3.27Å; I391-H432 HydrophobicContact CG1-CB 4.35Å; I391-D433 PolarHBondContact N-O 2.76Å; I391-V434 HydrophobicContact CB-CG2 4.45Å; I391-V434 WeakPolarHBondContact O-CA 3.45Å; I391-I435 PolarHBondContact O-N 2.98Å
392	V	96.2	Very high	84	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.6	169.9	-173.5	0	0	0	0	108.4	I228 L248 L249 C251 L261 L390 L394 I435 I437	I228-V392 HydrophobicContact CD1-CB 4.43Å; I228-V392 HydrophobicContact CD1-CG1 3.88Å; I228-V392 HydrophobicContact CD1-CG2 3.62Å; I228-V392 HydrophobicContact CG1-CG2 4.31Å; L248-V392 HydrophobicContact CD1-CG2 4.24Å; L248-V392 HydrophobicContact CD2-CG2 3.83Å; L248-V392 HydrophobicContact CG-CG2 4.13Å; L249-V392 PolarHBondContact O-N 2.76Å; C251-V392 PolarHBondContact N-O 3.1Å; L261-V392 HydrophobicContact CD2-CB 4.35Å; L261-V392 HydrophobicContact CD2-CG1 3.64Å; L390-V392 HydrophobicContact CD2-CG2 4.29Å; L390-V392 HydrophobicContact CG-CG2 4.26Å; V392-L394 HydrophobicContact CG1-CD2 4.37Å; V392-I435 WeakPolarHBondContact CA-O 3.4Å; V392-I437 HydrophobicContact CG1-CD1 3.55Å; V392-I437 HydrophobicContact CG1-CG1 4.06Å
393	Q	95	Very high	81.8	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	109	-175.4	178	176.4	1.8	0	0	110.2	V406 P407 I435 L436 I437	Q393-V406 PolarHBondContact NE2-O 3.43Å; Q393-P407 PolarHBondContact NE2-O 2.78Å; Q393-I435 PolarHBondContact N-O 3.41Å; Q393-L436 HydrophobicContact CB-CD2 3.98Å; Q393-L436 HydrophobicContact CG-CD2 4.05Å; Q393-L436 WeakPolarHBondContact O-CA 3.46Å; Q393-I437 PolarHBondContact O-N 3.11Å
394	L	93.1	Very high	79.9	Confident	10 Å²	10	55 Å²	55	5%	0.052	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.4	177.7	-54.8	179	0	0	0	110.3	I250 C251 G252 P253 A256 K258 L261 V392 I437	I250-L394 HydrophobicContact CG2-CD1 4.35Å; C251-L394 PolarHBondContact O-N 3.32Å; G252-L394 WeakPolarHBondContact CA-O 3.34Å; P253-L394 WeakPolarHBondContact CD-O 3.36Å; A256-L394 HydrophobicContact CB-CB 3.78Å; A256-L394 HydrophobicContact CB-CD1 4.44Å; A256-L394 WeakPolarHBondContact O-CD1 3.46Å; K258-L394 HydrophobicContact CB-CD1 4.33Å; K258-L394 HydrophobicContact CG-CD1 3.85Å; L261-L394 HydrophobicContact CD2-CD1 4.48Å; L261-L394 HydrophobicContact CD2-CD2 4.01Å; V392-L394 HydrophobicContact CG1-CD2 4.37Å; L394-I437 WeakPolarHBondContact CA-O 3.34Å; L394-I437 HydrophobicContact CD2-CB 3.72Å; L394-I437 HydrophobicContact CD2-CD1 4.14Å; L394-I437 HydrophobicContact CD2-CG1 4.34Å; L394-I437 HydrophobicContact CD2-CG2 4.12Å
395	R	89.3	Confident	78.1	Confident	48 Å²	48	57 Å²	57	18%	0.181	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.1	177.7	-68.6	-175.4	160.4	159.3	1.1	110.8	V406 D408 L436 I437 S439	R395-V406 PolarHBondContact NH2-O 3.48Å; R395-D408 IonicContact CZ-OD1 3.06Å; R395-D408 IonicContact NH1-OD1 3.74Å; R395-D408 PolarHBondContact NH1-OD1 2.99Å; R395-D408 IonicContact NH2-OD1 2.62Å; R395-D408 PolarHBondContact NH2-OD1 3.39Å; R395-L436 VanDerWaalsContact NH1-CD1 3.29Å; R395-I437 PolarHBondContact N-O 3.44Å; R395-S439 WeakPolarHBondContact O-CA 3.22Å; R395-S439 WeakPolarHBondContact O-CB 3.21Å; R395-S439 PolarHBondContact O-N 3.04Å
396	L	85.4	Confident	76.8	Confident	49 Å²	49	54.9 Å²	54.9	26%	0.257	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	125.8	176.7	-67.7	171.4	0	0	0	110.1	P253 A256	P253-L396 HydrophobicContact CB-CD1 4.39Å; P253-L396 HydrophobicContact CG-CD1 3.88Å; P253-L396 HydrophobicContact CG-CG 3.86Å; A256-L396 HydrophobicContact CB-CD2 4.07Å; A256-L396 HydrophobicContact CB-CG 4.44Å
397	T	77.2	Confident	75.8	Confident	57 Å²	57	58.2 Å²	58.2	35%	0.35	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	137.6	176.2	50.4	0	0	0	0	111.4	S399 E438 N440	T397-S399 VanDerWaalsContact C-N 3.3Å; T397-S399 PolarHBondContact O-N 3.22Å; T397-E438 HydrophobicContact CG2-CB 3.77Å; T397-E438 HydrophobicContact CG2-CG 4.48Å; T397-N440 HydrophobicContact CG2-CB 4.42Å
398	G	65.9	Low	75.4	Confident	82 Å²	82	55.9 Å²	55.9	85%	0.845	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	5.8	171.6	0	0	0	0	0	115.8	S400	G398-S400 VanDerWaalsContact C-N 3.33Å; G398-S400 PolarHBondContact O-N 3.41Å
399	S	55.4	Low	75.1	Confident	35 Å²	35	55.6 Å²	55.6	25%	0.245	32%	0.317	C	S	.	.			trans	-78	86.2	168.4	-172.2	0	0	0	0	109.7	T397 N401 T404	T397-S399 VanDerWaalsContact C-N 3.3Å; T397-S399 PolarHBondContact O-N 3.22Å; S399-N401 PolarHBondContact O-N 3.06Å; S399-N401 VanDerWaalsContact O-N 3.08Å; S399-N401 PolarHBondContact OG-O 2.94Å; S399-T404 WeakPolarHBondContact CB-OG1 3.29Å; S399-T404 PolarHBondContact OG-OG1 3.12Å
400	S	46.2	Very low	75	Confident	115 Å²	115	55.7 Å²	55.7	80%	0.804	32%	0.317	S	S	*	.			trans	-61.8	-6.7	168	60.2	0	0	0	0	113.3	G398 N402	G398-S400 VanDerWaalsContact C-N 3.33Å; G398-S400 PolarHBondContact O-N 3.41Å; S400-N402 PolarHBondContact O-N 3.28Å
401	N	47.6	Very low	74.6	Confident	109 Å²	109	57.9 Å²	57.9	58%	0.583	33%	0.333	S	S	*	.			trans	-81.9	107.9	171.2	-78.2	-29.8	0	0	0	110.5	S399 R403 T404	S399-N401 PolarHBondContact O-N 3.06Å; S399-N401 VanDerWaalsContact O-N 3.08Å; S399-N401 PolarHBondContact OG-O 2.94Å; N401-R403 PolarHBondContact O-N 2.89Å; N401-T404 PolarHBondContact O-N 3.41Å; N401-T404 PolarHBondContact O-OG1 3.05Å
402	N	50.8	Low	74.2	Confident	155 Å²	155	61.7 Å²	61.7	83%	0.829	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-8	167.6	-80.7	-5.4	0	0	0	115	S400	S400-N402 PolarHBondContact O-N 3.28Å
403	R	50.8	Low	73.9	Confident	209 Å²	209	62.9 Å²	62.9	79%	0.789	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-18.6	-178.3	-72.1	-176.4	173.8	164.4	-1.4	114.5	Q372 N401	Q372-R403 PolarHBondContact OE1-O 3.33Å; Q372-R403 VanDerWaalsContact OE1-O 3.11Å; N401-R403 PolarHBondContact O-N 2.89Å
404	T	55.4	Low	73.7	Confident	50 Å²	50	62.8 Å²	62.8	31%	0.307	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-20.4	-176.4	53.8	0	0	0	0	113.8	S399 N401	S399-T404 WeakPolarHBondContact CB-OG1 3.29Å; S399-T404 PolarHBondContact OG-OG1 3.12Å; N401-T404 PolarHBondContact O-N 3.41Å; N401-T404 PolarHBondContact O-OG1 3.05Å
405	N	59	Low	73.6	Confident	54 Å²	54	67.2 Å²	67.2	29%	0.289	39%	0.386	S	S	.	.			trans	-102.2	108.7	-177.7	-72.6	-27.4	0	0	0	109.7
406	V	68.8	Low	73.5	Confident	9 Å²	9	70.6 Å²	70.6	6%	0.055	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-65.2	150.5	174.4	-170.1	0	0	0	0	109.7	M371 L376 Q393 R395 L409 M417	M371-V406 HydrophobicContact CB-CG2 3.45Å; M371-V406 VanDerWaalsContact CB-CG2 3.45Å; M371-V406 HydrophobicContact CE-CB 4.13Å; M371-V406 HydrophobicContact CE-CG2 3.42Å; M371-V406 VanDerWaalsContact CE-CG2 3.42Å; M371-V406 HydrophobicContact CG-CG2 4.16Å; M371-V406 WeakPolarHBondContact O-CG2 3.47Å; M371-V406 HydrophobicContact SD-CG2 4.47Å; L376-V406 HydrophobicContact CD1-CG1 3.57Å; L376-V406 HydrophobicContact CD1-CG2 4.43Å; L376-V406 HydrophobicContact CD2-CG1 4Å; L376-V406 HydrophobicContact CG-CG1 4.44Å; Q393-V406 PolarHBondContact NE2-O 3.43Å; R395-V406 PolarHBondContact NH2-O 3.48Å; V406-L409 HydrophobicContact CG1-CD2 3.82Å; V406-M417 HydrophobicContact CG1-CE 4.03Å
407	P	77.7	Confident	73.7	Confident	72 Å²	72	69.6 Å²	69.6	47%	0.468	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-46.5	153	161.6	19.7	-32.9	0	0	0	111.4	Q393 L409 M417	Q393-P407 PolarHBondContact NE2-O 2.78Å; P407-L409 PolarHBondContact O-N 3.02Å; P407-M417 HydrophobicContact CG-CE 3.88Å
408	D	86.9	Confident	74.2	Confident	61 Å²	61	73.1 Å²	73.1	33%	0.326	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-54.2	125.3	171.6	-65	-2.5	0	0	0	107.7	R395 N410 S413	R395-D408 IonicContact CZ-OD1 3.06Å; R395-D408 IonicContact NH1-OD1 3.74Å; R395-D408 PolarHBondContact NH1-OD1 2.99Å; R395-D408 IonicContact NH2-OD1 2.62Å; R395-D408 PolarHBondContact NH2-OD1 3.39Å; D408-N410 PolarHBondContact O-N 2.85Å; D408-S413 WeakPolarHBondContact O-CB 3.49Å; D408-S413 PolarHBondContact O-OG 3.12Å; D408-S413 VanDerWaalsContact O-OG 3.05Å
409	L	91.5	Very high	75.4	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	39%	0.387	C	S	.	.			trans	-75.4	42.8	-177.6	-63.2	176.6	0	0	0	112.3	C251 L376 L379 I383 I391 V406 P407 L414 M417 H432 V434	C251-L409 WeakPolarHBondContact SG-CD1 3.49Å; L376-L409 HydrophobicContact CD1-CD2 4.37Å; L379-L409 HydrophobicContact CD2-CD1 3.8Å; I383-L409 HydrophobicContact CD1-CD1 4.4Å; I391-L409 HydrophobicContact CD1-CB 4.49Å; I391-L409 HydrophobicContact CG2-CD1 4.29Å; V406-L409 HydrophobicContact CG1-CD2 3.82Å; P407-L409 PolarHBondContact O-N 3.02Å; L409-L414 HydrophobicContact CB-CD2 4.26Å; L409-L414 HydrophobicContact CD2-CD2 3.85Å; L409-M417 HydrophobicContact CD2-CE 3.86Å; L409-M417 HydrophobicContact CD2-SD 4.38Å; L409-H432 PolarHBondContact O-NE2 3.07Å; L409-V434 WeakPolarHBondContact O-CG2 3.33Å
410	N	90.6	Very high	77.1	Confident	51 Å²	51	71 Å²	71	27%	0.273	39%	0.386	S	S	.	.			trans	-77.4	167	175.4	61.4	33.5	0	0	0	111.2	D408 S412 S413 L414 V434	D408-N410 PolarHBondContact O-N 2.85Å; N410-S412 VanDerWaalsContact C-N 3.31Å; N410-S412 PolarHBondContact O-N 2.87Å; N410-S412 PolarHBondContact OD1-OG 3.47Å; N410-S413 PolarHBondContact O-N 2.96Å; N410-S413 VanDerWaalsContact OD1-CB 3.28Å; N410-S413 WeakPolarHBondContact OD1-CB 3.39Å; N410-S413 PolarHBondContact OD1-N 3.16Å; N410-S413 PolarHBondContact OD1-OG 3.35Å; N410-L414 WeakPolarHBondContact O-CG 3.28Å; N410-L414 PolarHBondContact O-N 3.38Å; N410-V434 HydrophobicContact CB-CG2 4.4Å
411	S	88.1	Confident	79.1	Confident	46 Å²	46	71.6 Å²	71.6	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-53.3	-44.3	-176.5	-177.1	0	0	0	0	113.2	K415	S411-K415 WeakPolarHBondContact O-CG 3.44Å; S411-K415 PolarHBondContact O-N 2.86Å
412	S	87.7	Confident	81	Confident	81 Å²	81	71.6 Å²	71.6	57%	0.566	39%	0.389	S	S	*	.	H	α-helix	trans	-65.6	-42.8	179.7	50.1	0	0	0	0	112.5	N410	N410-S412 VanDerWaalsContact C-N 3.31Å; N410-S412 PolarHBondContact O-N 2.87Å; N410-S412 PolarHBondContact OD1-OG 3.47Å
413	S	89.7	Confident	82.7	Confident	24 Å²	24	70.2 Å²	70.2	17%	0.168	37%	0.372	C	S	.	.	H	α-helix	trans	-67.5	-43.3	179.3	-55.8	0	0	0	0	111.9	D408 N410 K415 T416	D408-S413 WeakPolarHBondContact O-CB 3.49Å; D408-S413 PolarHBondContact O-OG 3.12Å; D408-S413 VanDerWaalsContact O-OG 3.05Å; N410-S413 PolarHBondContact O-N 2.96Å; N410-S413 VanDerWaalsContact OD1-CB 3.28Å; N410-S413 WeakPolarHBondContact OD1-CB 3.39Å; N410-S413 PolarHBondContact OD1-N 3.16Å; N410-S413 PolarHBondContact OD1-OG 3.35Å; S413-K415 VanDerWaalsContact C-N 3.31Å; S413-K415 PolarHBondContact O-N 2.9Å; S413-T416 PolarHBondContact O-N 3.32Å; S413-T416 PolarHBondContact O-OG1 3.11Å
414	L	91.8	Very high	84.6	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-36.3	-178.6	-67.5	173.2	0	0	0	112.7	L380 I383 L409 N410 T416 M417 F430 H432	L380-L414 HydrophobicContact CD1-CB 4.29Å; L380-L414 HydrophobicContact CD1-CD2 4.04Å; I383-L414 HydrophobicContact CD1-CD1 4.43Å; I383-L414 HydrophobicContact CD1-CD2 3.98Å; I383-L414 HydrophobicContact CG2-CD1 4.19Å; L409-L414 HydrophobicContact CB-CD2 4.26Å; L409-L414 HydrophobicContact CD2-CD2 3.85Å; N410-L414 WeakPolarHBondContact O-CG 3.28Å; N410-L414 PolarHBondContact O-N 3.38Å; L414-T416 PolarHBondContact O-N 3.35Å; L414-M417 HydrophobicContact CD2-SD 3.76Å; L414-M417 WeakPolarHBondContact O-CB 3.16Å; L414-M417 PolarHBondContact O-N 3.45Å; L414-M417 VanDerWaalsContact O-N 3.16Å; L414-F430 HydrophobicContact CB-CD1 4.39Å; L414-F430 HydrophobicContact CB-CD2 4.22Å; L414-F430 HydrophobicContact CB-CE1 4.08Å; L414-F430 HydrophobicContact CB-CE2 3.92Å; L414-F430 HydrophobicContact CB-CG 4.45Å; L414-F430 HydrophobicContact CB-CZ 3.84Å; L414-F430 HydrophobicContact CD1-CD1 3.57Å; L414-F430 HydrophobicContact CD1-CE1 3.78Å; L414-F430 HydrophobicContact CD1-CG 4Å; L414-F430 HydrophobicContact CD1-CZ 4.38Å; L414-H432 WeakPolarHBondContact CD1-CE1 3.39Å
415	K	89.8	Confident	86.3	Confident	102 Å²	102	64 Å²	64	44%	0.443	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19	175.9	-73.6	-176.5	-179.4	-160	0	113.9	S411 S413 E428 F430	S411-K415 WeakPolarHBondContact O-CG 3.44Å; S411-K415 PolarHBondContact O-N 2.86Å; S413-K415 VanDerWaalsContact C-N 3.31Å; S413-K415 PolarHBondContact O-N 2.9Å; K415-E428 WeakPolarHBondContact CE-O 3.42Å; K415-F430 HydrophobicContact CG-CD2 4Å; K415-F430 HydrophobicContact CG-CE2 3.72Å
416	T	87.9	Confident	87.5	Confident	119 Å²	119	64.7 Å²	64.7	73%	0.73	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-2.6	178.6	66.1	0	0	0	0	113.4	S413 L414	S413-T416 PolarHBondContact O-N 3.32Å; S413-T416 PolarHBondContact O-OG1 3.11Å; L414-T416 PolarHBondContact O-N 3.35Å
417	M	88.5	Confident	88.4	Confident	28 Å²	28	71.4 Å²	71.4	14%	0.138	40%	0.397	C	S	.	.	S	Bend	trans	-86.9	147.1	-176.5	-72.9	-178	156.5	0	0	112.7	L376 L380 V406 P407 L409 L414 T419	L376-M417 HydrophobicContact CD1-CE 3.73Å; L376-M417 HydrophobicContact CD1-SD 4.34Å; L376-M417 HydrophobicContact CD2-CE 3.64Å; L376-M417 HydrophobicContact CG-CE 3.76Å; L376-M417 HydrophobicContact CG-SD 4.25Å; L380-M417 HydrophobicContact CD2-CB 3.75Å; V406-M417 HydrophobicContact CG1-CE 4.03Å; P407-M417 HydrophobicContact CG-CE 3.88Å; L409-M417 HydrophobicContact CD2-CE 3.86Å; L409-M417 HydrophobicContact CD2-SD 4.38Å; L414-M417 HydrophobicContact CD2-SD 3.76Å; L414-M417 WeakPolarHBondContact O-CB 3.16Å; L414-M417 PolarHBondContact O-N 3.45Å; L414-M417 VanDerWaalsContact O-N 3.16Å; M417-T419 PolarHBondContact O-N 2.96Å
418	D	88.2	Confident	89.1	Confident	132 Å²	132	69.7 Å²	69.7	71%	0.706	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-72	122.3	172.4	-65.1	-45	0	0	0	111.5	T377	T377-D418 WeakPolarHBondContact CG2-O 3.31Å; T377-D418 PolarHBondContact OG1-O 3.26Å; T377-D418 VanDerWaalsContact OG1-O 3.1Å
419	T	91.5	Very high	89.2	Confident	12 Å²	12	71.3 Å²	71.3	7%	0.074	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-83	164.8	174.9	53.6	0	0	0	0	112	T377 L380 L384 M417 N421 S422 R423 I425	T377-T419 VanDerWaalsContact CG2-C 3.4Å; L380-T419 HydrophobicContact CD2-CG2 3.58Å; L380-T419 HydrophobicContact CG-CG2 4.38Å; L384-T419 HydrophobicContact CD1-CG2 4.39Å; M417-T419 PolarHBondContact O-N 2.96Å; T419-N421 PolarHBondContact O-N 2.74Å; T419-S422 PolarHBondContact O-N 2.95Å; T419-R423 PolarHBondContact OG1-N 2.9Å; T419-R423 PolarHBondContact OG1-O 2.95Å; T419-I425 HydrophobicContact CG2-CB 4.39Å; T419-I425 HydrophobicContact CG2-CD1 3.67Å; T419-I425 HydrophobicContact CG2-CG1 3.86Å; T419-I425 HydrophobicContact CG2-CG2 3.67Å
420	W	90.2	Very high	89.2	Confident	60 Å²	60	72.1 Å²	72.1	23%	0.227	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-67.8	130.3	175.3	-175	-116.1	0	0	0	109.5	P339 S340 L343 L374 T377 E381 S422	P339-W420 HydrophobicContact CB-CH2 3.62Å; P339-W420 HydrophobicContact CB-CZ2 3.76Å; P339-W420 HydrophobicContact CB-CZ3 4.09Å; P339-W420 HydrophobicContact CG-CH2 3.87Å; P339-W420 HydrophobicContact CG-CZ2 4.36Å; P339-W420 HydrophobicContact CG-CZ3 4.45Å; S340-W420 WeakPolarHBondContact OG-CZ2 3.37Å; S340-W420 PolarHBondContact OG-NE1 3.3Å; L343-W420 HydrophobicContact CD1-CB 4.04Å; L343-W420 VanDerWaalsContact CD1-CD1 3.44Å; L343-W420 HydrophobicContact CD1-CD2 4.39Å; L343-W420 HydrophobicContact CD1-CG 3.7Å; L374-W420 HydrophobicContact CD1-CE3 3.88Å; L374-W420 HydrophobicContact CD1-CH2 4.24Å; L374-W420 HydrophobicContact CD1-CZ3 3.37Å; T377-W420 HydrophobicContact CG2-CB 3.94Å; T377-W420 HydrophobicContact CG2-CE3 4.22Å; E381-W420 HydrophobicContact CG-CB 3.62Å; E381-W420 WeakPolarHBondContact OE1-CB 3.33Å; E381-W420 PolarHBondContact OE1-N 2.96Å; W420-S422 PolarHBondContact O-N 2.86Å
421	N	88.5	Confident	89.2	Confident	127 Å²	127	76.6 Å²	76.6	68%	0.679	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	55.9	26.4	-173.9	-58.7	-36.6	0	0	0	114.8	T419 R423	T419-N421 PolarHBondContact O-N 2.74Å; N421-R423 VanDerWaalsContact C-N 3.26Å; N421-R423 PolarHBondContact O-N 3.03Å
422	S	87.5	Confident	89.4	Confident	109 Å²	109	75.3 Å²	75.3	76%	0.762	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	56.5	37.2	176	-53.3	0	0	0	0	113.9	T419 W420 D424	T419-S422 PolarHBondContact O-N 2.95Å; W420-S422 PolarHBondContact O-N 2.86Å; S422-D424 PolarHBondContact O-N 2.78Å
423	R	87.8	Confident	89.6	Confident	126 Å²	126	74.9 Å²	74.9	48%	0.475	40%	0.403	S	S	.	.			trans	-57.1	130.8	170.2	174.8	-179.4	172.4	176.9	-3.5	110.6	T419 N421 I425 E428	T419-R423 PolarHBondContact OG1-N 2.9Å; T419-R423 PolarHBondContact OG1-O 2.95Å; N421-R423 VanDerWaalsContact C-N 3.26Å; N421-R423 PolarHBondContact O-N 3.03Å; R423-I425 HydrophobicContact CG-CG2 4.31Å; R423-I425 PolarHBondContact O-N 2.82Å; R423-E428 IonicContact CZ-OE1 3.63Å; R423-E428 IonicContact NH2-OE1 2.58Å; R423-E428 PolarHBondContact NH2-OE1 3.36Å
424	D	88.9	Confident	89.8	Confident	118 Å²	118	75.8 Å²	75.8	63%	0.631	41%	0.407	S	S	*	.			trans	-69.1	124.5	171.1	-176.8	11.2	0	0	0	110.8	S422 S426	S422-D424 PolarHBondContact O-N 2.78Å; D424-S426 VanDerWaalsContact CG-OG 3.31Å; D424-S426 WeakPolarHBondContact OD1-CB 3.44Å; D424-S426 PolarHBondContact OD1-N 2.93Å; D424-S426 PolarHBondContact OD1-OG 2.87Å; D424-S426 PolarHBondContact OD2-OG 3.38Å
425	I	91.7	Very high	89.9	Confident	12 Å²	12	76.9 Å²	76.9	6%	0.062	41%	0.412	C	S	.	.			trans	-122.7	16.4	178.5	58.2	161.7	0	0	0	112.2	L380 L384 T419 R423 N427 E428 F430	L380-I425 HydrophobicContact CD2-CD1 4.15Å; L384-I425 HydrophobicContact CD1-CG2 3.87Å; L384-I425 HydrophobicContact CD2-CG2 4.31Å; T419-I425 HydrophobicContact CG2-CB 4.39Å; T419-I425 HydrophobicContact CG2-CD1 3.67Å; T419-I425 HydrophobicContact CG2-CG1 3.86Å; T419-I425 HydrophobicContact CG2-CG2 3.67Å; R423-I425 HydrophobicContact CG-CG2 4.31Å; R423-I425 PolarHBondContact O-N 2.82Å; I425-N427 PolarHBondContact O-N 2.91Å; I425-E428 HydrophobicContact CB-CB 4.17Å; I425-E428 HydrophobicContact CB-CG 3.78Å; I425-E428 HydrophobicContact CG2-CG 3.91Å; I425-E428 WeakPolarHBondContact O-CB 3.22Å; I425-E428 PolarHBondContact O-N 2.82Å; I425-F430 HydrophobicContact CD1-CZ 4.33Å
426	S	85.3	Confident	90	Very high	68 Å²	68	74.8 Å²	74.8	48%	0.476	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-35.9	178.6	55.7	0	0	0	0	113	D424	D424-S426 VanDerWaalsContact CG-OG 3.31Å; D424-S426 WeakPolarHBondContact OD1-CB 3.44Å; D424-S426 PolarHBondContact OD1-N 2.93Å; D424-S426 PolarHBondContact OD1-OG 2.87Å; D424-S426 PolarHBondContact OD2-OG 3.38Å
427	N	87.8	Confident	90.2	Very high	149 Å²	149	69.6 Å²	69.6	80%	0.797	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.5	178.6	-65.4	-35.7	0	0	0	114.3	I425	I425-N427 PolarHBondContact O-N 2.91Å
428	E	90.6	Very high	90.3	Very high	37 Å²	37	75 Å²	75	17%	0.173	40%	0.398	C	S	.	.			trans	-74.3	137.1	179.6	-66.3	-73.1	177.4	0	0	111.1	L384 K387 K415 R423 I425 F430	L384-E428 HydrophobicContact CD2-CB 4.14Å; L384-E428 HydrophobicContact CD2-CG 3.87Å; K387-E428 IonicContact NZ-OE2 3.83Å; K415-E428 WeakPolarHBondContact CE-O 3.42Å; R423-E428 IonicContact CZ-OE1 3.63Å; R423-E428 IonicContact NH2-OE1 2.58Å; R423-E428 PolarHBondContact NH2-OE1 3.36Å; I425-E428 HydrophobicContact CB-CB 4.17Å; I425-E428 HydrophobicContact CB-CG 3.78Å; I425-E428 HydrophobicContact CG2-CG 3.91Å; I425-E428 WeakPolarHBondContact O-CB 3.22Å; I425-E428 PolarHBondContact O-N 2.82Å; E428-F430 HydrophobicContact CB-CE2 4.4Å; E428-F430 HydrophobicContact CB-CZ 4.42Å
429	T	89.7	Confident	90.3	Very high	94 Å²	94	69.5 Å²	69.5	58%	0.577	37%	0.37	S	S	*	.			trans	-103.8	122	177	56.6	0	0	0	0	110.3
430	F	92.3	Very high	89.9	Confident	19 Å²	19	74 Å²	74	8%	0.083	39%	0.394	C	S	.	.			trans	-103.3	102.5	174.7	-61.2	-77.5	0	0	0	109.2	L380 I383 L384 L414 K415 I425 E428 H432	L380-F430 HydrophobicContact CD1-CE1 4.26Å; L380-F430 HydrophobicContact CD1-CZ 4.16Å; I383-F430 HydrophobicContact CG2-CD1 4.18Å; I383-F430 HydrophobicContact CG2-CE1 4.14Å; L384-F430 HydrophobicContact CD2-CE1 3.75Å; L384-F430 HydrophobicContact CD2-CZ 3.77Å; L384-F430 HydrophobicContact CG-CE1 4.47Å; L414-F430 HydrophobicContact CB-CD1 4.39Å; L414-F430 HydrophobicContact CB-CD2 4.22Å; L414-F430 HydrophobicContact CB-CE1 4.08Å; L414-F430 HydrophobicContact CB-CE2 3.92Å; L414-F430 HydrophobicContact CB-CG 4.45Å; L414-F430 HydrophobicContact CB-CZ 3.84Å; L414-F430 HydrophobicContact CD1-CD1 3.57Å; L414-F430 HydrophobicContact CD1-CE1 3.78Å; L414-F430 HydrophobicContact CD1-CG 4Å; L414-F430 HydrophobicContact CD1-CZ 4.38Å; K415-F430 HydrophobicContact CG-CD2 4Å; K415-F430 HydrophobicContact CG-CE2 3.72Å; I425-F430 HydrophobicContact CD1-CZ 4.33Å; E428-F430 HydrophobicContact CB-CE2 4.4Å; E428-F430 HydrophobicContact CB-CZ 4.42Å; F430-H432 AromaticContact CD1-CE1 3.86Å
431	N	89.5	Confident	89.1	Confident	144 Å²	144	75 Å²	75	77%	0.77	41%	0.406	S	S	*	.			trans	-103.6	18.3	-176.3	-62.5	-13.9	0	0	0	112.7
432	H	93.2	Very high	88.1	Confident	19 Å²	19	76.6 Å²	76.6	9%	0.088	41%	0.407	C	S	.	.			trans	-88.8	148.3	179.8	58.5	-88.1	0	0	0	112.4	P388 D389 I391 L409 L414 F430	P388-H432 VanDerWaalsContact O-CB 3.31Å; P388-H432 WeakPolarHBondContact O-CB 3.36Å; D389-H432 VanDerWaalsContact O-CA 3.29Å; D389-H432 WeakPolarHBondContact O-CA 3.07Å; I391-H432 WeakPolarHBondContact CD1-CD2 3.44Å; I391-H432 WeakPolarHBondContact CD1-NE2 3.27Å; I391-H432 HydrophobicContact CG1-CB 4.35Å; L409-H432 PolarHBondContact O-NE2 3.07Å; L414-H432 WeakPolarHBondContact CD1-CE1 3.39Å; F430-H432 AromaticContact CD1-CE1 3.86Å
433	D	92.3	Very high	86.6	Confident	73 Å²	73	76.9 Å²	76.9	39%	0.39	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	157.1	163.1	-73	-37.8	0	0	0	111.3	K231 D389 L390 I391	K231-D433 IonicContact NZ-OD2 3.82Å; K231-D433 PolarHBondContact NZ-OD2 2.89Å; D389-D433 PolarHBondContact O-N 3.28Å; L390-D433 HydrophobicContact CD1-CB 3.78Å; I391-D433 PolarHBondContact N-O 2.76Å
434	V	93.4	Very high	84.9	Confident	43 Å²	43	76.3 Å²	76.3	26%	0.261	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.5	173.1	-176	0	0	0	0	109.6	I391 L409 N410 L436	I391-V434 HydrophobicContact CB-CG2 4.45Å; I391-V434 WeakPolarHBondContact O-CA 3.45Å; L409-V434 WeakPolarHBondContact O-CG2 3.33Å; N410-V434 HydrophobicContact CB-CG2 4.4Å; V434-L436 HydrophobicContact CG1-CD2 4.27Å
435	I	93.6	Very high	82.8	Confident	23 Å²	23	75 Å²	75	12%	0.118	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.6	168.9	-67.4	173.1	0	0	0	108.4	E224 I228 L390 I391 V392 Q393 I437	E224-I435 HydrophobicContact CB-CG2 4.02Å; I228-I435 HydrophobicContact CD1-CG2 4.34Å; I228-I435 HydrophobicContact CG1-CD1 3.68Å; I228-I435 HydrophobicContact CG1-CG2 4.36Å; L390-I435 HydrophobicContact CD1-CB 4.46Å; L390-I435 HydrophobicContact CD1-CD1 3.9Å; L390-I435 HydrophobicContact CD1-CG1 3.93Å; L390-I435 HydrophobicContact CD2-CD1 4.25Å; I391-I435 PolarHBondContact O-N 2.98Å; V392-I435 WeakPolarHBondContact CA-O 3.4Å; Q393-I435 PolarHBondContact N-O 3.41Å; I435-I437 HydrophobicContact CG2-CG1 4.14Å
436	L	92.3	Very high	80.4	Confident	59 Å²	59	81.1 Å²	81.1	31%	0.309	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.9	175	-61.1	170.7	0	0	0	109.1	Q393 R395 V434	Q393-L436 HydrophobicContact CB-CD2 3.98Å; Q393-L436 HydrophobicContact CG-CD2 4.05Å; Q393-L436 WeakPolarHBondContact O-CA 3.46Å; R395-L436 VanDerWaalsContact NH1-CD1 3.29Å; V434-L436 HydrophobicContact CG1-CD2 4.27Å
437	I	92.2	Very high	78.3	Confident	10 Å²	10	84.8 Å²	84.8	5%	0.051	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126	174.3	-55.3	-177.4	0	0	0	109.2	A222 E224 V225 I228 L261 V392 Q393 L394 R395 I435 S439	A222-I437 HydrophobicContact CB-CG2 3.64Å; E224-I437 HydrophobicContact CB-CG1 4.12Å; V225-I437 HydrophobicContact CG2-CD1 3.84Å; I228-I437 HydrophobicContact CD1-CD1 3.86Å; L261-I437 HydrophobicContact CD2-CD1 4.42Å; V392-I437 HydrophobicContact CG1-CD1 3.55Å; V392-I437 HydrophobicContact CG1-CG1 4.06Å; Q393-I437 PolarHBondContact O-N 3.11Å; L394-I437 WeakPolarHBondContact CA-O 3.34Å; L394-I437 HydrophobicContact CD2-CB 3.72Å; L394-I437 HydrophobicContact CD2-CD1 4.14Å; L394-I437 HydrophobicContact CD2-CG1 4.34Å; L394-I437 HydrophobicContact CD2-CG2 4.12Å; R395-I437 PolarHBondContact N-O 3.44Å; I435-I437 HydrophobicContact CG2-CG1 4.14Å; I437-S439 PolarHBondContact O-N 2.99Å
438	E	89.4	Confident	76.3	Confident	141 Å²	141	80.9 Å²	80.9	66%	0.659	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	111.3	169.5	-68.5	-161.1	166.4	0	0	110.5	T397 N440	T397-E438 HydrophobicContact CG2-CB 3.77Å; T397-E438 HydrophobicContact CG2-CG 4.48Å; E438-N440 PolarHBondContact O-N 3.08Å
439	S	88.5	Confident	74.5	Confident	16 Å²	16	84.9 Å²	84.9	11%	0.112	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	105.8	177.8	169.8	0	0	0	0	110.5	A256 R395 I437 V441	A256-S439 VanDerWaalsContact O-CB 3.31Å; A256-S439 WeakPolarHBondContact O-CB 3.3Å; A256-S439 PolarHBondContact O-OG 3.11Å; R395-S439 WeakPolarHBondContact O-CA 3.22Å; R395-S439 WeakPolarHBondContact O-CB 3.21Å; R395-S439 PolarHBondContact O-N 3.04Å; I437-S439 PolarHBondContact O-N 2.99Å; S439-V441 PolarHBondContact O-N 2.95Å; S439-V441 WeakPolarHBondContact OG-CG2 3.45Å
440	N	82.5	Confident	73.1	Confident	107 Å²	107	86 Å²	86	57%	0.572	44%	0.44	S	S	*	.			trans	-91	91	168.9	-167.3	-13.3	0	0	0	110.5	T397 E438 K442	T397-N440 HydrophobicContact CG2-CB 4.42Å; E438-N440 PolarHBondContact O-N 3.08Å; N440-K442 PolarHBondContact O-N 3.27Å
441	V	74	Confident	72.1	Confident	80 Å²	80	86.1 Å²	86.1	49%	0.485	44%	0.441	S	S	.	.			trans	-88.2	99.5	177.5	-175.9	0	0	0	0	109.7	G255 S439	G255-V441 WeakPolarHBondContact O-CG2 3.48Å; S439-V441 PolarHBondContact O-N 2.95Å; S439-V441 WeakPolarHBondContact OG-CG2 3.45Å
442	K	67.6	Low	71.5	Confident	161 Å²	161	83.6 Å²	83.6	70%	0.7	43%	0.433	S	S	*	.			trans	-79.9	122.1	166.4	-63.3	-177.4	-176.9	177.8	0	108.5	N440 Y444	N440-K442 PolarHBondContact O-N 3.27Å; K442-Y444 PolarHBondContact O-N 3.09Å
443	L	56.9	Low	70.9	Confident	115 Å²	115	88.5 Å²	88.5	60%	0.602	45%	0.45	S	S	*	.			trans	-62.1	136.5	161.7	-92.1	110.4	0	0	0	107.3	K445	L443-K445 HydrophobicContact CB-CB 4.28Å; L443-K445 HydrophobicContact CB-CD 4.43Å; L443-K445 HydrophobicContact CB-CG 4.14Å; L443-K445 HydrophobicContact CD2-CD 3.93Å; L443-K445 HydrophobicContact CD2-CG 4.17Å; L443-K445 PolarHBondContact O-N 3.02Å
444	Y	50.8	Low	70.3	Confident	115 Å²	115	87.3 Å²	87.3	45%	0.451	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-58.3	6.3	174.3	-167.2	-98.8	0	0	0	114.2	Y67 L217 K442 D446 T448	Y67-Y444 PolarHBondContact OH-OH 2.93Å; L217-Y444 HydrophobicContact CD1-CD2 4.43Å; L217-Y444 HydrophobicContact CD1-CE2 3.62Å; K442-Y444 PolarHBondContact O-N 3.09Å; Y444-D446 VanDerWaalsContact C-N 3.32Å; Y444-D446 PolarHBondContact O-N 3.44Å; Y444-T448 VanDerWaalsContact CE1-OG1 3.25Å; Y444-T448 WeakPolarHBondContact CE1-OG1 3.48Å; Y444-T448 PolarHBondContact OH-OG1 3.5Å
445	K	46.2	Very low	69.8	Low	89 Å²	89	88.2 Å²	88.2	39%	0.387	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-70	-22.8	-177.8	-72.3	-172.7	176.4	-169.7	0	114.1	L443 N447 N455	L443-K445 HydrophobicContact CB-CB 4.28Å; L443-K445 HydrophobicContact CB-CD 4.43Å; L443-K445 HydrophobicContact CB-CG 4.14Å; L443-K445 HydrophobicContact CD2-CD 3.93Å; L443-K445 HydrophobicContact CD2-CG 4.17Å; L443-K445 PolarHBondContact O-N 3.02Å; K445-N447 VanDerWaalsContact C-N 3.32Å; K445-N447 PolarHBondContact O-N 3.07Å; K445-N455 WeakPolarHBondContact CE-OD1 3.32Å
446	D	41.1	Very low	69.6	Low	141 Å²	141	88.7 Å²	88.7	75%	0.754	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-74.2	-18.8	-169.8	-83.1	-15.3	0	0	0	114.4	Y444	Y444-D446 VanDerWaalsContact C-N 3.32Å; Y444-D446 PolarHBondContact O-N 3.44Å
447	N	39.7	Very low	69.5	Low	146 Å²	146	86.9 Å²	86.9	78%	0.781	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.4	-19.5	-175.5	-81.7	-18.7	0	0	0	117.6	K445	K445-N447 VanDerWaalsContact C-N 3.32Å; K445-N447 PolarHBondContact O-N 3.07Å
448	T	45.7	Very low	69.5	Low	67 Å²	67	88.3 Å²	88.3	41%	0.411	45%	0.452	S	S	.	.	S	Bend	trans	-152	103.3	175.5	40.4	0	0	0	0	112.6	Y444	Y444-T448 VanDerWaalsContact CE1-OG1 3.25Å; Y444-T448 WeakPolarHBondContact CE1-OG1 3.48Å; Y444-T448 PolarHBondContact OH-OG1 3.5Å
449	I	52.5	Low	69.7	Low	120 Å²	120	84.9 Å²	84.9	62%	0.615	44%	0.442	S	S	*	.			trans	71	102.9	161	-39.7	176.6	0	0	0	115.3	D451	I449-D451 HydrophobicContact CB-CB 4.36Å; I449-D451 HydrophobicContact CG2-CB 3.4Å; I449-D451 PolarHBondContact O-N 3.42Å
450	N	62.1	Low	70	Confident	119 Å²	119	85.4 Å²	85.4	64%	0.636	44%	0.444	S	S	*	.			trans	-72.4	58	167.8	-163.5	22.2	0	0	0	111.1
451	D	71.5	Confident	70.6	Confident	20 Å²	20	82.2 Å²	82.2	11%	0.107	43%	0.425	C	S	.	.			trans	-99.7	120.2	-175.7	175.5	-9.3	0	0	0	110.2	I449 R453 Y454	I449-D451 HydrophobicContact CB-CB 4.36Å; I449-D451 HydrophobicContact CG2-CB 3.4Å; I449-D451 PolarHBondContact O-N 3.42Å; D451-R453 VanDerWaalsContact CG-NE 3.3Å; D451-R453 PolarHBondContact O-N 3.39Å; D451-R453 WeakPolarHBondContact OD1-CB 3.42Å; D451-R453 WeakPolarHBondContact OD1-CG 3.39Å; D451-R453 PolarHBondContact OD1-N 3.07Å; D451-R453 IonicContact OD1-NE 3.88Å; D451-R453 PolarHBondContact OD1-NE 3.3Å; D451-R453 VanDerWaalsContact OD1-NE 3.08Å; D451-R453 IonicContact OD2-CZ 3.56Å; D451-R453 IonicContact OD2-NE 2.89Å; D451-R453 PolarHBondContact OD2-NE 3.25Å; D451-R453 IonicContact OD2-NH2 3.67Å; D451-R453 PolarHBondContact OD2-NH2 2.8Å; D451-Y454 HydrophobicContact CB-CD2 3.8Å; D451-Y454 HydrophobicContact CB-CE2 3.99Å; D451-Y454 PolarHBondContact O-N 3.35Å
452	P	76.5	Confident	71.7	Confident	92 Å²	92	81 Å²	81	60%	0.597	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-15.8	-177	25.1	-34.1	0	0	0	113.8	R184 Y454 N455	R184-P452 PolarHBondContact NH1-O 2.94Å; P452-Y454 PolarHBondContact O-N 3.03Å; P452-N455 PolarHBondContact O-N 3.41Å
453	R	79.6	Confident	73	Confident	122 Å²	122	75.2 Å²	75.2	46%	0.46	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.4	174.3	-65	-180	-69.7	177.3	-1.2	112.9	F187 D451	F187-R453 HydrophobicContact CD2-CB 4.21Å; F187-R453 HydrophobicContact CD2-CG 4.45Å; F187-R453 HydrophobicContact CE2-CG 4.45Å; D451-R453 VanDerWaalsContact CG-NE 3.3Å; D451-R453 PolarHBondContact O-N 3.39Å; D451-R453 WeakPolarHBondContact OD1-CB 3.42Å; D451-R453 WeakPolarHBondContact OD1-CG 3.39Å; D451-R453 PolarHBondContact OD1-N 3.07Å; D451-R453 IonicContact OD1-NE 3.88Å; D451-R453 PolarHBondContact OD1-NE 3.3Å; D451-R453 VanDerWaalsContact OD1-NE 3.08Å; D451-R453 IonicContact OD2-CZ 3.56Å; D451-R453 IonicContact OD2-NE 2.89Å; D451-R453 PolarHBondContact OD2-NE 3.25Å; D451-R453 IonicContact OD2-NH2 3.67Å; D451-R453 PolarHBondContact OD2-NH2 2.8Å
454	Y	80.2	Confident	74.9	Confident	48 Å²	48	69.7 Å²	69.7	19%	0.188	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-10.7	-179.9	-54.4	-70.4	0	0	0	113.5	T101 F187 H190 D451 P452 L456	T101-Y454 HydrophobicContact CG2-CD1 4.18Å; T101-Y454 HydrophobicContact CG2-CE1 4.13Å; F187-Y454 HydrophobicContact CB-CD1 4.44Å; F187-Y454 HydrophobicContact CB-CE1 3.81Å; H190-Y454 HydrophobicContact CB-CE1 4.24Å; H190-Y454 PolarHBondContact CD2-OH 3.44Å; D451-Y454 HydrophobicContact CB-CD2 3.8Å; D451-Y454 HydrophobicContact CB-CE2 3.99Å; D451-Y454 PolarHBondContact O-N 3.35Å; P452-Y454 PolarHBondContact O-N 3.03Å; Y454-L456 PolarHBondContact O-N 3.21Å
455	N	83.6	Confident	77.1	Confident	61 Å²	61	64.4 Å²	64.4	33%	0.326	34%	0.339	S	S	.	.			trans	-80.7	90	178.8	-71.3	-37.6	0	0	0	110.3	R184 K445 P452	R184-N455 PolarHBondContact NH2-O 3.41Å; K445-N455 WeakPolarHBondContact CE-OD1 3.32Å; P452-N455 PolarHBondContact O-N 3.41Å
456	L	89.2	Confident	79.5	Confident	33 Å²	33	60.3 Å²	60.3	17%	0.173	32%	0.322	C	S	.	.			trans	-95	130.5	173.9	-58.2	-173.2	0	0	0	110.8	L188 Y454 D460 L464	L188-L456 HydrophobicContact CD2-CD1 4.06Å; Y454-L456 PolarHBondContact O-N 3.21Å; L456-D460 HydrophobicContact CB-CB 3.96Å; L456-D460 HydrophobicContact CD2-CB 4.05Å; L456-D460 HydrophobicContact CG-CB 4.46Å; L456-L464 HydrophobicContact CD1-CD1 4.06Å
457	G	90.3	Very high	82.1	Confident	22 Å²	22	53.6 Å²	53.6	23%	0.227	29%	0.286	C	S	.	.			trans	-99.9	176.8	176.9	0	0	0	0	0	112.6	P459 D460 H461	G457-P459 VanDerWaalsContact C-CD 3.43Å; G457-P459 VanDerWaalsContact C-N 3.33Å; G457-D460 PolarHBondContact N-OD2 3.36Å; G457-D460 WeakPolarHBondContact O-CB 3.5Å; G457-D460 PolarHBondContact O-N 2.93Å; G457-H461 PolarHBondContact O-CD2 2.88Å; G457-H461 PolarHBondContact O-N 3.24Å; G457-H461 VanDerWaalsContact O-N 3.12Å
458	P	91.9	Very high	84.8	Confident	39 Å²	39	46.6 Å²	46.6	25%	0.253	25%	0.248	S	C	.	.	H	α-helix	trans	-52	-40.9	176.1	-26.6	34.1	0	0	0	115.1	D460 H461 R462	P458-D460 VanDerWaalsContact C-N 3.33Å; P458-D460 PolarHBondContact O-N 3.19Å; P458-H461 PolarHBondContact O-N 3.22Å; P458-R462 WeakPolarHBondContact O-CG 3.44Å; P458-R462 PolarHBondContact O-N 2.72Å
459	P	94.1	Very high	87.2	Confident	69 Å²	69	44.8 Å²	44.8	45%	0.448	23%	0.234	S	C	.	.	H	α-helix	trans	-59.4	-41.1	173.5	-22.1	33.7	0	0	0	113.4	G457 H461 R462 D463	G457-P459 VanDerWaalsContact C-CD 3.43Å; G457-P459 VanDerWaalsContact C-N 3.33Å; P459-H461 PolarHBondContact O-N 3.04Å; P459-R462 WeakPolarHBondContact O-CB 3.29Å; P459-R462 PolarHBondContact O-N 3.44Å; P459-D463 PolarHBondContact O-N 3.02Å
460	D	94.7	Very high	89.3	Confident	28 Å²	28	39 Å²	39	15%	0.15	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-42.4	178.6	-62	-67.9	0	0	0	111.2	R184 F185 L456 G457 P458 R462 D463 L464	R184-D460 IonicContact CZ-OD1 3.32Å; R184-D460 IonicContact CZ-OD2 2.81Å; R184-D460 IonicContact NE-OD1 3.81Å; R184-D460 PolarHBondContact NE-OD1 2.86Å; R184-D460 IonicContact NE-OD2 3.62Å; R184-D460 IonicContact NH2-OD1 3.77Å; R184-D460 PolarHBondContact NH2-OD1 2.94Å; R184-D460 IonicContact NH2-OD2 3.52Å; R184-D460 PolarHBondContact NH2-OD2 3.27Å; F185-D460 HydrophobicContact CE1-CB 4.16Å; L456-D460 HydrophobicContact CB-CB 3.96Å; L456-D460 HydrophobicContact CD2-CB 4.05Å; L456-D460 HydrophobicContact CG-CB 4.46Å; G457-D460 PolarHBondContact N-OD2 3.36Å; G457-D460 WeakPolarHBondContact O-CB 3.5Å; G457-D460 PolarHBondContact O-N 2.93Å; P458-D460 VanDerWaalsContact C-N 3.33Å; P458-D460 PolarHBondContact O-N 3.19Å; D460-R462 VanDerWaalsContact C-N 3.34Å; D460-R462 PolarHBondContact O-N 3.34Å; D460-D463 PolarHBondContact O-N 3.45Å; D460-L464 WeakPolarHBondContact O-CG 3.23Å; D460-L464 PolarHBondContact O-N 3.28Å
461	H	94.9	Very high	90.9	Very high	39 Å²	39	33.4 Å²	33.4	18%	0.181	17%	0.174	C	C	.	.	H	α-helix	trans	-66.5	-35.8	177.2	-70	-68.9	0	0	0	112.9	H103 G457 P458 P459 D463 L464 M465	H103-H461 AromaticContact CE1-CE1 3.33Å; H103-H461 PolarHBondContact CE1-CE1 3.35Å; H103-H461 AromaticContact CE1-ND1 3.51Å; H103-H461 AromaticContact ND1-CE1 3.93Å; H103-H461 AromaticContact NE2-CE1 3.89Å; G457-H461 PolarHBondContact O-CD2 2.88Å; G457-H461 PolarHBondContact O-N 3.24Å; G457-H461 VanDerWaalsContact O-N 3.12Å; P458-H461 PolarHBondContact O-N 3.22Å; P459-H461 PolarHBondContact O-N 3.04Å; H461-D463 VanDerWaalsContact C-N 3.33Å; H461-L464 PolarHBondContact O-N 3.01Å; H461-M465 PolarHBondContact O-N 2.89Å
462	R	95.9	Very high	91.9	Very high	56 Å²	56	34 Å²	34	21%	0.211	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-42.8	173.1	-73.2	-160	-65	-86.6	-0.3	111.5	G290 N297 P458 P459 D460 M465 M466	G290-R462 VanDerWaalsContact O-CD 3.23Å; G290-R462 WeakPolarHBondContact O-CD 3.44Å; G290-R462 VanDerWaalsContact O-CG 3.31Å; G290-R462 WeakPolarHBondContact O-CG 3.23Å; N297-R462 HydrophobicContact CB-CG 4.49Å; N297-R462 WeakPolarHBondContact ND2-CA 3.44Å; N297-R462 VanDerWaalsContact ND2-CB 3.3Å; N297-R462 WeakPolarHBondContact ND2-CB 3.4Å; N297-R462 PolarHBondContact ND2-O 3.35Å; N297-R462 VanDerWaalsContact ND2-O 3.09Å; N297-R462 VanDerWaalsContact OD1-CG 3.29Å; N297-R462 WeakPolarHBondContact OD1-CG 3.26Å; P458-R462 WeakPolarHBondContact O-CG 3.44Å; P458-R462 PolarHBondContact O-N 2.72Å; P459-R462 WeakPolarHBondContact O-CB 3.29Å; P459-R462 PolarHBondContact O-N 3.44Å; D460-R462 VanDerWaalsContact C-N 3.34Å; D460-R462 PolarHBondContact O-N 3.34Å; R462-M465 PolarHBondContact O-N 3.46Å; R462-M466 PolarHBondContact O-N 3.36Å
463	D	96.5	Very high	92.7	Very high	38 Å²	38	31.5 Å²	31.5	20%	0.203	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-43.5	176.6	-75.9	1.4	0	0	0	110.9	F185 P459 D460 H461 M465 M466 L467 P662	F185-D463 HydrophobicContact CE2-CB 4.42Å; F185-D463 HydrophobicContact CZ-CB 4.02Å; P459-D463 PolarHBondContact O-N 3.02Å; D460-D463 PolarHBondContact O-N 3.45Å; H461-D463 VanDerWaalsContact C-N 3.33Å; D463-M465 PolarHBondContact O-N 3.19Å; D463-M466 PolarHBondContact O-N 3.17Å; D463-L467 VanDerWaalsContact O-CB 3.3Å; D463-L467 WeakPolarHBondContact O-CB 3.41Å; D463-L467 WeakPolarHBondContact O-CD1 3.07Å; D463-L467 VanDerWaalsContact O-CG 3.22Å; D463-L467 WeakPolarHBondContact O-CG 3.15Å; D463-L467 PolarHBondContact O-N 3.2Å; D463-P662 HydrophobicContact CB-CB 4.21Å; D463-P662 HydrophobicContact CB-CG 4.33Å
464	L	96.4	Very high	93.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-45.8	175.2	-76	173	0	0	0	112.4	I179 F185 L188 Y314 L456 D460 H461 T468	I179-L464 HydrophobicContact CG2-CD2 3.74Å; F185-L464 HydrophobicContact CB-CD2 4.26Å; F185-L464 HydrophobicContact CD1-CD1 4.28Å; F185-L464 HydrophobicContact CD1-CD2 3.54Å; F185-L464 HydrophobicContact CD1-CG 3.93Å; F185-L464 HydrophobicContact CD2-CD2 3.84Å; F185-L464 HydrophobicContact CE1-CD1 4.14Å; F185-L464 HydrophobicContact CE1-CD2 3.73Å; F185-L464 HydrophobicContact CE1-CG 3.64Å; F185-L464 HydrophobicContact CE2-CD2 4.04Å; F185-L464 HydrophobicContact CE2-CG 4.41Å; F185-L464 HydrophobicContact CG-CD2 3.6Å; F185-L464 HydrophobicContact CG-CG 4.43Å; F185-L464 HydrophobicContact CZ-CD2 3.98Å; F185-L464 HydrophobicContact CZ-CG 3.91Å; L188-L464 HydrophobicContact CD1-CD2 3.73Å; L188-L464 HydrophobicContact CD2-CD1 4.07Å; L188-L464 HydrophobicContact CD2-CD2 4.44Å; Y314-L464 HydrophobicContact CD1-CB 4.09Å; Y314-L464 HydrophobicContact CD1-CD1 4.1Å; Y314-L464 HydrophobicContact CE1-CD1 3.89Å; Y314-L464 HydrophobicContact CG-CB 4.16Å; L456-L464 HydrophobicContact CD1-CD1 4.06Å; D460-L464 WeakPolarHBondContact O-CG 3.23Å; D460-L464 PolarHBondContact O-N 3.28Å; H461-L464 PolarHBondContact O-N 3.01Å; L464-T468 WeakPolarHBondContact O-CB 3.45Å; L464-T468 PolarHBondContact O-N 3.47Å; L464-T468 PolarHBondContact O-OG1 2.97Å
465	M	96	Very high	93.9	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.02	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-46.1	178.3	-172.6	61.9	105	0	0	111.2	P292 E293 T295 P313 T317 H461 R462 D463 T468 Y469	P292-M465 WeakPolarHBondContact O-CE 3.38Å; E293-M465 WeakPolarHBondContact O-CE 3.49Å; T295-M465 WeakPolarHBondContact O-CE 3.49Å; T295-M465 VanDerWaalsContact O-CG 3.31Å; T295-M465 WeakPolarHBondContact O-CG 3.5Å; P313-M465 HydrophobicContact CB-CE 3.72Å; T317-M465 HydrophobicContact CG2-CE 4.47Å; T317-M465 HydrophobicContact CG2-SD 3.77Å; H461-M465 PolarHBondContact O-N 2.89Å; R462-M465 PolarHBondContact O-N 3.46Å; D463-M465 PolarHBondContact O-N 3.19Å; M465-T468 PolarHBondContact O-N 3.08Å; M465-Y469 WeakPolarHBondContact O-CB 3.16Å; M465-Y469 PolarHBondContact O-N 3.13Å
466	M	96.3	Very high	94	Very high	2 Å²	2	26 Å²	26	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-43.5	-180	-167.1	66.7	71.2	0	0	112.3	P296 R462 D463 T468 Y469 F470 L590 L624 V659 P662	P296-M466 HydrophobicContact CB-CE 4.04Å; P296-M466 HydrophobicContact CB-SD 4.09Å; R462-M466 PolarHBondContact O-N 3.36Å; D463-M466 PolarHBondContact O-N 3.17Å; M466-T468 VanDerWaalsContact C-N 3.34Å; M466-Y469 PolarHBondContact O-N 3.36Å; M466-F470 HydrophobicContact CG-CD2 3.99Å; M466-F470 HydrophobicContact CG-CE2 3.86Å; M466-F470 VanDerWaalsContact O-CD2 3.31Å; M466-F470 WeakPolarHBondContact O-CD2 3.43Å; M466-F470 PolarHBondContact O-N 3.43Å; M466-F470 HydrophobicContact SD-CD2 4.19Å; M466-F470 HydrophobicContact SD-CE2 3.63Å; M466-L590 HydrophobicContact CE-CD1 4.43Å; M466-L590 HydrophobicContact CE-CD2 3.52Å; M466-L590 HydrophobicContact SD-CD1 3.97Å; M466-L590 HydrophobicContact SD-CD2 4.15Å; M466-L624 HydrophobicContact CE-CD1 4.18Å; M466-L624 HydrophobicContact SD-CD1 3.9Å; M466-V659 HydrophobicContact CE-CG1 3.9Å; M466-P662 HydrophobicContact CB-CG 3.87Å; M466-P662 HydrophobicContact CG-CG 3.94Å
467	L	96.8	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-43	176.3	-74.2	164.5	0	0	0	111.2	I179 I182 F185 D463 F470 M471 P493 P662 F665	I179-L467 HydrophobicContact CG1-CB 4.32Å; I182-L467 HydrophobicContact CD1-CD1 3.5Å; I182-L467 HydrophobicContact CD1-CD2 3.94Å; I182-L467 HydrophobicContact CD1-CG 4.34Å; F185-L467 HydrophobicContact CD2-CD1 4Å; F185-L467 HydrophobicContact CE2-CD1 3.51Å; D463-L467 VanDerWaalsContact O-CB 3.3Å; D463-L467 WeakPolarHBondContact O-CB 3.41Å; D463-L467 WeakPolarHBondContact O-CD1 3.07Å; D463-L467 VanDerWaalsContact O-CG 3.22Å; D463-L467 WeakPolarHBondContact O-CG 3.15Å; D463-L467 PolarHBondContact O-N 3.2Å; L467-F470 PolarHBondContact O-N 2.9Å; L467-M471 VanDerWaalsContact O-CB 3.31Å; L467-M471 WeakPolarHBondContact O-CB 3.36Å; L467-M471 VanDerWaalsContact O-CG 3.26Å; L467-M471 WeakPolarHBondContact O-CG 3.37Å; L467-M471 PolarHBondContact O-N 3.49Å; L467-P493 HydrophobicContact CD2-CB 4.31Å; L467-P662 HydrophobicContact CD1-CB 4.49Å; L467-P662 HydrophobicContact CD2-CB 4.33Å; L467-P662 HydrophobicContact CD2-CG 4.33Å; L467-P662 HydrophobicContact CG-CB 4.22Å; L467-P662 HydrophobicContact CG-CG 4.02Å; L467-F665 HydrophobicContact CD2-CE1 4.31Å; L467-F665 HydrophobicContact CD2-CE2 3.99Å; L467-F665 HydrophobicContact CD2-CZ 3.72Å
468	T	96.4	Very high	93.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-42.2	179.6	-48.9	0	0	0	0	111.4	V175 I179 Y314 L318 L464 M465 M466 M471 S472	V175-T468 HydrophobicContact CG1-CG2 3.85Å; I179-T468 HydrophobicContact CD1-CG2 4.19Å; I179-T468 WeakPolarHBondContact CD1-OG1 3.19Å; Y314-T468 WeakPolarHBondContact O-CG2 3.28Å; L318-T468 HydrophobicContact CD1-CG2 4.21Å; L318-T468 HydrophobicContact CD2-CG2 3.53Å; L318-T468 HydrophobicContact CG-CG2 3.84Å; L464-T468 WeakPolarHBondContact O-CB 3.45Å; L464-T468 PolarHBondContact O-N 3.47Å; L464-T468 PolarHBondContact O-OG1 2.97Å; M465-T468 PolarHBondContact O-N 3.08Å; M466-T468 VanDerWaalsContact C-N 3.34Å; T468-M471 PolarHBondContact O-N 2.87Å; T468-S472 VanDerWaalsContact O-CB 3.23Å; T468-S472 WeakPolarHBondContact O-CB 3.47Å; T468-S472 PolarHBondContact O-N 2.93Å; T468-S472 PolarHBondContact O-OG 3.46Å
469	Y	96.3	Very high	93.5	Very high	28 Å²	28	31.6 Å²	31.6	11%	0.11	17%	0.172	C	C	.	.	H	α-helix	trans	-56.4	-50.2	173.3	170.2	-89.8	0	0	0	112.5	P296 M465 M466 S472 T473 L624	P296-Y469 HydrophobicContact CG-CD1 4.08Å; P296-Y469 HydrophobicContact CG-CD2 3.5Å; P296-Y469 VanDerWaalsContact CG-CD2 3.5Å; P296-Y469 HydrophobicContact CG-CE2 4.14Å; P296-Y469 HydrophobicContact CG-CG 3.47Å; P296-Y469 VanDerWaalsContact CG-CG 3.47Å; M465-Y469 WeakPolarHBondContact O-CB 3.16Å; M465-Y469 PolarHBondContact O-N 3.13Å; M466-Y469 PolarHBondContact O-N 3.36Å; Y469-S472 PolarHBondContact O-OG 2.91Å; Y469-T473 HydrophobicContact CD2-CG2 4.32Å; Y469-T473 HydrophobicContact CE2-CG2 3.99Å; Y469-T473 WeakPolarHBondContact O-CB 3.45Å; Y469-T473 VanDerWaalsContact O-CG2 3.3Å; Y469-T473 WeakPolarHBondContact O-CG2 3.16Å; Y469-T473 PolarHBondContact O-N 2.95Å; Y469-T473 PolarHBondContact O-OG1 3.42Å; Y469-L624 HydrophobicContact CE1-CB 3.73Å; Y469-L624 HydrophobicContact CE1-CG 4.4Å; Y469-L624 PolarHBondContact OH-N 3.22Å; Y469-L624 PolarHBondContact OH-O 3.4Å
470	F	96	Very high	92.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-68.5	-42	-179.4	-80.8	-61.4	0	0	0	112.1	M466 L467 S472 T473 L474 L590 L624 I626 L661 F665	M466-F470 HydrophobicContact CG-CD2 3.99Å; M466-F470 HydrophobicContact CG-CE2 3.86Å; M466-F470 VanDerWaalsContact O-CD2 3.31Å; M466-F470 WeakPolarHBondContact O-CD2 3.43Å; M466-F470 PolarHBondContact O-N 3.43Å; M466-F470 HydrophobicContact SD-CD2 4.19Å; M466-F470 HydrophobicContact SD-CE2 3.63Å; L467-F470 PolarHBondContact O-N 2.9Å; F470-S472 VanDerWaalsContact C-N 3.34Å; F470-S472 PolarHBondContact O-N 3.42Å; F470-T473 PolarHBondContact O-OG1 3.07Å; F470-L474 HydrophobicContact CB-CD1 4.3Å; F470-L474 HydrophobicContact CD1-CD1 4.27Å; F470-L474 WeakPolarHBondContact O-CB 3.41Å; F470-L474 WeakPolarHBondContact O-CD1 3.35Å; F470-L474 VanDerWaalsContact O-CG 3.24Å; F470-L474 WeakPolarHBondContact O-CG 3.31Å; F470-L474 PolarHBondContact O-N 3.16Å; F470-L590 HydrophobicContact CE2-CD1 3.66Å; F470-L590 HydrophobicContact CZ-CD1 3.49Å; F470-L590 VanDerWaalsContact CZ-CD1 3.49Å; F470-L624 HydrophobicContact CZ-CB 4.21Å; F470-I626 HydrophobicContact CD1-CD1 4.32Å; F470-I626 HydrophobicContact CD1-CG1 4.3Å; F470-I626 HydrophobicContact CD2-CD1 4.07Å; F470-I626 HydrophobicContact CD2-CG1 4.44Å; F470-I626 HydrophobicContact CE1-CD1 4.17Å; F470-I626 HydrophobicContact CE1-CG1 3.68Å; F470-I626 HydrophobicContact CE2-CD1 3.89Å; F470-I626 HydrophobicContact CE2-CG1 3.83Å; F470-I626 HydrophobicContact CG-CD1 4.29Å; F470-I626 HydrophobicContact CZ-CD1 3.95Å; F470-I626 HydrophobicContact CZ-CG1 3.41Å; F470-I626 VanDerWaalsContact CZ-CG1 3.41Å; F470-L661 HydrophobicContact CE2-CD2 4.36Å; F470-F665 HydrophobicContact CD2-CE2 4.43Å; F470-F665 HydrophobicContact CD2-CZ 4.43Å
471	M	95	Very high	91.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-70.9	-30.2	-179.1	-68.9	-56.3	98.5	0	0	112.8	V175 L467 T468 L474 A475 P493 H496	V175-M471 HydrophobicContact CB-CB 4.49Å; V175-M471 HydrophobicContact CG1-CB 3.65Å; L467-M471 VanDerWaalsContact O-CB 3.31Å; L467-M471 WeakPolarHBondContact O-CB 3.36Å; L467-M471 VanDerWaalsContact O-CG 3.26Å; L467-M471 WeakPolarHBondContact O-CG 3.37Å; L467-M471 PolarHBondContact O-N 3.49Å; T468-M471 PolarHBondContact O-N 2.87Å; M471-L474 HydrophobicContact CE-CD1 4.4Å; M471-A475 WeakPolarHBondContact O-CB 3.36Å; M471-A475 PolarHBondContact O-N 3.02Å; M471-P493 HydrophobicContact CE-CB 4.19Å; M471-P493 HydrophobicContact CG-CB 3.99Å; M471-P493 HydrophobicContact CG-CG 4.36Å; M471-P493 VanDerWaalsContact SD-CA 3.54Å; M471-P493 HydrophobicContact SD-CB 3.62Å; M471-P493 HydrophobicContact SD-CG 4.33Å; M471-H496 HydrophobicContact SD-CB 4.4Å
472	S	93.8	Very high	90.3	Very high	33 Å²	33	39 Å²	39	23%	0.231	22%	0.222	C	C	.	.	H	α-helix	trans	-71.7	-49.8	174.2	68.5	0	0	0	0	111.3	T468 Y469 F470 A475	T468-S472 VanDerWaalsContact O-CB 3.23Å; T468-S472 WeakPolarHBondContact O-CB 3.47Å; T468-S472 PolarHBondContact O-N 2.93Å; T468-S472 PolarHBondContact O-OG 3.46Å; Y469-S472 PolarHBondContact O-OG 2.91Å; F470-S472 VanDerWaalsContact C-N 3.34Å; F470-S472 PolarHBondContact O-N 3.42Å; S472-A475 VanDerWaalsContact O-CB 3.29Å; S472-A475 WeakPolarHBondContact O-CB 3.47Å; S472-A475 PolarHBondContact O-N 3.18Å
473	T	92.6	Very high	88.3	Confident	40 Å²	40	41.4 Å²	41.4	25%	0.245	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-38.6	-178.6	56	0	0	0	0	111.9	Y469 F470 A475 G642	Y469-T473 HydrophobicContact CD2-CG2 4.32Å; Y469-T473 HydrophobicContact CE2-CG2 3.99Å; Y469-T473 WeakPolarHBondContact O-CB 3.45Å; Y469-T473 VanDerWaalsContact O-CG2 3.3Å; Y469-T473 WeakPolarHBondContact O-CG2 3.16Å; Y469-T473 PolarHBondContact O-N 2.95Å; Y469-T473 PolarHBondContact O-OG1 3.42Å; F470-T473 PolarHBondContact O-OG1 3.07Å; T473-A475 VanDerWaalsContact C-N 3.28Å; T473-A475 PolarHBondContact O-N 3.27Å; T473-G642 WeakPolarHBondContact O-CA 3.45Å
474	L	93.3	Very high	86.6	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	3.6	178.5	-63.4	168	0	0	0	113.6	F470 M471 C476 A477 H496 L497 T640 T641	F470-L474 HydrophobicContact CB-CD1 4.3Å; F470-L474 HydrophobicContact CD1-CD1 4.27Å; F470-L474 WeakPolarHBondContact O-CB 3.41Å; F470-L474 WeakPolarHBondContact O-CD1 3.35Å; F470-L474 VanDerWaalsContact O-CG 3.24Å; F470-L474 WeakPolarHBondContact O-CG 3.31Å; F470-L474 PolarHBondContact O-N 3.16Å; M471-L474 HydrophobicContact CE-CD1 4.4Å; L474-C476 VanDerWaalsContact C-N 3.3Å; L474-C476 PolarHBondContact O-N 3.05Å; L474-A477 HydrophobicContact CB-CB 4.27Å; L474-A477 HydrophobicContact CD2-CB 3.91Å; L474-A477 WeakPolarHBondContact O-CB 3.45Å; L474-A477 PolarHBondContact O-N 2.59Å; L474-H496 PolarHBondContact O-NE2 3.21Å; L474-L497 HydrophobicContact CD1-CD1 3.49Å; L474-L497 VanDerWaalsContact CD1-CD1 3.49Å; L474-T640 HydrophobicContact CD1-CG2 3.96Å; L474-T640 HydrophobicContact CD2-CG2 3.86Å; L474-T641 WeakPolarHBondContact CD2-O 3.43Å
475	A	90.9	Very high	85	Confident	18 Å²	18	48.3 Å²	48.3	15%	0.149	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-49.1	-176.4	0	0	0	0	0	111	R174 M471 S472 T473	R174-A475 VanDerWaalsContact NH2-CA 3.32Å; R174-A475 PolarHBondContact NH2-O 3.19Å; M471-A475 WeakPolarHBondContact O-CB 3.36Å; M471-A475 PolarHBondContact O-N 3.02Å; S472-A475 VanDerWaalsContact O-CB 3.29Å; S472-A475 WeakPolarHBondContact O-CB 3.47Å; S472-A475 PolarHBondContact O-N 3.18Å; T473-A475 VanDerWaalsContact C-N 3.28Å; T473-A475 PolarHBondContact O-N 3.27Å
476	C	87.4	Confident	83.6	Confident	96 Å²	96	55.9 Å²	55.9	65%	0.649	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	17.6	-178.5	-58.5	0	0	0	0	113.2	L474	L474-C476 VanDerWaalsContact C-N 3.3Å; L474-C476 PolarHBondContact O-N 3.05Å
477	A	88.5	Confident	82.5	Confident	29 Å²	29	63.3 Å²	63.3	24%	0.24	35%	0.352	C	S	.	.			trans	-67.2	149.2	179.6	0	0	0	0	0	111.4	L474 T479	L474-A477 HydrophobicContact CB-CB 4.27Å; L474-A477 HydrophobicContact CD2-CB 3.91Å; L474-A477 WeakPolarHBondContact O-CB 3.45Å; L474-A477 PolarHBondContact O-N 2.59Å; A477-T479 PolarHBondContact O-N 2.85Å
478	Y	86.4	Confident	81.8	Confident	160 Å²	160	67.4 Å²	67.4	63%	0.627	37%	0.371	S	S	*	.			trans	-62.3	132.7	173.2	-67.4	-76.2	0	0	0	110.6	C500 I501	Y478-C500 WeakPolarHBondContact O-CA 3.39Å; Y478-I501 PolarHBondContact O-N 2.81Å
479	T	86.1	Confident	81.4	Confident	21 Å²	21	71 Å²	71	13%	0.129	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-119.1	160.3	178.6	59.9	0	0	0	0	111.1	A477 L481 D499	A477-T479 PolarHBondContact O-N 2.85Å; T479-L481 VanDerWaalsContact C-N 3.25Å; T479-L481 PolarHBondContact OG1-O 3.19Å; T479-D499 CarbonylContact C-O 3.42Å; T479-D499 WeakPolarHBondContact CA-O 3.13Å; T479-D499 WeakPolarHBondContact CB-O 3.19Å; T479-D499 HydrophobicContact CG2-CB 4.21Å
480	S	80.4	Confident	81.1	Confident	91 Å²	91	69.7 Å²	69.7	64%	0.636	39%	0.391	S	S	*	.	S	Bend	trans	-74.2	-15.7	174.7	58.2	0	0	0	0	113.6	D499	S480-D499 PolarHBondContact N-O 3.15Å; S480-D499 PolarHBondContact OG-O 2.77Å
481	L	72.7	Confident	80.8	Confident	84 Å²	84	70.9 Å²	70.9	44%	0.44	40%	0.403	S	S	.	.	S	Bend	trans	-87.8	157.8	172.1	-66.2	175.4	0	0	0	110	T479 S483 D499	T479-L481 VanDerWaalsContact C-N 3.25Å; T479-L481 PolarHBondContact OG1-O 3.19Å; L481-S483 PolarHBondContact O-N 2.89Å; L481-D499 WeakPolarHBondContact CD1-OD2 3.42Å
482	P	62.8	Low	80.8	Confident	117 Å²	117	73.1 Å²	73.1	76%	0.76	41%	0.413	S	S	*	.	S	Bend	trans	-46.4	130.8	174.8	-24.4	32.1	0	0	0	110.2	R484	P482-R484 PolarHBondContact O-N 3.35Å
483	S	53.8	Low	80.7	Confident	107 Å²	107	71.6 Å²	71.6	75%	0.748	40%	0.402	S	S	*	.			trans	-47.1	111	-170.9	48.6	0	0	0	0	110.9	L481 L485	L481-S483 PolarHBondContact O-N 2.89Å; S483-L485 PolarHBondContact O-N 2.9Å
484	R	60.4	Low	80.7	Confident	65 Å²	65	69.7 Å²	69.7	25%	0.245	39%	0.391	C	S	.	.			trans	-61.1	123.4	177.8	-65	-168.9	-168.1	-179.9	13.2	108.2	P482 E488 S489 L490 D499	P482-R484 PolarHBondContact O-N 3.35Å; R484-E488 VanDerWaalsContact CA-OE2 3.24Å; R484-E488 WeakPolarHBondContact CA-OE2 3.28Å; R484-E488 HydrophobicContact CB-CB 4.26Å; R484-E488 WeakPolarHBondContact CB-OE2 3.25Å; R484-S489 PolarHBondContact NH1-O 3.13Å; R484-L490 PolarHBondContact NH1-O 2.85Å; R484-D499 IonicContact NH2-OD2 2.78Å; R484-D499 PolarHBondContact NH2-OD2 3.28Å
485	L	63.8	Low	80.4	Confident	118 Å²	118	71 Å²	71	62%	0.618	40%	0.402	S	S	*	.			trans	-57	153.4	177.1	-69	167.2	0	0	0	109.4	S483 D487 E488	S483-L485 PolarHBondContact O-N 2.9Å; L485-D487 PolarHBondContact O-N 2.76Å; L485-E488 HydrophobicContact CB-CG 4.1Å; L485-E488 PolarHBondContact N-OE2 2.95Å; L485-E488 PolarHBondContact O-N 3.3Å
486	K	66.6	Low	80.4	Confident	163 Å²	163	70.3 Å²	70.3	71%	0.709	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-28.1	-177.1	-83.9	-175.5	175.4	179.3	0	113.3	R174	R174-K486 PolarHBondContact NH1-O 3.5Å
487	D	72	Confident	80.6	Confident	157 Å²	157	66.1 Å²	66.1	84%	0.84	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	0.5	-176.3	-54.6	-39.2	0	0	0	114.3	L485	L485-D487 PolarHBondContact O-N 2.76Å
488	E	81.6	Confident	80.6	Confident	87 Å²	87	67.6 Å²	67.6	41%	0.407	37%	0.37	S	S	.	.	S	Bend	trans	-79.3	153.9	179	-77.7	177.4	-174.7	0	0	113	R484 L485	R484-E488 VanDerWaalsContact CA-OE2 3.24Å; R484-E488 WeakPolarHBondContact CA-OE2 3.28Å; R484-E488 HydrophobicContact CB-CB 4.26Å; R484-E488 WeakPolarHBondContact CB-OE2 3.25Å; L485-E488 HydrophobicContact CB-CG 4.1Å; L485-E488 PolarHBondContact N-OE2 2.95Å; L485-E488 PolarHBondContact O-N 3.3Å
489	S	88.6	Confident	80.6	Confident	76 Å²	76	61.6 Å²	61.6	53%	0.531	35%	0.349	S	S	.	.			trans	-63.1	138	175.8	-178	0	0	0	0	111.4	R484 G491	R484-S489 PolarHBondContact NH1-O 3.13Å; S489-G491 PolarHBondContact O-N 2.9Å; S489-G491 PolarHBondContact OG-N 2.85Å
490	L	90.2	Very high	80.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.343	C	S	.	.			trans	-72.3	-18.5	169.3	-78.6	179.4	0	0	0	112.5	R174 V175 R484 H496	R174-L490 HydrophobicContact CB-CG 4.41Å; R174-L490 HydrophobicContact CG-CD1 4.48Å; V175-L490 HydrophobicContact CG2-CD1 4.18Å; R484-L490 PolarHBondContact NH1-O 2.85Å; L490-H496 WeakPolarHBondContact CD2-CE1 3.13Å; L490-H496 WeakPolarHBondContact CD2-ND1 3.38Å; L490-H496 WeakPolarHBondContact CD2-NE2 3.21Å
491	G	90.7	Very high	81.4	Confident	24 Å²	24	61 Å²	61	25%	0.247	34%	0.337	C	S	.	.			trans	61.4	-151	-174.1	0	0	0	0	0	111.7	S178 S489	S178-G491 VanDerWaalsContact CA-O 3.3Å; S178-G491 WeakPolarHBondContact CA-O 3.5Å; S178-G491 VanDerWaalsContact CB-O 3.27Å; S178-G491 WeakPolarHBondContact CB-O 3.47Å; S178-G491 PolarHBondContact OG-O 2.86Å; S489-G491 PolarHBondContact O-N 2.9Å; S489-G491 PolarHBondContact OG-N 2.85Å
492	H	93.4	Very high	82.5	Confident	48 Å²	48	58.2 Å²	58.2	22%	0.222	32%	0.324	C	S	.	.	S	Bend	trans	-68.8	134.3	-178.6	-166.8	-90.1	0	0	0	111.7	E181 V494 A495 H496 D668	E181-H492 HydrophobicContact CB-CB 4.45Å; H492-V494 VanDerWaalsContact C-N 3.27Å; H492-V494 PolarHBondContact ND1-N 3.07Å; H492-V494 PolarHBondContact O-N 2.82Å; H492-V494 VanDerWaalsContact O-N 3.16Å; H492-A495 HydrophobicContact CB-CB 4.23Å; H492-A495 WeakPolarHBondContact O-CB 3.35Å; H492-A495 PolarHBondContact O-N 2.84Å; H492-H496 PolarHBondContact O-N 2.94Å; H492-D668 VanDerWaalsContact CE1-CB 3.43Å; H492-D668 WeakPolarHBondContact CE1-CB 3.44Å; H492-D668 IonicContact CE1-OD2 2.7Å; H492-D668 IonicContact NE2-OD2 3.69Å
493	P	93.5	Very high	84	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.4	-38.2	-174.3	-30.9	37.4	0	0	0	114.3	S178 I182 L467 M471 L497	S178-P493 WeakPolarHBondContact O-CD 3.43Å; S178-P493 WeakPolarHBondContact O-CG 3.4Å; S178-P493 WeakPolarHBondContact OG-CD 3.3Å; S178-P493 WeakPolarHBondContact OG-CG 3.26Å; I182-P493 HydrophobicContact CD1-CB 4.27Å; I182-P493 HydrophobicContact CD1-CG 3.73Å; I182-P493 HydrophobicContact CG1-CG 4Å; L467-P493 HydrophobicContact CD2-CB 4.31Å; M471-P493 HydrophobicContact CE-CB 4.19Å; M471-P493 HydrophobicContact CG-CB 3.99Å; M471-P493 HydrophobicContact CG-CG 4.36Å; M471-P493 VanDerWaalsContact SD-CA 3.54Å; M471-P493 HydrophobicContact SD-CB 3.62Å; M471-P493 HydrophobicContact SD-CG 4.33Å; P493-L497 WeakPolarHBondContact O-CB 3.35Å; P493-L497 PolarHBondContact O-N 2.84Å
494	V	91	Very high	85.9	Confident	1 Å²	1	57 Å²	57	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-70.4	-39.3	179.4	-176.2	0	0	0	0	111.3	H492 L497 L498 C664 F665 D668 Q669	H492-V494 VanDerWaalsContact C-N 3.27Å; H492-V494 PolarHBondContact ND1-N 3.07Å; H492-V494 PolarHBondContact O-N 2.82Å; H492-V494 VanDerWaalsContact O-N 3.16Å; V494-L497 PolarHBondContact O-N 3.04Å; V494-L498 HydrophobicContact CG1-CD1 4.15Å; V494-L498 WeakPolarHBondContact O-CB 3.48Å; V494-L498 VanDerWaalsContact O-CG 3.25Å; V494-L498 WeakPolarHBondContact O-CG 3.38Å; V494-L498 PolarHBondContact O-N 3.47Å; V494-C664 HydrophobicContact CG2-CB 4.39Å; V494-C664 WeakPolarHBondContact CG2-O 3.46Å; V494-F665 HydrophobicContact CG2-CD1 3.93Å; V494-F665 HydrophobicContact CG2-CE1 4.49Å; V494-D668 HydrophobicContact CG2-CB 4.21Å; V494-Q669 HydrophobicContact CG1-CG 3.77Å
495	A	88.8	Confident	87.5	Confident	29 Å²	29	54.8 Å²	54.8	24%	0.24	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-46.8	176.2	0	0	0	0	0	110.1	H492 L497 L498 D499	H492-A495 HydrophobicContact CB-CB 4.23Å; H492-A495 WeakPolarHBondContact O-CB 3.35Å; H492-A495 PolarHBondContact O-N 2.84Å; A495-L497 PolarHBondContact O-N 3.29Å; A495-L498 PolarHBondContact O-N 2.98Å; A495-L498 VanDerWaalsContact O-N 3.12Å; A495-D499 VanDerWaalsContact O-CG 3.24Å; A495-D499 PolarHBondContact O-N 2.8Å
496	H	90.4	Very high	88.8	Confident	3 Å²	3	51.9 Å²	51.9	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-58.1	-45.1	176.2	-173.3	62.6	0	0	0	112.6	M471 L474 L490 H492 L498 D499 C500	M471-H496 HydrophobicContact SD-CB 4.4Å; L474-H496 PolarHBondContact O-NE2 3.21Å; L490-H496 WeakPolarHBondContact CD2-CE1 3.13Å; L490-H496 WeakPolarHBondContact CD2-ND1 3.38Å; L490-H496 WeakPolarHBondContact CD2-NE2 3.21Å; H492-H496 PolarHBondContact O-N 2.94Å; H496-L498 VanDerWaalsContact C-N 3.32Å; H496-L498 PolarHBondContact O-N 2.77Å; H496-D499 PolarHBondContact O-N 2.83Å; H496-C500 PolarHBondContact O-N 3.08Å; H496-C500 PolarHBondContact O-SG 2.93Å
497	L	91.3	Very high	89.9	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-58.8	-42.4	175.7	-179.6	75.7	0	0	0	112.2	L474 P493 V494 A495 C500 I626 T640 F665	L474-L497 HydrophobicContact CD1-CD1 3.49Å; L474-L497 VanDerWaalsContact CD1-CD1 3.49Å; P493-L497 WeakPolarHBondContact O-CB 3.35Å; P493-L497 PolarHBondContact O-N 2.84Å; V494-L497 PolarHBondContact O-N 3.04Å; A495-L497 PolarHBondContact O-N 3.29Å; L497-C500 WeakPolarHBondContact O-CB 3.49Å; L497-C500 PolarHBondContact O-N 2.75Å; L497-I626 HydrophobicContact CD1-CD1 3.87Å; L497-I626 HydrophobicContact CD2-CD1 3.6Å; L497-I626 HydrophobicContact CG-CD1 4.4Å; L497-T640 HydrophobicContact CD1-CG2 3.52Å; L497-T640 HydrophobicContact CG-CG2 4.48Å; L497-F665 HydrophobicContact CB-CE1 4.25Å; L497-F665 HydrophobicContact CD2-CD1 3.48Å; L497-F665 VanDerWaalsContact CD2-CD1 3.48Å; L497-F665 HydrophobicContact CD2-CE1 3.48Å; L497-F665 VanDerWaalsContact CD2-CE1 3.48Å; L497-F665 HydrophobicContact CD2-CG 4.34Å; L497-F665 HydrophobicContact CD2-CZ 4.28Å; L497-F665 HydrophobicContact CG-CE1 4.36Å
498	L	87.6	Confident	90.3	Very high	61 Å²	61	39 Å²	39	32%	0.319	22%	0.216	S	C	.	.	H	α-helix	trans	-71.7	-32	-179.9	-69.3	173.9	0	0	0	112.3	V494 A495 H496 C500 R628 Q669	V494-L498 HydrophobicContact CG1-CD1 4.15Å; V494-L498 WeakPolarHBondContact O-CB 3.48Å; V494-L498 VanDerWaalsContact O-CG 3.25Å; V494-L498 WeakPolarHBondContact O-CG 3.38Å; V494-L498 PolarHBondContact O-N 3.47Å; A495-L498 PolarHBondContact O-N 2.98Å; A495-L498 VanDerWaalsContact O-N 3.12Å; H496-L498 VanDerWaalsContact C-N 3.32Å; H496-L498 PolarHBondContact O-N 2.77Å; L498-C500 VanDerWaalsContact C-N 3.32Å; L498-R628 PolarHBondContact O-NH1 2.89Å; L498-Q669 HydrophobicContact CD1-CG 4.36Å
499	D	87.5	Confident	89.8	Confident	33 Å²	33	36.7 Å²	36.7	18%	0.176	21%	0.208	C	C	.	.	H	α-helix	trans	-69.8	-29.1	174.4	-69.4	-15.6	0	0	0	112.1	T479 S480 L481 R484 A495 H496 I501	T479-D499 CarbonylContact C-O 3.42Å; T479-D499 WeakPolarHBondContact CA-O 3.13Å; T479-D499 WeakPolarHBondContact CB-O 3.19Å; T479-D499 HydrophobicContact CG2-CB 4.21Å; S480-D499 PolarHBondContact N-O 3.15Å; S480-D499 PolarHBondContact OG-O 2.77Å; L481-D499 WeakPolarHBondContact CD1-OD2 3.42Å; R484-D499 IonicContact NH2-OD2 2.78Å; R484-D499 PolarHBondContact NH2-OD2 3.28Å; A495-D499 VanDerWaalsContact O-CG 3.24Å; A495-D499 PolarHBondContact O-N 2.8Å; H496-D499 PolarHBondContact O-N 2.83Å; D499-I501 PolarHBondContact O-N 2.81Å
500	C	91.5	Very high	88.6	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-61.8	133.6	177.6	-68.1	0	0	0	0	111.5	Y478 H496 L497 L498 R628 T640	Y478-C500 WeakPolarHBondContact O-CA 3.39Å; H496-C500 PolarHBondContact O-N 3.08Å; H496-C500 PolarHBondContact O-SG 2.93Å; L497-C500 WeakPolarHBondContact O-CB 3.49Å; L497-C500 PolarHBondContact O-N 2.75Å; L498-C500 VanDerWaalsContact C-N 3.32Å; C500-R628 PolarHBondContact O-NH1 2.62Å; C500-T640 HydrophobicContact CB-CG2 3.9Å
501	I	92	Very high	86.8	Confident	100 Å²	100	42 Å²	42	51%	0.513	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-73.7	122.5	175.2	-58	178.3	0	0	0	108.2	Y478 D499	Y478-I501 PolarHBondContact O-N 2.81Å; D499-I501 PolarHBondContact O-N 2.81Å
502	P	94.3	Very high	84.5	Confident	24 Å²	24	51 Å²	51	16%	0.156	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-79.6	155.1	179	36.7	-39.4	0	0	0	111.2	Y638 L639	P502-Y638 HydrophobicContact CG-CD1 3.95Å; P502-Y638 HydrophobicContact CG-CG 4.43Å; P502-L639 CarbonylContact C-O 3.51Å; P502-L639 VanDerWaalsContact CA-O 3.29Å; P502-L639 WeakPolarHBondContact CA-O 3.16Å; P502-L639 WeakPolarHBondContact CB-O 3.18Å
503	Y	94.8	Very high	81.6	Confident	75 Å²	75	56.6 Å²	56.6	29%	0.294	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.7	164.7	-64.4	-86.1	0	0	0	110	Y638 L639 T641 L648	Y503-Y638 CarbonylContact O-C 3.53Å; Y503-Y638 WeakPolarHBondContact O-CA 3.22Å; Y503-L639 PolarHBondContact N-O 3.27Å; Y503-L639 PolarHBondContact O-N 3.01Å; Y503-T641 HydrophobicContact CD2-CG2 4.08Å; Y503-T641 HydrophobicContact CE2-CG2 3.99Å; Y503-L648 HydrophobicContact CD1-CD1 4.48Å; Y503-L648 HydrophobicContact CD2-CD1 4.48Å; Y503-L648 HydrophobicContact CE1-CD1 3.91Å; Y503-L648 HydrophobicContact CE2-CD1 3.9Å
504	Q	93.9	Very high	78.6	Confident	124 Å²	124	65 Å²	65	58%	0.579	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	122.9	170.1	-173.3	-179.4	21.6	0	0	108.9	V636 Y638	Q504-V636 HydrophobicContact CG-CB 4.16Å; Q504-V636 HydrophobicContact CG-CG1 4.3Å; Q504-V636 HydrophobicContact CG-CG2 4.24Å; Q504-Y638 HydrophobicContact CB-CD1 4.34Å; Q504-Y638 HydrophobicContact CB-CE1 4.14Å; Q504-Y638 HydrophobicContact CG-CE1 3.98Å
505	V	93.6	Very high	75.6	Confident	19 Å²	19	73 Å²	73	12%	0.115	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116	-177.3	-178.9	0	0	0	0	109.5	L557 V636 I637 L639	V505-L557 HydrophobicContact CG1-CD1 3.87Å; V505-L557 HydrophobicContact CG1-CG 4.5Å; V505-V636 WeakPolarHBondContact O-CA 3.34Å; V505-I637 HydrophobicContact CB-CD1 4.39Å; V505-I637 HydrophobicContact CB-CG1 3.75Å; V505-I637 HydrophobicContact CG1-CG1 4.29Å; V505-I637 PolarHBondContact N-O 3.49Å; V505-I637 PolarHBondContact O-N 3.29Å; V505-L639 HydrophobicContact CG2-CD1 3.87Å; V505-L639 HydrophobicContact CG2-CG 4.14Å
506	P	91.6	Very high	72.7	Confident	56 Å²	56	77.4 Å²	77.4	36%	0.364	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	129.8	174.4	27.8	-31.1	0	0	0	111.2	V636	P506-V636 HydrophobicContact CB-CG1 4.48Å
507	V	89.9	Confident	69.6	Low	2 Å²	2	83.1 Å²	83.1	1%	0.012	45%	0.446	C	S	.	.			trans	-88.7	-44.6	178.9	178.1	0	0	0	0	110.8	F559 V579 L582 L583 Y610 G635 I637	V507-F559 HydrophobicContact CB-CE2 4.29Å; V507-F559 HydrophobicContact CB-CZ 4.26Å; V507-F559 HydrophobicContact CG1-CD2 4.31Å; V507-F559 HydrophobicContact CG1-CE2 3.83Å; V507-F559 HydrophobicContact CG1-CZ 4.12Å; V507-F559 HydrophobicContact CG2-CE1 4.41Å; V507-F559 HydrophobicContact CG2-CE2 4.36Å; V507-F559 HydrophobicContact CG2-CZ 3.84Å; V507-V579 HydrophobicContact CG1-CG1 4.46Å; V507-L582 HydrophobicContact CG1-CD2 3.63Å; V507-L583 HydrophobicContact CG2-CD2 3.84Å; V507-Y610 HydrophobicContact CG1-CG 4.15Å; V507-Y610 WeakPolarHBondContact O-CB 3.36Å; V507-G635 WeakPolarHBondContact CB-O 3.5Å; V507-G635 PolarHBondContact N-O 3.04Å; V507-I637 HydrophobicContact CG2-CG1 4.31Å; V507-I637 HydrophobicContact CG2-CG2 3.78Å
508	T	79.4	Confident	66.5	Low	47 Å²	47	91.7 Å²	91.7	29%	0.288	49%	0.486	S	S	.	.	S	Bend	trans	-79.8	143.2	-178.7	47.7	0	0	0	0	111.6	H556 V579 M609	T508-H556 PolarHBondContact O-CE1 3.21Å; T508-V579 HydrophobicContact CG2-CB 4.43Å; T508-V579 HydrophobicContact CG2-CG1 4.09Å; T508-V579 HydrophobicContact CG2-CG2 3.52Å; T508-M609 HydrophobicContact CG2-CB 4.36Å
509	V	71.9	Confident	63.5	Low	40 Å²	40	96.9 Å²	96.9	24%	0.242	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-87.9	129.4	168.9	-173.4	0	0	0	0	107.5	S511 H556 P604 M609	V509-S511 PolarHBondContact O-N 3.35Å; V509-H556 HydrophobicContact CG2-CB 4.13Å; V509-P604 HydrophobicContact CB-CG 4Å; V509-P604 HydrophobicContact CG2-CG 3.54Å; V509-M609 PolarHBondContact N-O 3.48Å; V509-M609 VanDerWaalsContact N-O 3.17Å
510	P	63.4	Low	60.7	Low	98 Å²	98	101.2 Å²	101.2	64%	0.636	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-54.4	125.3	174.7	-22.4	31.1	0	0	0	109.9	K512 H556	P510-K512 PolarHBondContact O-N 3.12Å; P510-H556 WeakPolarHBondContact CD-NE2 3.3Å
511	S	52	Low	57.5	Low	88 Å²	88	108.5 Å²	108.5	62%	0.615	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-59.5	127.6	177.9	-29	0	0	0	0	108.5	V509 Q513	V509-S511 PolarHBondContact O-N 3.35Å; S511-Q513 PolarHBondContact O-N 3.44Å
512	K	43.1	Very low	54.3	Low	213 Å²	213	113.2 Å²	113.2	93%	0.926	60%	0.6	S	S	*	*			trans	-68.6	71.4	166.3	-71	-177.3	179.9	173.8	0	108.8	P510	P510-K512 PolarHBondContact O-N 3.12Å
513	Q	32.4	Very low	51	Low	167 Å²	167	120.8 Å²	120.8	78%	0.78	63%	0.634	S	S	*	*			trans	-76.9	136.2	162.8	-83.7	-174.4	-16.2	0	0	108.6	S511 N515	S511-Q513 PolarHBondContact O-N 3.44Å; Q513-N515 PolarHBondContact O-N 2.97Å; Q513-N515 VanDerWaalsContact O-N 3.15Å
514	Q	30.4	Very low	47.7	Very low	177 Å²	177	126.9 Å²	126.9	83%	0.827	66%	0.662	S	S	*	*			trans	-47.6	113.7	-177.7	-70.3	163.7	-30.2	0	0	111.1	T516	Q514-T516 PolarHBondContact O-N 2.83Å
515	N	28.2	Very low	44.4	Very low	167 Å²	167	128.3 Å²	128.3	89%	0.893	67%	0.673	S	S	*	*			trans	-71	81.6	158.4	-83.1	-12.4	0	0	0	108.3	Q513 C517	Q513-N515 PolarHBondContact O-N 2.97Å; Q513-N515 VanDerWaalsContact O-N 3.15Å; N515-C517 PolarHBondContact O-N 2.81Å
516	T	26.6	Very low	41.2	Very low	123 Å²	123	134.3 Å²	134.3	76%	0.755	71%	0.709	S	S	*	*			trans	-69.9	112.6	141.7	38.7	0	0	0	0	106.8	Q514	Q514-T516 PolarHBondContact O-N 2.83Å
517	C	25.7	Very low	38.1	Very low	122 Å²	122	137.8 Å²	137.8	82%	0.824	72%	0.723	S	S	*	*			trans	-0.6	118.7	169.8	-61.2	0	0	0	0	117	N515	N515-C517 PolarHBondContact O-N 2.81Å
518	E	26.1	Very low	35.1	Very low	188 Å²	188	143.7 Å²	143.7	88%	0.879	75%	0.754	S	S	*	*				-161.5	122.4	128.8	-108.8	169.9	-158.4	0	0	110.4	V520	E518-V520 PolarHBondContact O-N 3.32Å
519	N	25.3	Very low	32.6	Very low	171 Å²	171	144.6 Å²	144.6	91%	0.914	76%	0.763	S	S	*	*			trans	-68.7	109.8	174.6	-81.9	-32.2	0	0	0	109.7
520	V	28	Very low	30.4	Very low	124 Å²	124	145.8 Å²	145.8	75%	0.752	77%	0.773	S	S	*	*			trans	-142.6	112.1	158.6	-174.5	0	0	0	0	110.5	E518	E518-V520 PolarHBondContact O-N 3.32Å
521	N	25.5	Very low	28.5	Very low	153 Å²	153	146 Å²	146	82%	0.818	78%	0.777	S	S	*	*			trans	32.8	112	157.7	-73.9	-16.8	0	0	0	120.2	Q523	N521-Q523 PolarHBondContact O-N 2.77Å; N521-Q523 VanDerWaalsContact O-N 3.1Å
522	E	25.1	Very low	27.3	Very low	200 Å²	200	148.4 Å²	148.4	94%	0.935	79%	0.787	S	S	*	*			trans	-47.9	106.4	158	-67.6	178	145.6	0	0	112.2
523	Q	24.8	Very low	26.4	Very low	183 Å²	183	143.5 Å²	143.5	86%	0.855	78%	0.78	S	S	*	*			trans	-100.3	112.4	153.2	-87	-176.9	-11.7	0	0	109	N521 N525	N521-Q523 PolarHBondContact O-N 2.77Å; N521-Q523 VanDerWaalsContact O-N 3.1Å; Q523-N525 PolarHBondContact O-N 3.39Å; Q523-N525 VanDerWaalsContact O-N 3.11Å
524	K	24.1	Very low	26.2	Very low	203 Å²	203	144.2 Å²	144.2	88%	0.883	79%	0.785	S	S	*	*			trans	-47.9	108.3	172.8	-71.3	171.6	174	174.9	0	110.7
525	N	26.2	Very low	25.8	Very low	154 Å²	154	140.1 Å²	140.1	82%	0.824	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-78.2	133.4	165.5	-89.7	-28	0	0	0	110.2	Q523 I527	Q523-N525 PolarHBondContact O-N 3.39Å; Q523-N525 VanDerWaalsContact O-N 3.11Å; N525-I527 PolarHBondContact O-N 3.29Å
526	V	25.2	Very low	25.7	Very low	144 Å²	144	139.4 Å²	139.4	87%	0.873	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61	122	-170.3	173.3	0	0	0	0	110.5
527	I	26.3	Very low	25.7	Very low	129 Å²	129	139.9 Å²	139.9	66%	0.662	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71.2	135.5	178.6	-61.8	168.8	0	0	0	108.3	N525 S529	N525-I527 PolarHBondContact O-N 3.29Å; I527-S529 WeakPolarHBondContact CG2-OG 3.47Å; I527-S529 PolarHBondContact O-N 3.39Å
528	L	28.3	Very low	25.6	Very low	126 Å²	126	143 Å²	143	66%	0.66	78%	0.778	S	S	*	*	S	Bend	trans	-59	86.2	154.6	-83.3	155.9	0	0	0	107.8
529	S	25.8	Very low	25.7	Very low	67 Å²	67	142.3 Å²	142.3	47%	0.469	77%	0.774	S	S	.	*			trans	-156.9	104.9	169.5	62.5	0	0	0	0	110.3	I527 S531	I527-S529 WeakPolarHBondContact CG2-OG 3.47Å; I527-S529 PolarHBondContact O-N 3.39Å; S529-S531 PolarHBondContact O-N 2.89Å
530	S	25.6	Very low	25.6	Very low	64 Å²	64	142.4 Å²	142.4	45%	0.448	77%	0.774	S	S	.	*			trans	-79.6	94.3	148.1	63	0	0	0	0	106.3	V532 E645	S530-V532 PolarHBondContact O-N 3.01Å; S530-E645 PolarHBondContact OG-OE1 3.33Å; S530-E645 PolarHBondContact OG-OE2 3.06Å; S530-E645 VanDerWaalsContact OG-OE2 3.08Å
531	S	23.9	Very low	25.6	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	78%	0.776	S	S	*	*			trans	-87.1	102	-178.9	45.7	0	0	0	0	110.5	S529	S529-S531 PolarHBondContact O-N 2.89Å
532	V	26.5	Very low	25.7	Very low	137 Å²	137	142.9 Å²	142.9	83%	0.83	78%	0.777	S	S	*	*			trans	-138.1	116.7	153.4	-178.2	0	0	0	0	108.8	S530	S530-V532 PolarHBondContact O-N 3.01Å
533	S	24.6	Very low	25.7	Very low	111 Å²	111	143 Å²	143	78%	0.776	77%	0.774	S	S	*	*			trans	-65.6	129.5	174.3	51.9	0	0	0	0	112
534	M	27.5	Very low	25.9	Very low	181 Å²	181	141.8 Å²	141.8	89%	0.892	77%	0.772	S	S	*	*			trans	-142.8	135.9	151.5	-82.9	-110.9	95.8	0	0	109
535	S	23.5	Very low	26.1	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	77%	0.765	S	S	*	*			trans	-80.5	156.4	-171.4	45	0	0	0	0	114.1
536	D	24.3	Very low	26.1	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	76%	0.761	S	S	*	*			trans	66.4	101.5	156.2	-56.2	-32	0	0	0	119.6
537	V	28.4	Very low	26.4	Very low	134 Å²	134	135.5 Å²	135.5	81%	0.812	75%	0.751	S	S	*	*			trans	-152.8	121.2	130.1	-179	0	0	0	0	109.9
538	Q	22.9	Very low	26.3	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	76%	0.762	S	S	*	*			trans	-76.9	122.4	166.8	-74.4	176.3	-23.3	0	0	110.2
539	H	28.6	Very low	26.4	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.806	75%	0.752	S	S	*	*			trans	-146.8	128.4	154	-98.7	-55.7	0	0	0	113	T541	H539-T541 PolarHBondContact O-N 2.78Å
540	N	23.6	Very low	26.5	Very low	172 Å²	172	138 Å²	138	92%	0.92	76%	0.764	S	S	*	*			trans	-50.9	113.8	178.8	-79.4	-26	0	0	0	112.6
541	T	27.7	Very low	27	Very low	129 Å²	129	144.5 Å²	144.5	79%	0.791	78%	0.784	S	S	*	*			trans	-104	133.8	168.8	-49.7	0	0	0	0	109.3	H539	H539-T541 PolarHBondContact O-N 2.78Å
542	L	27	Very low	27.7	Very low	159 Å²	159	147 Å²	147	83%	0.832	79%	0.789	S	S	*	*			trans	-48.4	135.8	175.1	-72.2	147.1	0	0	0	111.2	I544	L542-I544 PolarHBondContact O-N 3.49Å
543	K	24.8	Very low	28.7	Very low	202 Å²	202	145.1 Å²	145.1	88%	0.878	78%	0.775	S	S	*	*			trans	-54.1	101.8	175.8	-74.2	178.1	173.7	179.4	0	110.1
544	I	29.3	Very low	30	Very low	157 Å²	157	144.1 Å²	144.1	81%	0.805	77%	0.768	S	S	*	*			trans	-86	113.7	157.5	-65	175.9	0	0	0	105	L542	L542-I544 PolarHBondContact O-N 3.49Å
545	D	28.5	Very low	31.6	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	75%	0.75	S	S	*	*			trans	-55	140.6	179.8	-79.6	-39.3	0	0	0	111.8	L547	D545-L547 PolarHBondContact O-N 2.79Å
546	S	26.5	Very low	34.5	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	73%	0.729	S	S	*	*			trans	-42.9	111.6	-178.2	48.3	0	0	0	0	114.9
547	L	30.5	Very low	37.8	Very low	126 Å²	126	131.8 Å²	131.8	66%	0.66	70%	0.696	S	S	*	*			trans	-113.3	81.5	152.8	-80.3	168.3	0	0	0	108.7	D545 T549	D545-L547 PolarHBondContact O-N 2.79Å; L547-T549 PolarHBondContact O-N 3Å; L547-T549 VanDerWaalsContact O-N 3.09Å
548	N	24.8	Very low	41	Very low	166 Å²	166	125.4 Å²	125.4	89%	0.888	66%	0.658	S	S	*	*			trans	-63.7	102.3	155.2	-96.5	-19.8	0	0	0	107.3
549	T	29.4	Very low	44.4	Very low	75 Å²	75	116.5 Å²	116.5	46%	0.46	62%	0.616	S	S	.	*			trans	-122.6	131	167.9	45.3	0	0	0	0	111.7	L547 R598	L547-T549 PolarHBondContact O-N 3Å; L547-T549 VanDerWaalsContact O-N 3.09Å; T549-R598 PolarHBondContact OG1-NH2 3.35Å
550	N	28.6	Very low	47.5	Very low	132 Å²	132	109.5 Å²	109.5	71%	0.706	58%	0.583	S	S	*	*			trans	-27	127.8	172.6	-65	-34.9	0	0	0	114.4	N552 D553	N550-N552 PolarHBondContact O-N 3.42Å; N550-D553 PolarHBondContact O-N 3.42Å
551	K	37.2	Very low	50.8	Low	202 Å²	202	101.7 Å²	101.7	88%	0.878	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	6.1	-179.2	-81.6	-178.6	172.3	179.2	0	116.3
552	N	38.1	Very low	53.8	Low	156 Å²	156	96.4 Å²	96.4	83%	0.834	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-3.3	-175.6	-77.2	-0.3	0	0	0	115.4	N550	N550-N552 PolarHBondContact O-N 3.42Å
553	D	46.7	Very low	56.4	Low	98 Å²	98	95.3 Å²	95.3	52%	0.524	49%	0.492	S	S	.	.	S	Bend	trans	-103.7	3.3	-177.2	-84.2	-27.4	0	0	0	114.9	N550	N550-D553 PolarHBondContact O-N 3.42Å
554	S	51.6	Low	58.6	Low	90 Å²	90	89 Å²	89	63%	0.629	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.8	-143.1	65.1	0	0	0	0	119.3
555	N	62.8	Low	60.3	Low	96 Å²	96	86.1 Å²	86.1	51%	0.513	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	1.9	-166.3	-69.5	14.1	0	0	0	116.8
556	H	83.8	Confident	61.5	Low	43 Å²	43	81.8 Å²	81.8	20%	0.199	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-90.8	122.3	177.5	-69.2	-71	0	0	0	111.9	T508 V509 P510 R611	T508-H556 PolarHBondContact O-CE1 3.21Å; V509-H556 HydrophobicContact CG2-CB 4.13Å; P510-H556 WeakPolarHBondContact CD-NE2 3.3Å; H556-R611 PolarHBondContact O-NH1 2.81Å
557	L	94.1	Very high	62.7	Low	25 Å²	25	86 Å²	86	13%	0.131	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-82.5	146	178.5	-59.2	179.5	0	0	0	111.2	V505 F559 V651 I654	V505-L557 HydrophobicContact CG1-CD1 3.87Å; V505-L557 HydrophobicContact CG1-CG 4.5Å; L557-F559 HydrophobicContact CB-CZ 4.44Å; L557-F559 WeakPolarHBondContact O-CD2 3.49Å; L557-F559 WeakPolarHBondContact O-CE2 3.41Å; L557-V651 HydrophobicContact CD1-CG1 4.46Å; L557-V651 HydrophobicContact CD2-CG1 4.04Å; L557-V651 WeakPolarHBondContact CD2-O 3.29Å; L557-I654 HydrophobicContact CB-CD1 4.39Å; L557-I654 HydrophobicContact CB-CG1 4.4Å; L557-I654 HydrophobicContact CD1-CD1 3.51Å; L557-I654 HydrophobicContact CD1-CG1 3.8Å
558	A	94.6	Very high	63.5	Low	0 Å²	0	87.5 Å²	87.5	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143.5	171.5	0	0	0	0	0	111.4	I601 R611 I613 T652 G653 I654	A558-I601 HydrophobicContact CB-CB 4.4Å; A558-I601 HydrophobicContact CB-CD1 4.1Å; A558-I601 HydrophobicContact CB-CG1 3.88Å; A558-I601 HydrophobicContact CB-CG2 3.83Å; A558-R611 CarbonylContact C-O 3.35Å; A558-R611 WeakPolarHBondContact CA-O 3.36Å; A558-R611 HydrophobicContact CB-CB 3.93Å; A558-I613 HydrophobicContact CB-CD1 4.07Å; A558-I613 HydrophobicContact CB-CG1 3.76Å; A558-T652 PolarHBondContact N-O 2.87Å; A558-G653 CarbonylContact O-C 3.56Å; A558-G653 WeakPolarHBondContact O-CA 3.48Å; A558-I654 PolarHBondContact O-N 3.01Å
559	F	94.8	Very high	64.5	Low	1 Å²	1	87.6 Å²	87.6	0%	0.004	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.5	-175.9	-62.4	-90.4	0	0	0	112.5	V507 L557 F575 L582 L586 Y610 R611 W612 I613 I637 I654	V507-F559 HydrophobicContact CB-CE2 4.29Å; V507-F559 HydrophobicContact CB-CZ 4.26Å; V507-F559 HydrophobicContact CG1-CD2 4.31Å; V507-F559 HydrophobicContact CG1-CE2 3.83Å; V507-F559 HydrophobicContact CG1-CZ 4.12Å; V507-F559 HydrophobicContact CG2-CE1 4.41Å; V507-F559 HydrophobicContact CG2-CE2 4.36Å; V507-F559 HydrophobicContact CG2-CZ 3.84Å; L557-F559 HydrophobicContact CB-CZ 4.44Å; L557-F559 WeakPolarHBondContact O-CD2 3.49Å; L557-F559 WeakPolarHBondContact O-CE2 3.41Å; F559-F575 HydrophobicContact CB-CZ 4.45Å; F559-F575 VanDerWaalsContact O-CZ 3.3Å; F559-F575 WeakPolarHBondContact O-CZ 3.16Å; F559-L582 HydrophobicContact CB-CD1 4.19Å; F559-L582 HydrophobicContact CB-CD2 4Å; F559-L582 HydrophobicContact CD1-CD2 4.18Å; F559-L582 HydrophobicContact CD2-CD2 4.11Å; F559-L582 HydrophobicContact CG-CD2 3.82Å; F559-L586 HydrophobicContact CD1-CD1 3.94Å; F559-L586 HydrophobicContact CE1-CD1 4.09Å; F559-Y610 HydrophobicContact CB-CD2 4.34Å; F559-Y610 HydrophobicContact CB-CE2 4.18Å; F559-Y610 AromaticContact CD2-CD2 3.92Å; F559-Y610 HydrophobicContact CD2-CD2 3.92Å; F559-Y610 HydrophobicContact CG-CD2 4.48Å; F559-R611 PolarHBondContact N-O 2.98Å; F559-W612 WeakPolarHBondContact O-CA 3.32Å; F559-I613 PolarHBondContact O-N 3.33Å; F559-I613 VanDerWaalsContact O-N 3.12Å; F559-I637 HydrophobicContact CE1-CD1 3.8Å; F559-I637 HydrophobicContact CZ-CD1 4.32Å; F559-I654 WeakPolarHBondContact CA-O 3.4Å; F559-I654 HydrophobicContact CD1-CB 3.95Å; F559-I654 HydrophobicContact CD1-CD1 4.45Å; F559-I654 HydrophobicContact CD1-CG2 4.32Å; F559-I654 HydrophobicContact CE1-CB 4.08Å; F559-I654 HydrophobicContact CE1-CD1 3.7Å; F559-I654 HydrophobicContact CE1-CG1 4.35Å; F559-I654 HydrophobicContact CE1-CG2 4.47Å; F559-I654 HydrophobicContact CZ-CD1 4.28Å
560	R	93.1	Very high	65.1	Low	26 Å²	26	87.9 Å²	87.9	10%	0.098	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	128.4	169	-176.2	67.4	-178.6	178	-3.2	110.8	M562 D565 I613 S614 N616 I654 L655 R656	R560-M562 HydrophobicContact CG-CG 3.97Å; R560-D565 IonicContact NH2-OD1 3.35Å; R560-I613 HydrophobicContact CB-CB 4.11Å; R560-I613 HydrophobicContact CB-CD1 4.08Å; R560-I613 HydrophobicContact CB-CG1 4.47Å; R560-I613 WeakPolarHBondContact CD-O 3.37Å; R560-I613 PolarHBondContact NH1-O 3.08Å; R560-S614 PolarHBondContact NH1-O 3.06Å; R560-N616 PolarHBondContact NE-OD1 3.47Å; R560-N616 VanDerWaalsContact NE-OD1 3.08Å; R560-N616 PolarHBondContact NH2-OD1 3.5Å; R560-I654 PolarHBondContact N-O 3.03Å; R560-L655 HydrophobicContact CB-CD2 3.57Å; R560-L655 HydrophobicContact CG-CD2 4.4Å; R560-L655 WeakPolarHBondContact O-CA 3.39Å; R560-R656 PolarHBondContact O-N 3.46Å
561	I	92.3	Very high	65.4	Low	9 Å²	9	90.5 Å²	90.5	5%	0.046	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	105.9	159	-52.4	-55.6	0	0	0	106.6	R563 P576 L582 C585 L586 R656	I561-R563 PolarHBondContact O-N 3.15Å; I561-P576 HydrophobicContact CG1-CG 4.47Å; I561-L582 HydrophobicContact CD1-CD1 4.07Å; I561-L582 HydrophobicContact CG1-CD1 4.27Å; I561-C585 HydrophobicContact CD1-CB 3.96Å; I561-C585 HydrophobicContact CG1-CB 4.3Å; I561-L586 HydrophobicContact CD1-CD2 3.85Å; I561-R656 HydrophobicContact CD1-CB 3.71Å; I561-R656 HydrophobicContact CD1-CG 4.28Å
562	M	91.7	Very high	65.7	Low	18 Å²	18	88 Å²	88	9%	0.089	46%	0.458	C	S	.	.			trans	-69.6	132.8	-175.5	-58.3	176.5	75.8	0	0	110	F329 V330 F341 R560 N616 L655 R656	F329-M562 HydrophobicContact CD1-SD 3.79Å; F329-M562 HydrophobicContact CE1-SD 3.93Å; V330-M562 VanDerWaalsContact O-CE 3.26Å; V330-M562 WeakPolarHBondContact O-CE 3.26Å; F341-M562 HydrophobicContact CD1-CE 4.26Å; F341-M562 HydrophobicContact CE1-CE 3.4Å; F341-M562 HydrophobicContact CZ-CE 3.85Å; R560-M562 HydrophobicContact CG-CG 3.97Å; M562-N616 HydrophobicContact CE-CB 4.26Å; M562-L655 HydrophobicContact CG-CB 4.3Å; M562-L655 HydrophobicContact SD-CB 3.9Å; M562-L655 HydrophobicContact SD-CD1 4.3Å; M562-R656 WeakPolarHBondContact CB-O 2.88Å; M562-R656 PolarHBondContact N-O 2.92Å
563	R	81.1	Confident	66.1	Low	135 Å²	135	85.7 Å²	85.7	51%	0.509	45%	0.454	S	S	.	.			trans	-140.9	153.2	172.8	-65.5	-173.5	-176.5	159	3.9	108.2	I561 D565 N616	I561-R563 PolarHBondContact O-N 3.15Å; R563-D565 PolarHBondContact O-N 2.94Å; R563-N616 PolarHBondContact O-ND2 2.8Å
564	P	71.6	Confident	66.4	Low	70 Å²	70	84.2 Å²	84.2	46%	0.455	46%	0.455	S	S	.	.			trans	-55.5	131.8	171.4	-24	34.8	0	0	0	110.5	D337 D338 S566	D337-P564 WeakPolarHBondContact O-CB 3.29Å; D337-P564 WeakPolarHBondContact O-CG 3.27Å; D338-P564 HydrophobicContact CB-CB 4.4Å; P564-S566 PolarHBondContact O-N 3.5Å
565	D	65	Low	67	Low	97 Å²	97	81.8 Å²	81.8	52%	0.519	43%	0.434	S	S	.	.			trans	-72.6	79	173.2	-73.5	-24.6	0	0	0	109	D338 R560 R563	D338-D565 PolarHBondContact OD2-N 2.61Å; R560-D565 IonicContact NH2-OD1 3.35Å; R563-D565 PolarHBondContact O-N 2.94Å
566	S	53.6	Low	67.3	Low	45 Å²	45	77.9 Å²	77.9	32%	0.315	41%	0.413	S	S	.	.			trans	-103.5	122.8	-178.5	173.5	0	0	0	0	111.5	P564 L568 F569	P564-S566 PolarHBondContact O-N 3.5Å; S566-L568 PolarHBondContact O-N 3.43Å; S566-L568 WeakPolarHBondContact OG-CB 3.26Å; S566-L568 PolarHBondContact OG-N 3.05Å; S566-F569 PolarHBondContact O-N 3.22Å
567	K	51	Low	66.7	Low	197 Å²	197	79.5 Å²	79.5	86%	0.857	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-65.9	-15.5	171.3	-66.4	-173.2	178.6	-177	0	113.5	F569 A570	K567-F569 PolarHBondContact O-N 3.39Å; K567-A570 WeakPolarHBondContact O-CB 3.48Å; K567-A570 PolarHBondContact O-N 3.2Å
568	L	48.2	Very low	66.2	Low	157 Å²	157	80.3 Å²	80.3	82%	0.822	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-71.2	-18.5	179.3	-75.9	154.3	0	0	0	112.9	S566	S566-L568 PolarHBondContact O-N 3.43Å; S566-L568 WeakPolarHBondContact OG-CB 3.26Å; S566-L568 PolarHBondContact OG-N 3.05Å
569	F	44.8	Very low	65.8	Low	168 Å²	168	81.4 Å²	81.4	74%	0.737	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-115.2	32.4	173.8	-55.8	-72.1	0	0	0	111	S566 K567 E571	S566-F569 PolarHBondContact O-N 3.22Å; K567-F569 PolarHBondContact O-N 3.39Å; F569-E571 PolarHBondContact O-N 2.96Å
570	A	41.8	Very low	65.4	Low	80 Å²	80	85.9 Å²	85.9	66%	0.661	47%	0.468	S	S	*	.			trans	-63.6	-7.8	-178.7	0	0	0	0	0	114.3	K567 D572	K567-A570 WeakPolarHBondContact O-CB 3.48Å; K567-A570 PolarHBondContact O-N 3.2Å; A570-D572 PolarHBondContact O-N 3.38Å
571	E	36.4	Very low	65	Low	187 Å²	187	88.9 Å²	88.9	87%	0.874	49%	0.486	S	S	*	.	S	Bend	trans	-82.5	104.5	170.4	-68.8	-174.5	174.1	0	0	109.5	F569	F569-E571 PolarHBondContact O-N 2.96Å
572	D	43.3	Very low	64.9	Low	150 Å²	150	88.4 Å²	88.4	80%	0.802	48%	0.484	S	S	*	.			trans	48.4	84.9	176.6	-70.6	-26.7	0	0	0	115.2	A570 A574	A570-D572 PolarHBondContact O-N 3.38Å; D572-A574 PolarHBondContact O-N 2.89Å
573	S	45.3	Very low	64.8	Low	107 Å²	107	87.6 Å²	87.6	75%	0.748	48%	0.48	S	S	*	.			trans	-61.9	73.4	152.1	60.2	0	0	0	0	109.3	F575	S573-F575 PolarHBondContact O-N 2.98Å
574	A	52.9	Low	65.1	Low	67 Å²	67	82.2 Å²	82.2	55%	0.554	46%	0.464	S	S	*	.			trans	-68.1	78.9	168.3	0	0	0	0	0	107.1	D572	D572-A574 PolarHBondContact O-N 2.89Å
575	F	65.8	Low	65.9	Low	40 Å²	40	79.7 Å²	79.7	18%	0.175	45%	0.448	C	S	.	.			trans	-48.7	133.6	147.9	-173.7	-101.7	0	0	0	106.3	F559 S573 S577 Y610 W612	F559-F575 HydrophobicContact CB-CZ 4.45Å; F559-F575 VanDerWaalsContact O-CZ 3.3Å; F559-F575 WeakPolarHBondContact O-CZ 3.16Å; S573-F575 PolarHBondContact O-N 2.98Å; F575-S577 PolarHBondContact O-N 3.25Å; F575-Y610 HydrophobicContact CD1-CE2 4.45Å; F575-Y610 WeakPolarHBondContact CD1-OH 3.48Å; F575-Y610 AromaticContact CE1-CE2 3.29Å; F575-Y610 HydrophobicContact CE1-CE2 3.29Å; F575-Y610 AromaticContact CE1-CZ 3.43Å; F575-Y610 VanDerWaalsContact CE1-CZ 3.43Å; F575-Y610 WeakPolarHBondContact CE1-OH 3.43Å; F575-Y610 AromaticContact CZ-CE2 3.66Å; F575-Y610 HydrophobicContact CZ-CE2 3.66Å; F575-W612 HydrophobicContact CD1-CB 4.04Å; F575-W612 HydrophobicContact CD1-CG 4.29Å; F575-W612 HydrophobicContact CE1-CB 3.26Å; F575-W612 AromaticContact CE1-CG 3.96Å; F575-W612 HydrophobicContact CE1-CG 3.96Å; F575-W612 HydrophobicContact CZ-CB 3.62Å
576	P	67.8	Low	67.2	Low	13 Å²	13	75.2 Å²	75.2	8%	0.084	42%	0.424	C	S	.	.			trans	-56.3	102.3	-169	16.8	-28.2	0	0	0	110.6	I561 S578 N581 L582 Y610	I561-P576 HydrophobicContact CG1-CG 4.47Å; P576-S578 PolarHBondContact O-N 3.22Å; P576-N581 HydrophobicContact CB-CB 3.48Å; P576-N581 VanDerWaalsContact CB-CB 3.48Å; P576-L582 HydrophobicContact CB-CB 4.26Å; P576-L582 HydrophobicContact CG-CB 3.96Å; P576-L582 HydrophobicContact CG-CD1 4.1Å; P576-Y610 PolarHBondContact O-OH 3.12Å
577	S	72	Confident	69	Low	78 Å²	78	74.6 Å²	74.6	55%	0.545	42%	0.417	S	S	.	.			trans	-64.3	-32	-173.8	49.6	0	0	0	0	111.2	F575	F575-S577 PolarHBondContact O-N 3.25Å
578	S	83.7	Confident	70.9	Confident	41 Å²	41	65.9 Å²	65.9	29%	0.287	38%	0.382	S	S	.	.	S	Bend	trans	-91.1	146.4	172.4	72.5	0	0	0	0	113	P576 D580 N581 L582	P576-S578 PolarHBondContact O-N 3.22Å; S578-D580 VanDerWaalsContact C-N 3.27Å; S578-D580 PolarHBondContact O-N 3.24Å; S578-N581 PolarHBondContact O-N 2.85Å; S578-N581 WeakPolarHBondContact OG-CB 3.3Å; S578-N581 PolarHBondContact OG-N 3.35Å; S578-N581 PolarHBondContact OG-ND2 3.42Å; S578-L582 PolarHBondContact O-N 2.7Å
579	V	85.7	Confident	73	Confident	24 Å²	24	58.7 Å²	58.7	15%	0.145	34%	0.344	C	S	.	.	H	α-helix	trans	-56.4	-43	171.6	177.3	0	0	0	0	110.5	V507 T508 N581 L582 L583 M609 Y610	V507-V579 HydrophobicContact CG1-CG1 4.46Å; T508-V579 HydrophobicContact CG2-CB 4.43Å; T508-V579 HydrophobicContact CG2-CG1 4.09Å; T508-V579 HydrophobicContact CG2-CG2 3.52Å; V579-N581 VanDerWaalsContact C-N 3.31Å; V579-N581 PolarHBondContact O-N 3.44Å; V579-L582 WeakPolarHBondContact O-CB 3.23Å; V579-L582 PolarHBondContact O-N 3.05Å; V579-L582 VanDerWaalsContact O-N 3.1Å; V579-L583 HydrophobicContact CG1-CD1 3.8Å; V579-L583 HydrophobicContact CG1-CG 4.04Å; V579-L583 VanDerWaalsContact O-CG 3.29Å; V579-L583 WeakPolarHBondContact O-CG 3.36Å; V579-L583 PolarHBondContact O-N 3.1Å; V579-M609 HydrophobicContact CG2-CB 4.28Å; V579-Y610 HydrophobicContact CG2-CD1 3.96Å; V579-Y610 HydrophobicContact CG2-CE1 4.49Å
580	D	85.9	Confident	75.5	Confident	95 Å²	95	50.9 Å²	50.9	51%	0.508	31%	0.31	S	S	.	.	H	α-helix	trans	-57.1	-42.1	179.4	-66.6	-25	0	0	0	113	S578 L583 A584	S578-D580 VanDerWaalsContact C-N 3.27Å; S578-D580 PolarHBondContact O-N 3.24Å; D580-L583 PolarHBondContact O-N 2.72Å; D580-A584 VanDerWaalsContact O-CB 3.3Å; D580-A584 WeakPolarHBondContact O-CB 3.39Å; D580-A584 PolarHBondContact O-N 2.9Å
581	N	85.7	Confident	78.1	Confident	88 Å²	88	47.1 Å²	47.1	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-69.4	-38.5	178.7	-73.2	-18.8	0	0	0	111.2	P576 S578 V579 A584 C585	P576-N581 HydrophobicContact CB-CB 3.48Å; P576-N581 VanDerWaalsContact CB-CB 3.48Å; S578-N581 PolarHBondContact O-N 2.85Å; S578-N581 WeakPolarHBondContact OG-CB 3.3Å; S578-N581 PolarHBondContact OG-N 3.35Å; S578-N581 PolarHBondContact OG-ND2 3.42Å; V579-N581 VanDerWaalsContact C-N 3.31Å; V579-N581 PolarHBondContact O-N 3.44Å; N581-A584 PolarHBondContact O-N 3.48Å; N581-C585 PolarHBondContact O-N 2.76Å; N581-C585 PolarHBondContact O-SG 3.44Å; N581-C585 VanDerWaalsContact O-SG 3.32Å
582	L	89.3	Confident	81.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-51.2	174.2	175.4	67.1	0	0	0	110.3	V507 F559 I561 P576 S578 V579 A584 C585 L586 Y610	V507-L582 HydrophobicContact CG1-CD2 3.63Å; F559-L582 HydrophobicContact CB-CD1 4.19Å; F559-L582 HydrophobicContact CB-CD2 4Å; F559-L582 HydrophobicContact CD1-CD2 4.18Å; F559-L582 HydrophobicContact CD2-CD2 4.11Å; F559-L582 HydrophobicContact CG-CD2 3.82Å; I561-L582 HydrophobicContact CD1-CD1 4.07Å; I561-L582 HydrophobicContact CG1-CD1 4.27Å; P576-L582 HydrophobicContact CB-CB 4.26Å; P576-L582 HydrophobicContact CG-CB 3.96Å; P576-L582 HydrophobicContact CG-CD1 4.1Å; S578-L582 PolarHBondContact O-N 2.7Å; V579-L582 WeakPolarHBondContact O-CB 3.23Å; V579-L582 PolarHBondContact O-N 3.05Å; V579-L582 VanDerWaalsContact O-N 3.1Å; L582-A584 VanDerWaalsContact C-N 3.29Å; L582-A584 PolarHBondContact O-N 3.15Å; L582-C585 WeakPolarHBondContact O-CA 3.12Å; L582-C585 WeakPolarHBondContact O-CB 3.31Å; L582-C585 PolarHBondContact O-N 3.14Å; L582-L586 HydrophobicContact CD1-CD1 3.99Å; L582-L586 HydrophobicContact CD1-CG 4.13Å; L582-L586 HydrophobicContact CD2-CD1 4.34Å; L582-L586 HydrophobicContact CG-CD1 3.88Å; L582-L586 HydrophobicContact CG-CG 4.35Å; L582-L586 WeakPolarHBondContact O-CG 3.34Å; L582-L586 PolarHBondContact O-N 3.44Å; L582-Y610 HydrophobicContact CB-CE1 4.24Å; L582-Y610 HydrophobicContact CD2-CD1 4.27Å; L582-Y610 HydrophobicContact CD2-CD2 3.76Å; L582-Y610 HydrophobicContact CD2-CE1 4Å; L582-Y610 HydrophobicContact CD2-CE2 3.43Å; L582-Y610 VanDerWaalsContact CD2-CE2 3.43Å; L582-Y610 HydrophobicContact CD2-CG 4.16Å; L582-Y610 HydrophobicContact CG-CE2 4.39Å
583	L	89.8	Confident	83.7	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-42.2	179.8	-66.5	178.2	0	0	0	111.3	V507 V579 D580 C585 L586 N587 V630 P632 I637	V507-L583 HydrophobicContact CG2-CD2 3.84Å; V579-L583 HydrophobicContact CG1-CD1 3.8Å; V579-L583 HydrophobicContact CG1-CG 4.04Å; V579-L583 VanDerWaalsContact O-CG 3.29Å; V579-L583 WeakPolarHBondContact O-CG 3.36Å; V579-L583 PolarHBondContact O-N 3.1Å; D580-L583 PolarHBondContact O-N 2.72Å; L583-C585 VanDerWaalsContact C-N 3.3Å; L583-C585 PolarHBondContact O-N 2.88Å; L583-L586 PolarHBondContact O-N 3.44Å; L583-N587 WeakPolarHBondContact O-CB 3.38Å; L583-N587 PolarHBondContact O-N 3.38Å; L583-V630 HydrophobicContact CB-CB 4.09Å; L583-V630 HydrophobicContact CB-CG1 4.33Å; L583-V630 HydrophobicContact CB-CG2 4.16Å; L583-V630 HydrophobicContact CD2-CB 4.18Å; L583-V630 HydrophobicContact CD2-CG1 4.31Å; L583-P632 VanDerWaalsContact CD1-CA 3.43Å; L583-P632 HydrophobicContact CD1-CB 4.01Å; L583-P632 HydrophobicContact CD1-CG 4.17Å; L583-I637 HydrophobicContact CD2-CG2 3.31Å
584	A	87.1	Confident	86.2	Confident	22 Å²	22	26.1 Å²	26.1	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-37.5	174.1	0	0	0	0	0	112.7	D580 N581 L582	D580-A584 VanDerWaalsContact O-CB 3.3Å; D580-A584 WeakPolarHBondContact O-CB 3.39Å; D580-A584 PolarHBondContact O-N 2.9Å; N581-A584 PolarHBondContact O-N 3.48Å; L582-A584 VanDerWaalsContact C-N 3.29Å; L582-A584 PolarHBondContact O-N 3.15Å
585	C	88.4	Confident	88.4	Confident	17 Å²	17	25.6 Å²	25.6	12%	0.115	15%	0.154	C	C	.	.	H	α-helix	trans	-71.9	-27.7	175.7	-72.7	0	0	0	0	113.9	I561 N581 L582 L583 T589	I561-C585 HydrophobicContact CD1-CB 3.96Å; I561-C585 HydrophobicContact CG1-CB 4.3Å; N581-C585 PolarHBondContact O-N 2.76Å; N581-C585 PolarHBondContact O-SG 3.44Å; N581-C585 VanDerWaalsContact O-SG 3.32Å; L582-C585 WeakPolarHBondContact O-CA 3.12Å; L582-C585 WeakPolarHBondContact O-CB 3.31Å; L582-C585 PolarHBondContact O-N 3.14Å; L583-C585 VanDerWaalsContact C-N 3.3Å; L583-C585 PolarHBondContact O-N 2.88Å; C585-T589 WeakPolarHBondContact O-CG2 3.44Å
586	L	92.1	Very high	89.9	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-87.8	-28.5	-178.8	-65.2	177.6	0	0	0	112.6	F559 I561 L582 L583 A588 T589 V591 C627 I637 R656	F559-L586 HydrophobicContact CD1-CD1 3.94Å; F559-L586 HydrophobicContact CE1-CD1 4.09Å; I561-L586 HydrophobicContact CD1-CD2 3.85Å; L582-L586 HydrophobicContact CD1-CD1 3.99Å; L582-L586 HydrophobicContact CD1-CG 4.13Å; L582-L586 HydrophobicContact CD2-CD1 4.34Å; L582-L586 HydrophobicContact CG-CD1 3.88Å; L582-L586 HydrophobicContact CG-CG 4.35Å; L582-L586 WeakPolarHBondContact O-CG 3.34Å; L582-L586 PolarHBondContact O-N 3.44Å; L583-L586 PolarHBondContact O-N 3.44Å; L586-A588 PolarHBondContact O-N 2.89Å; L586-T589 WeakPolarHBondContact O-CB 3.47Å; L586-T589 PolarHBondContact O-N 3.18Å; L586-T589 PolarHBondContact O-OG1 3.18Å; L586-V591 HydrophobicContact CD2-CG1 4.03Å; L586-C627 WeakPolarHBondContact O-CB 3.47Å; L586-C627 PolarHBondContact O-SG 3.08Å; L586-C627 VanDerWaalsContact O-SG 3.35Å; L586-I637 HydrophobicContact CD1-CD1 4.32Å; L586-I637 HydrophobicContact CD1-CG2 4.24Å; L586-R656 HydrophobicContact CD2-CB 3.97Å; L586-R656 HydrophobicContact CD2-CG 4.4Å
587	N	91.1	Very high	91.1	Very high	32 Å²	32	25.3 Å²	25.3	17%	0.171	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	131.4	-172.3	-161.2	3.9	0	0	0	112.9	L583 T589 V630 Y686	L583-N587 WeakPolarHBondContact O-CB 3.38Å; L583-N587 PolarHBondContact O-N 3.38Å; N587-T589 PolarHBondContact O-N 3.26Å; N587-V630 HydrophobicContact CB-CG1 3.86Å; N587-V630 HydrophobicContact CB-CG2 3.98Å; N587-Y686 PolarHBondContact ND2-OH 3.19Å
588	A	91	Very high	92.1	Very high	14 Å²	14	28.1 Å²	28.1	12%	0.116	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	37	-178.7	0	0	0	0	0	114	L586 C627 F666 Y686	L586-A588 PolarHBondContact O-N 2.89Å; A588-C627 VanDerWaalsContact CA-O 3.25Å; A588-C627 WeakPolarHBondContact CA-O 3.5Å; A588-C627 PolarHBondContact N-O 2.82Å; A588-F666 HydrophobicContact CB-CE1 4.12Å; A588-Y686 HydrophobicContact CB-CD2 3.93Å; A588-Y686 HydrophobicContact CB-CE1 4.47Å; A588-Y686 HydrophobicContact CB-CE2 3.5Å
589	T	93.5	Very high	92.6	Very high	7 Å²	7	34.1 Å²	34.1	4%	0.043	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	162	177.2	68.4	0	0	0	0	113.1	C585 L586 N587 C627 L700	C585-T589 WeakPolarHBondContact O-CG2 3.44Å; L586-T589 WeakPolarHBondContact O-CB 3.47Å; L586-T589 PolarHBondContact O-N 3.18Å; L586-T589 PolarHBondContact O-OG1 3.18Å; N587-T589 PolarHBondContact O-N 3.26Å; T589-C627 PolarHBondContact O-N 3.14Å; T589-L700 HydrophobicContact CG2-CD2 4.42Å
590	L	96.5	Very high	92.9	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	134.7	166.2	-174.7	76.1	0	0	0	109.4	M466 F470 L624 V659 L661	M466-L590 HydrophobicContact CE-CD1 4.43Å; M466-L590 HydrophobicContact CE-CD2 3.52Å; M466-L590 HydrophobicContact SD-CD1 3.97Å; M466-L590 HydrophobicContact SD-CD2 4.15Å; F470-L590 HydrophobicContact CE2-CD1 3.66Å; F470-L590 HydrophobicContact CZ-CD1 3.49Å; F470-L590 VanDerWaalsContact CZ-CD1 3.49Å; L590-L624 HydrophobicContact CD1-CB 4.12Å; L590-L624 HydrophobicContact CD1-CD1 4.21Å; L590-L624 HydrophobicContact CD2-CD1 4.19Å; L590-V659 HydrophobicContact CD2-CB 3.86Å; L590-V659 HydrophobicContact CD2-CG1 3.54Å; L590-L661 HydrophobicContact CB-CD2 3.85Å; L590-L661 HydrophobicContact CB-CG 4.11Å; L590-L661 HydrophobicContact CD1-CD2 3.83Å; L590-L661 HydrophobicContact CG-CD2 4.45Å
591	V	97.6	Very high	93.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.5	172.5	-59.3	0	0	0	0	110.6	L586 L624 A625 L639 I654 L655 R656	L586-V591 HydrophobicContact CD2-CG1 4.03Å; V591-L624 WeakPolarHBondContact O-CA 3.14Å; V591-A625 HydrophobicContact CG2-CB 3.9Å; V591-A625 PolarHBondContact N-O 3.25Å; V591-A625 PolarHBondContact O-N 3.4Å; V591-L639 HydrophobicContact CG2-CD2 4.1Å; V591-I654 HydrophobicContact CB-CG2 3.63Å; V591-I654 HydrophobicContact CG1-CG2 3.94Å; V591-I654 HydrophobicContact CG2-CG2 3.83Å; V591-L655 CarbonylContact C-O 3.53Å; V591-L655 WeakPolarHBondContact CA-O 3.41Å; V591-R656 HydrophobicContact CG1-CB 4.2Å; V591-R656 HydrophobicContact CG1-CG 4.43Å
592	A	98.4	Very high	93.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	139.9	169.8	0	0	0	0	0	110.3	F329 L624 I654 L655	F329-A592 HydrophobicContact CB-CB 3.82Å; F329-A592 HydrophobicContact CD1-CB 3.3Å; F329-A592 HydrophobicContact CD2-CB 3.91Å; F329-A592 HydrophobicContact CE1-CB 3.66Å; F329-A592 HydrophobicContact CE2-CB 4.24Å; F329-A592 HydrophobicContact CG-CB 3.4Å; F329-A592 VanDerWaalsContact CG-CB 3.4Å; F329-A592 HydrophobicContact CZ-CB 4.11Å; A592-L624 HydrophobicContact CB-CD2 3.77Å; A592-I654 WeakPolarHBondContact O-CA 3.42Å; A592-L655 HydrophobicContact CB-CB 4.43Å; A592-L655 PolarHBondContact N-O 3.36Å; A592-L655 PolarHBondContact O-N 3.17Å
593	L	98.4	Very high	93.6	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.2	174.7	-55.1	-178.5	0	0	0	107.6	V622 G623 A625 L639 T641 V643 L648 V651 I654	L593-V622 WeakPolarHBondContact O-CB 3.49Å; L593-V622 PolarHBondContact O-N 2.86Å; L593-G623 PolarHBondContact N-O 2.94Å; L593-G623 PolarHBondContact O-N 3.43Å; L593-A625 HydrophobicContact CD1-CB 4.14Å; L593-A625 HydrophobicContact CD2-CB 4.12Å; L593-A625 HydrophobicContact CG-CB 4.15Å; L593-L639 HydrophobicContact CD2-CD1 4.16Å; L593-T641 HydrophobicContact CD1-CG2 4.07Å; L593-V643 HydrophobicContact CD1-CG2 4.26Å; L593-L648 HydrophobicContact CD1-CD2 3.63Å; L593-V651 HydrophobicContact CB-CG1 3.98Å; L593-V651 HydrophobicContact CB-CG2 3.87Å; L593-I654 HydrophobicContact CD2-CG1 4.09Å
594	C	98.4	Very high	93.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	152.1	-168.1	-67	0	0	0	0	113	V596 E620 T652 G653 L655	C594-V596 HydrophobicContact CB-CG2 4.04Å; C594-V596 PolarHBondContact O-N 2.91Å; C594-E620 VanDerWaalsContact CA-O 3.27Å; C594-E620 WeakPolarHBondContact CA-O 3.45Å; C594-T652 PolarHBondContact O-N 3.3Å; C594-G653 PolarHBondContact N-O 3.39Å; C594-G653 PolarHBondContact O-N 2.99Å; C594-L655 HydrophobicContact CB-CD1 4.14Å; C594-L655 HydrophobicContact CB-CG 4.24Å; C594-L655 WeakPolarHBondContact SG-CD1 3.49Å
595	V	97.8	Very high	93.3	Very high	56 Å²	56	38.6 Å²	38.6	34%	0.339	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	80.3	169.1	-169.3	0	0	0	0	108.6	C619 E620 V622 K650	V595-C619 VanDerWaalsContact O-CB 3.3Å; V595-C619 WeakPolarHBondContact O-CB 3.35Å; V595-E620 HydrophobicContact CB-CB 4.31Å; V595-E620 HydrophobicContact CG2-CB 4.36Å; V595-E620 PolarHBondContact N-O 3.23Å; V595-V622 HydrophobicContact CG2-CG2 3.6Å; V595-K650 HydrophobicContact CG2-CB 4.24Å
596	V	97	Very high	92.9	Very high	4 Å²	4	43 Å²	43	2%	0.024	23%	0.23	C	C	.	.			trans	-73.7	127	180	-176.6	0	0	0	0	110.2	C594 N600 I601 I613 P617 T652 L655	C594-V596 HydrophobicContact CB-CG2 4.04Å; C594-V596 PolarHBondContact O-N 2.91Å; V596-N600 HydrophobicContact CG1-CB 3.92Å; V596-I601 HydrophobicContact CB-CD1 4.35Å; V596-I601 HydrophobicContact CB-CG1 4.39Å; V596-I601 HydrophobicContact CG1-CD1 4.32Å; V596-I601 HydrophobicContact CG1-CG1 3.83Å; V596-I613 HydrophobicContact CB-CD1 4.31Å; V596-I613 HydrophobicContact CG1-CD1 3.83Å; V596-I613 HydrophobicContact CG1-CG1 4.3Å; V596-I613 HydrophobicContact CG2-CD1 3.72Å; V596-P617 HydrophobicContact CG1-CB 4.21Å; V596-P617 HydrophobicContact CG1-CG 4.5Å; V596-P617 HydrophobicContact CG2-CG 4.36Å; V596-T652 WeakPolarHBondContact CA-OG1 3.44Å; V596-T652 PolarHBondContact N-OG1 3.26Å; V596-T652 PolarHBondContact O-OG1 3.18Å; V596-L655 HydrophobicContact CG2-CD2 4.46Å
597	P	94.6	Very high	92.2	Very high	43 Å²	43	47.7 Å²	47.7	28%	0.279	26%	0.258	S	S	.	.			trans	-59.2	138.7	174.8	-24	33.7	0	0	0	111.9	H599 N600	P597-H599 WeakPolarHBondContact CB-CE1 3.41Å; P597-H599 WeakPolarHBondContact CB-ND1 3.44Å; P597-H599 PolarHBondContact O-N 3.35Å; P597-H599 VanDerWaalsContact O-N 3.11Å; P597-N600 WeakPolarHBondContact O-CB 3.48Å; P597-N600 PolarHBondContact O-N 3.06Å
598	R	92.7	Very high	91.7	Very high	138 Å²	138	46.4 Å²	46.4	52%	0.521	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-55.7	-33.5	-176.6	-73.7	-171.9	177.2	151.2	-2.4	114.2	T549 N600 I601	T549-R598 PolarHBondContact OG1-NH2 3.35Å; R598-N600 PolarHBondContact O-N 3.03Å; R598-I601 PolarHBondContact O-N 3Å; R598-I601 VanDerWaalsContact O-N 3.08Å
599	H	92.7	Very high	91.4	Very high	167 Å²	167	50 Å²	50	77%	0.773	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-70.1	-14.4	179.6	65	-90.3	0	0	0	113.8	P597	P597-H599 WeakPolarHBondContact CB-CE1 3.41Å; P597-H599 WeakPolarHBondContact CB-ND1 3.44Å; P597-H599 PolarHBondContact O-N 3.35Å; P597-H599 VanDerWaalsContact O-N 3.11Å
600	N	92.4	Very high	91.2	Very high	30 Å²	30	49.7 Å²	49.7	16%	0.16	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-89.2	-13.6	172	-68.3	66.5	0	0	0	112.7	V596 P597 R598 I613	V596-N600 HydrophobicContact CG1-CB 3.92Å; P597-N600 WeakPolarHBondContact O-CB 3.48Å; P597-N600 PolarHBondContact O-N 3.06Å; R598-N600 PolarHBondContact O-N 3.03Å; N600-I613 HydrophobicContact CB-CG2 4.17Å
601	I	93	Very high	91	Very high	30 Å²	30	51 Å²	51	15%	0.154	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.3	-176.3	-60	176.4	0	0	0	108.6	A558 V596 R598 R611	A558-I601 HydrophobicContact CB-CB 4.4Å; A558-I601 HydrophobicContact CB-CD1 4.1Å; A558-I601 HydrophobicContact CB-CG1 3.88Å; A558-I601 HydrophobicContact CB-CG2 3.83Å; V596-I601 HydrophobicContact CB-CD1 4.35Å; V596-I601 HydrophobicContact CB-CG1 4.39Å; V596-I601 HydrophobicContact CG1-CD1 4.32Å; V596-I601 HydrophobicContact CG1-CG1 3.83Å; R598-I601 PolarHBondContact O-N 3Å; R598-I601 VanDerWaalsContact O-N 3.08Å; I601-R611 HydrophobicContact CG2-CB 4.15Å; I601-R611 HydrophobicContact CG2-CG 4.24Å
602	T	91.6	Very high	90.7	Very high	47 Å²	47	53 Å²	53	29%	0.288	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.2	170.8	-49.9	0	0	0	0	108.7	R611 W612	T602-R611 WeakPolarHBondContact O-CA 3.03Å; T602-W612 HydrophobicContact CG2-CD2 4.28Å; T602-W612 HydrophobicContact CG2-CH2 4.24Å; T602-W612 HydrophobicContact CG2-CZ2 3.56Å; T602-W612 PolarHBondContact N-O 2.63Å; T602-W612 PolarHBondContact O-N 3.22Å; T602-W612 PolarHBondContact OG1-NE1 2.72Å
603	E	90.6	Very high	90.3	Very high	102 Å²	102	53 Å²	53	48%	0.477	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-76.6	152.7	177.2	-67.1	-62.8	159.5	0	0	111.1	R611	E603-R611 IonicContact OE1-CZ 3.84Å; E603-R611 IonicContact OE1-NE 2.91Å; E603-R611 PolarHBondContact OE1-NE 2.83Å; E603-R611 IonicContact OE1-NH2 2.59Å; E603-R611 PolarHBondContact OE1-NH2 3.49Å; E603-R611 IonicContact OE2-CZ 2.63Å; E603-R611 IonicContact OE2-NE 2.98Å; E603-R611 PolarHBondContact OE2-NE 3.44Å; E603-R611 IonicContact OE2-NH2 2.76Å; E603-R611 PolarHBondContact OE2-NH2 2.87Å
604	P	86.8	Confident	89.7	Confident	42 Å²	42	56.4 Å²	56.4	27%	0.273	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-58.5	148.9	179.3	-18.8	28.6	0	0	0	112.9	V509 C608 R611	V509-P604 HydrophobicContact CB-CG 4Å; V509-P604 HydrophobicContact CG2-CG 3.54Å; P604-C608 VanDerWaalsContact CA-O 3.32Å; P604-C608 WeakPolarHBondContact CA-O 3.49Å; P604-C608 WeakPolarHBondContact CB-O 3.45Å; P604-R611 HydrophobicContact CG-CG 4.32Å
605	D	84.3	Confident	89.3	Confident	73 Å²	73	58.6 Å²	58.6	39%	0.39	32%	0.317	S	S	.	.			trans	-135.4	-171.7	174.4	69.4	18.6	0	0	0	111.6	T607 C608	D605-T607 PolarHBondContact O-N 3.37Å; D605-T607 VanDerWaalsContact O-N 3.17Å; D605-T607 WeakPolarHBondContact OD1-CA 3.48Å; D605-T607 WeakPolarHBondContact OD1-CB 3.36Å; D605-T607 PolarHBondContact OD1-N 3.2Å; D605-T607 PolarHBondContact OD1-OG1 3.03Å; D605-T607 PolarHBondContact OD2-OG1 3.2Å; D605-C608 PolarHBondContact N-O 3.3Å; D605-C608 CarbonylContact O-C 3.56Å; D605-C608 PolarHBondContact O-N 2.95Å; D605-C608 PolarHBondContact OD1-N 3.26Å
606	S	79.9	Confident	89.1	Confident	110 Å²	110	56.5 Å²	56.5	77%	0.769	30%	0.304	S	S	*	.	S	Bend	trans	-62.5	-19.6	179.1	52.8	0	0	0	0	114.1
607	T	78.1	Confident	89	Confident	99 Å²	99	56.4 Å²	56.4	61%	0.607	30%	0.303	S	S	*	.	S	Bend	trans	-97.3	-26	-177.1	69.2	0	0	0	0	113	D605	D605-T607 PolarHBondContact O-N 3.37Å; D605-T607 VanDerWaalsContact O-N 3.17Å; D605-T607 WeakPolarHBondContact OD1-CA 3.48Å; D605-T607 WeakPolarHBondContact OD1-CB 3.36Å; D605-T607 PolarHBondContact OD1-N 3.2Å; D605-T607 PolarHBondContact OD1-OG1 3.03Å; D605-T607 PolarHBondContact OD2-OG1 3.2Å
608	C	80.9	Confident	89.1	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.034	30%	0.303	C	S	.	.			trans	-146.8	122.4	179	174.2	0	0	0	0	111.8	P604 D605 Y610 W612	P604-C608 VanDerWaalsContact CA-O 3.32Å; P604-C608 WeakPolarHBondContact CA-O 3.49Å; P604-C608 WeakPolarHBondContact CB-O 3.45Å; D605-C608 PolarHBondContact N-O 3.3Å; D605-C608 CarbonylContact O-C 3.56Å; D605-C608 PolarHBondContact O-N 2.95Å; D605-C608 PolarHBondContact OD1-N 3.26Å; C608-Y610 VanDerWaalsContact C-N 3.32Å; C608-Y610 PolarHBondContact O-N 3.17Å; C608-Y610 VanDerWaalsContact SG-CD1 3.53Å; C608-Y610 WeakPolarHBondContact SG-CE1 3.25Å; C608-Y610 VanDerWaalsContact SG-CZ 3.59Å; C608-W612 HydrophobicContact CB-CE3 3.72Å; C608-W612 HydrophobicContact CB-CH2 3.83Å; C608-W612 HydrophobicContact CB-CZ3 3.18Å; C608-W612 WeakPolarHBondContact SG-CZ3 3.18Å
609	M	84.8	Confident	89.3	Confident	90 Å²	90	50 Å²	50	44%	0.443	28%	0.279	S	S	.	.	S	Bend	trans	-90	13	-164.2	-64.4	-71.2	169.4	0	0	114.3	T508 V509 V579	T508-M609 HydrophobicContact CG2-CB 4.36Å; V509-M609 PolarHBondContact N-O 3.48Å; V509-M609 VanDerWaalsContact N-O 3.17Å; V579-M609 HydrophobicContact CG2-CB 4.28Å
610	Y	88.9	Confident	89.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-140.9	158.7	-177.4	63.8	-92.7	0	0	0	110.3	V507 F559 F575 P576 V579 L582 C608 W612	V507-Y610 HydrophobicContact CG1-CG 4.15Å; V507-Y610 WeakPolarHBondContact O-CB 3.36Å; F559-Y610 HydrophobicContact CB-CD2 4.34Å; F559-Y610 HydrophobicContact CB-CE2 4.18Å; F559-Y610 AromaticContact CD2-CD2 3.92Å; F559-Y610 HydrophobicContact CD2-CD2 3.92Å; F559-Y610 HydrophobicContact CG-CD2 4.48Å; F575-Y610 HydrophobicContact CD1-CE2 4.45Å; F575-Y610 WeakPolarHBondContact CD1-OH 3.48Å; F575-Y610 AromaticContact CE1-CE2 3.29Å; F575-Y610 HydrophobicContact CE1-CE2 3.29Å; F575-Y610 AromaticContact CE1-CZ 3.43Å; F575-Y610 VanDerWaalsContact CE1-CZ 3.43Å; F575-Y610 WeakPolarHBondContact CE1-OH 3.43Å; F575-Y610 AromaticContact CZ-CE2 3.66Å; F575-Y610 HydrophobicContact CZ-CE2 3.66Å; P576-Y610 PolarHBondContact O-OH 3.12Å; V579-Y610 HydrophobicContact CG2-CD1 3.96Å; V579-Y610 HydrophobicContact CG2-CE1 4.49Å; L582-Y610 HydrophobicContact CB-CE1 4.24Å; L582-Y610 HydrophobicContact CD2-CD1 4.27Å; L582-Y610 HydrophobicContact CD2-CD2 3.76Å; L582-Y610 HydrophobicContact CD2-CE1 4Å; L582-Y610 HydrophobicContact CD2-CE2 3.43Å; L582-Y610 VanDerWaalsContact CD2-CE2 3.43Å; L582-Y610 HydrophobicContact CD2-CG 4.16Å; L582-Y610 HydrophobicContact CG-CE2 4.39Å; C608-Y610 VanDerWaalsContact C-N 3.32Å; C608-Y610 PolarHBondContact O-N 3.17Å; C608-Y610 VanDerWaalsContact SG-CD1 3.53Å; C608-Y610 WeakPolarHBondContact SG-CE1 3.25Å; C608-Y610 VanDerWaalsContact SG-CZ 3.59Å; Y610-W612 HydrophobicContact CE2-CB 4.25Å; Y610-W612 VanDerWaalsContact O-CE3 3.24Å
611	R	91.8	Very high	89.9	Confident	32 Å²	32	43 Å²	43	12%	0.121	25%	0.246	C	C	.	.			trans	-70.9	133	177.9	-75.1	176	173.8	160.7	0.4	110.2	H556 A558 F559 I601 T602 E603 P604	H556-R611 PolarHBondContact O-NH1 2.81Å; A558-R611 CarbonylContact C-O 3.35Å; A558-R611 WeakPolarHBondContact CA-O 3.36Å; A558-R611 HydrophobicContact CB-CB 3.93Å; F559-R611 PolarHBondContact N-O 2.98Å; I601-R611 HydrophobicContact CG2-CB 4.15Å; I601-R611 HydrophobicContact CG2-CG 4.24Å; T602-R611 WeakPolarHBondContact O-CA 3.03Å; E603-R611 IonicContact OE1-CZ 3.84Å; E603-R611 IonicContact OE1-NE 2.91Å; E603-R611 PolarHBondContact OE1-NE 2.83Å; E603-R611 IonicContact OE1-NH2 2.59Å; E603-R611 PolarHBondContact OE1-NH2 3.49Å; E603-R611 IonicContact OE2-CZ 2.63Å; E603-R611 IonicContact OE2-NE 2.98Å; E603-R611 PolarHBondContact OE2-NE 3.44Å; E603-R611 IonicContact OE2-NH2 2.76Å; E603-R611 PolarHBondContact OE2-NH2 2.87Å; P604-R611 HydrophobicContact CG-CG 4.32Å
612	W	91.1	Very high	90.1	Very high	41 Å²	41	43 Å²	43	16%	0.155	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	166	177.9	71.9	75.6	0	0	0	113.3	F559 F575 T602 C608 Y610	F559-W612 WeakPolarHBondContact O-CA 3.32Å; F575-W612 HydrophobicContact CD1-CB 4.04Å; F575-W612 HydrophobicContact CD1-CG 4.29Å; F575-W612 HydrophobicContact CE1-CB 3.26Å; F575-W612 AromaticContact CE1-CG 3.96Å; F575-W612 HydrophobicContact CE1-CG 3.96Å; F575-W612 HydrophobicContact CZ-CB 3.62Å; T602-W612 HydrophobicContact CG2-CD2 4.28Å; T602-W612 HydrophobicContact CG2-CH2 4.24Å; T602-W612 HydrophobicContact CG2-CZ2 3.56Å; T602-W612 PolarHBondContact N-O 2.63Å; T602-W612 PolarHBondContact O-N 3.22Å; T602-W612 PolarHBondContact OG1-NE1 2.72Å; C608-W612 HydrophobicContact CB-CE3 3.72Å; C608-W612 HydrophobicContact CB-CH2 3.83Å; C608-W612 HydrophobicContact CB-CZ3 3.18Å; C608-W612 WeakPolarHBondContact SG-CZ3 3.18Å; Y610-W612 HydrophobicContact CE2-CB 4.25Å; Y610-W612 VanDerWaalsContact O-CE3 3.24Å
613	I	91.5	Very high	90.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.7	179.3	-47.7	169.6	0	0	0	107.8	A558 F559 R560 V596 N600 S615 P617 L655	A558-I613 HydrophobicContact CB-CD1 4.07Å; A558-I613 HydrophobicContact CB-CG1 3.76Å; F559-I613 PolarHBondContact O-N 3.33Å; F559-I613 VanDerWaalsContact O-N 3.12Å; R560-I613 HydrophobicContact CB-CB 4.11Å; R560-I613 HydrophobicContact CB-CD1 4.08Å; R560-I613 HydrophobicContact CB-CG1 4.47Å; R560-I613 WeakPolarHBondContact CD-O 3.37Å; R560-I613 PolarHBondContact NH1-O 3.08Å; V596-I613 HydrophobicContact CB-CD1 4.31Å; V596-I613 HydrophobicContact CG1-CD1 3.83Å; V596-I613 HydrophobicContact CG1-CG1 4.3Å; V596-I613 HydrophobicContact CG2-CD1 3.72Å; N600-I613 HydrophobicContact CB-CG2 4.17Å; I613-S615 VanDerWaalsContact CG2-O 3.22Å; I613-S615 WeakPolarHBondContact CG2-O 3.13Å; I613-P617 HydrophobicContact CD1-CG 4.29Å; I613-P617 HydrophobicContact CG2-CB 4.22Å; I613-P617 HydrophobicContact CG2-CG 4.11Å; I613-L655 HydrophobicContact CD1-CD2 3.61Å
614	S	85.5	Confident	90.8	Very high	76 Å²	76	36.1 Å²	36.1	53%	0.531	21%	0.212	S	C	.	.	S	Bend	trans	-74.3	-31.2	-169.3	56.5	0	0	0	0	114	R560	R560-S614 PolarHBondContact NH1-O 3.06Å
615	S	89.5	Confident	91.3	Very high	46 Å²	46	34.1 Å²	34.1	32%	0.322	20%	0.199	S	C	.	.	S	Bend	trans	-132.5	166.1	176	60.7	0	0	0	0	111	I613 P617	I613-S615 VanDerWaalsContact CG2-O 3.22Å; I613-S615 WeakPolarHBondContact CG2-O 3.13Å; S615-P617 VanDerWaalsContact O-CD 3.26Å; S615-P617 WeakPolarHBondContact O-CD 3.41Å; S615-P617 VanDerWaalsContact O-N 3.17Å
616	N	92.9	Very high	91.9	Very high	12 Å²	12	31 Å²	31	6%	0.064	18%	0.182	C	C	.	.			trans	-63.7	117.4	177.1	-63	-22.3	0	0	0	109.2	F341 R560 M562 R563	F341-N616 HydrophobicContact CD1-CB 4.4Å; F341-N616 HydrophobicContact CD2-CB 3.78Å; F341-N616 HydrophobicContact CE1-CB 4.23Å; F341-N616 HydrophobicContact CE2-CB 3.6Å; F341-N616 VanDerWaalsContact CE2-O 3.27Å; F341-N616 WeakPolarHBondContact CE2-O 3.47Å; F341-N616 HydrophobicContact CG-CB 4.19Å; F341-N616 HydrophobicContact CZ-CB 3.84Å; R560-N616 PolarHBondContact NE-OD1 3.47Å; R560-N616 VanDerWaalsContact NE-OD1 3.08Å; R560-N616 PolarHBondContact NH2-OD1 3.5Å; M562-N616 HydrophobicContact CE-CB 4.26Å; R563-N616 PolarHBondContact O-ND2 2.8Å
617	P	94.9	Very high	92.6	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	15%	0.146	C	C	.	.			trans	-82	138.4	-175	33.5	-34.3	0	0	0	110.8	F341 V596 I613 S615 L655	F341-P617 VanDerWaalsContact CZ-O 3.29Å; F341-P617 WeakPolarHBondContact CZ-O 3.47Å; V596-P617 HydrophobicContact CG1-CB 4.21Å; V596-P617 HydrophobicContact CG1-CG 4.5Å; V596-P617 HydrophobicContact CG2-CG 4.36Å; I613-P617 HydrophobicContact CD1-CG 4.29Å; I613-P617 HydrophobicContact CG2-CB 4.22Å; I613-P617 HydrophobicContact CG2-CG 4.11Å; S615-P617 VanDerWaalsContact O-CD 3.26Å; S615-P617 WeakPolarHBondContact O-CD 3.41Å; S615-P617 VanDerWaalsContact O-N 3.17Å; P617-L655 HydrophobicContact CG-CD1 3.86Å; P617-L655 HydrophobicContact CG-CD2 3.78Å
618	V	97.4	Very high	93.2	Very high	44 Å²	44	25 Å²	25	27%	0.267	13%	0.132	S	C	.	.			trans	-91.4	105.8	169.8	-178	0	0	0	0	107.2	F341 K344 F348	F341-V618 HydrophobicContact CD2-CG2 4.11Å; F341-V618 HydrophobicContact CE2-CG2 3.65Å; K344-V618 HydrophobicContact CB-CG2 3.66Å; K344-V618 HydrophobicContact CD-CG2 4.27Å; F348-V618 HydrophobicContact CB-CG1 3.37Å; F348-V618 HydrophobicContact CD1-CG1 4.22Å; F348-V618 HydrophobicContact CD2-CG1 4.2Å; F348-V618 HydrophobicContact CG-CG1 3.68Å
619	C	97.8	Very high	93.7	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.027	15%	0.145	C	C	.	.			trans	-157.8	166.6	-171	59.4	0	0	0	0	112.9	C328 V595 C621	C328-C619 PolarHBondContact SG-O 2.66Å; C328-C619 VanDerWaalsContact SG-O 3.42Å; V595-C619 VanDerWaalsContact O-CB 3.3Å; V595-C619 WeakPolarHBondContact O-CB 3.35Å; C619-C621 PolarHBondContact O-N 2.82Å
620	E	98.4	Very high	94	Very high	49 Å²	49	23.5 Å²	23.5	23%	0.229	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	127.1	176.5	-168.2	64.2	-141.5	0	0	110.7	R326 Q327 F348 C594 V595	R326-E620 WeakPolarHBondContact CG-OE2 3.44Å; R326-E620 IonicContact NE-OE2 2.93Å; Q327-E620 PolarHBondContact N-OE1 3.28Å; F348-E620 HydrophobicContact CZ-CB 4.49Å; C594-E620 VanDerWaalsContact CA-O 3.27Å; C594-E620 WeakPolarHBondContact CA-O 3.45Å; V595-E620 HydrophobicContact CB-CB 4.31Å; V595-E620 HydrophobicContact CG2-CB 4.36Å; V595-E620 PolarHBondContact N-O 3.23Å
621	C	98.5	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.1	166.9	179.2	0	0	0	0	108.3	Q327 F329 C619	Q327-C621 HydrophobicContact CG-CB 4.13Å; Q327-C621 WeakPolarHBondContact CG-O 3.3Å; Q327-C621 PolarHBondContact NE2-O 3.15Å; Q327-C621 PolarHBondContact O-N 3.41Å; F329-C621 HydrophobicContact CB-CB 4.01Å; C619-C621 PolarHBondContact O-N 2.82Å
622	V	97.8	Very high	93.7	Very high	30 Å²	30	27.4 Å²	27.4	18%	0.182	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-38.5	178.2	-177	0	0	0	0	110.3	L593 V595 V643 D647 V651	L593-V622 WeakPolarHBondContact O-CB 3.49Å; L593-V622 PolarHBondContact O-N 2.86Å; V595-V622 HydrophobicContact CG2-CG2 3.6Å; V622-V643 HydrophobicContact CG1-CG1 3.68Å; V622-D647 HydrophobicContact CG1-CB 3.68Å; V622-V651 HydrophobicContact CB-CG2 4.16Å; V622-V651 HydrophobicContact CG1-CG2 4.37Å; V622-V651 HydrophobicContact CG2-CG2 3.99Å
623	G	97.3	Very high	93.5	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	-170.7	178.6	0	0	0	0	0	111.6	L593	L593-G623 PolarHBondContact N-O 2.94Å; L593-G623 PolarHBondContact O-N 3.43Å
624	L	98	Very high	93.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	152.8	179.5	-54.2	-179.6	0	0	0	112.2	P296 I299 F329 M466 Y469 F470 L590 V591 A592 T641	P296-L624 HydrophobicContact CB-CD1 3.48Å; P296-L624 VanDerWaalsContact CB-CD1 3.48Å; P296-L624 HydrophobicContact CG-CD1 3.69Å; I299-L624 HydrophobicContact CD1-CD1 4.38Å; I299-L624 HydrophobicContact CD1-CD2 4.35Å; I299-L624 HydrophobicContact CD1-CG 4.43Å; F329-L624 HydrophobicContact CD2-CD2 4.12Å; F329-L624 HydrophobicContact CE2-CD2 4.02Å; M466-L624 HydrophobicContact CE-CD1 4.18Å; M466-L624 HydrophobicContact SD-CD1 3.9Å; Y469-L624 HydrophobicContact CE1-CB 3.73Å; Y469-L624 HydrophobicContact CE1-CG 4.4Å; Y469-L624 PolarHBondContact OH-N 3.22Å; Y469-L624 PolarHBondContact OH-O 3.4Å; F470-L624 HydrophobicContact CZ-CB 4.21Å; L590-L624 HydrophobicContact CD1-CB 4.12Å; L590-L624 HydrophobicContact CD1-CD1 4.21Å; L590-L624 HydrophobicContact CD2-CD1 4.19Å; V591-L624 WeakPolarHBondContact O-CA 3.14Å; A592-L624 HydrophobicContact CB-CD2 3.77Å; L624-T641 PolarHBondContact O-OG1 3.08Å
625	A	97.9	Very high	93.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	157.1	174	0	0	0	0	0	111.1	V591 L593 L639 T640 T641	V591-A625 HydrophobicContact CG2-CB 3.9Å; V591-A625 PolarHBondContact N-O 3.25Å; V591-A625 PolarHBondContact O-N 3.4Å; L593-A625 HydrophobicContact CD1-CB 4.14Å; L593-A625 HydrophobicContact CD2-CB 4.12Å; L593-A625 HydrophobicContact CG-CB 4.15Å; A625-L639 HydrophobicContact CB-CB 4.36Å; A625-T640 WeakPolarHBondContact CA-O 3.17Å; A625-T641 HydrophobicContact CB-CG2 4.39Å
626	I	97	Very high	93.5	Very high	7 Å²	7	29.7 Å²	29.7	4%	0.036	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.6	168.7	-58.2	-174.1	0	0	0	107.8	F470 L497 R628 L639 T640 L661 F665	F470-I626 HydrophobicContact CD1-CD1 4.32Å; F470-I626 HydrophobicContact CD1-CG1 4.3Å; F470-I626 HydrophobicContact CD2-CD1 4.07Å; F470-I626 HydrophobicContact CD2-CG1 4.44Å; F470-I626 HydrophobicContact CE1-CD1 4.17Å; F470-I626 HydrophobicContact CE1-CG1 3.68Å; F470-I626 HydrophobicContact CE2-CD1 3.89Å; F470-I626 HydrophobicContact CE2-CG1 3.83Å; F470-I626 HydrophobicContact CG-CD1 4.29Å; F470-I626 HydrophobicContact CZ-CD1 3.95Å; F470-I626 HydrophobicContact CZ-CG1 3.41Å; F470-I626 VanDerWaalsContact CZ-CG1 3.41Å; L497-I626 HydrophobicContact CD1-CD1 3.87Å; L497-I626 HydrophobicContact CD2-CD1 3.6Å; L497-I626 HydrophobicContact CG-CD1 4.4Å; I626-R628 PolarHBondContact O-N 3.34Å; I626-R628 VanDerWaalsContact O-N 3.07Å; I626-L639 CarbonylContact O-C 3.57Å; I626-L639 WeakPolarHBondContact O-CA 3.13Å; I626-T640 PolarHBondContact N-O 3.41Å; I626-T640 PolarHBondContact O-N 2.76Å; I626-L661 HydrophobicContact CD1-CD2 3.86Å; I626-L661 HydrophobicContact CG1-CD2 3.83Å; I626-L661 HydrophobicContact CG2-CD1 3.96Å; I626-F665 HydrophobicContact CD1-CD2 4.43Å; I626-F665 HydrophobicContact CD1-CE1 4.49Å; I626-F665 HydrophobicContact CD1-CE2 4.07Å; I626-F665 HydrophobicContact CD1-CZ 4.1Å
627	C	95.6	Very high	93.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	94.5	166.4	-175.8	0	0	0	0	108.2	L586 A588 T589 Y638 L639	L586-C627 WeakPolarHBondContact O-CB 3.47Å; L586-C627 PolarHBondContact O-SG 3.08Å; L586-C627 VanDerWaalsContact O-SG 3.35Å; A588-C627 VanDerWaalsContact CA-O 3.25Å; A588-C627 WeakPolarHBondContact CA-O 3.5Å; A588-C627 PolarHBondContact N-O 2.82Å; T589-C627 PolarHBondContact O-N 3.14Å; C627-Y638 CarbonylContact C-O 3.44Å; C627-L639 HydrophobicContact CB-CD2 3.96Å
628	R	90.5	Very high	93.6	Very high	84 Å²	84	32.1 Å²	32.1	32%	0.317	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-36.4	-169.9	-170.5	176.6	73.4	144.5	12.9	112.2	L498 C500 I626 Y638	L498-R628 PolarHBondContact O-NH1 2.89Å; C500-R628 PolarHBondContact O-NH1 2.62Å; I626-R628 PolarHBondContact O-N 3.34Å; I626-R628 VanDerWaalsContact O-N 3.07Å; R628-Y638 PolarHBondContact N-O 3.33Å
629	A	90.4	Very high	93.6	Very high	37 Å²	37	30.3 Å²	30.3	31%	0.306	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	163.2	178.7	0	0	0	0	0	110.5	Y638	A629-Y638 HydrophobicContact CB-CD2 3.89Å; A629-Y638 HydrophobicContact CB-CG 4.41Å; A629-Y638 PolarHBondContact O-N 2.82Å
630	V	91.7	Very high	93.5	Very high	27 Å²	27	30.2 Å²	30.2	16%	0.164	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.2	173.3	-55.9	0	0	0	0	109	L583 N587 I637	L583-V630 HydrophobicContact CB-CB 4.09Å; L583-V630 HydrophobicContact CB-CG1 4.33Å; L583-V630 HydrophobicContact CB-CG2 4.16Å; L583-V630 HydrophobicContact CD2-CB 4.18Å; L583-V630 HydrophobicContact CD2-CG1 4.31Å; N587-V630 HydrophobicContact CB-CG1 3.86Å; N587-V630 HydrophobicContact CB-CG2 3.98Å; V630-I637 HydrophobicContact CG1-CG2 3.9Å
631	D	89.5	Confident	93.4	Very high	49 Å²	49	28.2 Å²	28.2	26%	0.262	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	97.9	171.4	-177.8	-14	0	0	0	108.6	T633 A634 G635 V636 Y638	D631-T633 PolarHBondContact O-N 3.13Å; D631-T633 WeakPolarHBondContact OD1-CB 3.37Å; D631-T633 PolarHBondContact OD1-N 3.41Å; D631-A634 HydrophobicContact CB-CB 4.25Å; D631-A634 PolarHBondContact O-N 3.32Å; D631-A634 PolarHBondContact OD1-N 3.11Å; D631-A634 WeakPolarHBondContact OD2-CB 3.22Å; D631-G635 WeakPolarHBondContact O-CA 3.3Å; D631-G635 PolarHBondContact O-N 3.25Å; D631-V636 HydrophobicContact CB-CG2 3.74Å; D631-V636 PolarHBondContact N-O 3.12Å; D631-V636 PolarHBondContact O-N 3.33Å; D631-V636 VanDerWaalsContact O-N 3.14Å; D631-Y638 HydrophobicContact CB-CE2 4.19Å
632	P	85.2	Confident	93.1	Very high	65 Å²	65	29.3 Å²	29.3	42%	0.422	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.9	178.1	-23.2	34.7	0	0	0	113.9	L583 G635	L583-P632 VanDerWaalsContact CD1-CA 3.43Å; L583-P632 HydrophobicContact CD1-CB 4.01Å; L583-P632 HydrophobicContact CD1-CG 4.17Å; P632-G635 PolarHBondContact O-N 3.39Å
633	T	86.2	Confident	92.9	Very high	141 Å²	141	28.5 Å²	28.5	87%	0.865	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-43.8	-178.6	-44.9	0	0	0	0	110.6	D631	D631-T633 PolarHBondContact O-N 3.13Å; D631-T633 WeakPolarHBondContact OD1-CB 3.37Å; D631-T633 PolarHBondContact OD1-N 3.41Å
634	A	86.9	Confident	92.7	Very high	53 Å²	53	30.7 Å²	30.7	44%	0.438	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-11	178.2	0	0	0	0	0	113.6	D631 V636	D631-A634 HydrophobicContact CB-CB 4.25Å; D631-A634 PolarHBondContact O-N 3.32Å; D631-A634 PolarHBondContact OD1-N 3.11Å; D631-A634 WeakPolarHBondContact OD2-CB 3.22Å; A634-V636 VanDerWaalsContact C-N 3.34Å; A634-V636 HydrophobicContact CB-CG1 4.26Å; A634-V636 HydrophobicContact CB-CG2 4.07Å
635	G	88.3	Confident	92.4	Very high	5 Å²	5	34.7 Å²	34.7	5%	0.052	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	35.1	-175.9	0	0	0	0	0	113.2	V507 D631 P632	V507-G635 WeakPolarHBondContact CB-O 3.5Å; V507-G635 PolarHBondContact N-O 3.04Å; D631-G635 WeakPolarHBondContact O-CA 3.3Å; D631-G635 PolarHBondContact O-N 3.25Å; P632-G635 PolarHBondContact O-N 3.39Å
636	V	91.7	Very high	92.2	Very high	11 Å²	11	40.5 Å²	40.5	7%	0.067	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	152.5	-178.1	-54.9	0	0	0	0	112.4	Q504 V505 P506 D631 A634 Y638	Q504-V636 HydrophobicContact CG-CB 4.16Å; Q504-V636 HydrophobicContact CG-CG1 4.3Å; Q504-V636 HydrophobicContact CG-CG2 4.24Å; V505-V636 WeakPolarHBondContact O-CA 3.34Å; P506-V636 HydrophobicContact CB-CG1 4.48Å; D631-V636 HydrophobicContact CB-CG2 3.74Å; D631-V636 PolarHBondContact N-O 3.12Å; D631-V636 PolarHBondContact O-N 3.33Å; D631-V636 VanDerWaalsContact O-N 3.14Å; A634-V636 VanDerWaalsContact C-N 3.34Å; A634-V636 HydrophobicContact CB-CG1 4.26Å; A634-V636 HydrophobicContact CB-CG2 4.07Å; V636-Y638 HydrophobicContact CG2-CE2 3.9Å
637	I	94.5	Very high	92.1	Very high	1 Å²	1	43 Å²	43	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	152.1	166.6	63.4	-179.5	0	0	0	110.6	V505 V507 F559 L583 L586 V630 L639 I654	V505-I637 HydrophobicContact CB-CD1 4.39Å; V505-I637 HydrophobicContact CB-CG1 3.75Å; V505-I637 HydrophobicContact CG1-CG1 4.29Å; V505-I637 PolarHBondContact N-O 3.49Å; V505-I637 PolarHBondContact O-N 3.29Å; V507-I637 HydrophobicContact CG2-CG1 4.31Å; V507-I637 HydrophobicContact CG2-CG2 3.78Å; F559-I637 HydrophobicContact CE1-CD1 3.8Å; F559-I637 HydrophobicContact CZ-CD1 4.32Å; L583-I637 HydrophobicContact CD2-CG2 3.31Å; L586-I637 HydrophobicContact CD1-CD1 4.32Å; L586-I637 HydrophobicContact CD1-CG2 4.24Å; V630-I637 HydrophobicContact CG1-CG2 3.9Å; I637-L639 HydrophobicContact CD1-CD1 4.29Å; I637-L639 HydrophobicContact CD1-CD2 3.91Å; I637-L639 HydrophobicContact CD1-CG 4.13Å; I637-L639 HydrophobicContact CG1-CD2 4.31Å; I637-L639 HydrophobicContact CG1-CG 4.25Å; I637-I654 HydrophobicContact CD1-CD1 3.88Å
638	Y	95.7	Very high	92.1	Very high	63 Å²	63	44.9 Å²	44.9	25%	0.247	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	111.8	176.6	-64.6	-85	0	0	0	109.7	P502 Y503 Q504 C627 R628 A629 D631 V636	P502-Y638 HydrophobicContact CG-CD1 3.95Å; P502-Y638 HydrophobicContact CG-CG 4.43Å; Y503-Y638 CarbonylContact O-C 3.53Å; Y503-Y638 WeakPolarHBondContact O-CA 3.22Å; Q504-Y638 HydrophobicContact CB-CD1 4.34Å; Q504-Y638 HydrophobicContact CB-CE1 4.14Å; Q504-Y638 HydrophobicContact CG-CE1 3.98Å; C627-Y638 CarbonylContact C-O 3.44Å; R628-Y638 PolarHBondContact N-O 3.33Å; A629-Y638 HydrophobicContact CB-CD2 3.89Å; A629-Y638 HydrophobicContact CB-CG 4.41Å; A629-Y638 PolarHBondContact O-N 2.82Å; D631-Y638 HydrophobicContact CB-CE2 4.19Å; V636-Y638 HydrophobicContact CG2-CE2 3.9Å
639	L	96.4	Very high	92.2	Very high	7 Å²	7	47 Å²	47	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.8	-177.7	-61.9	-175.2	0	0	0	111.3	P502 Y503 V505 V591 L593 A625 I626 C627 I637 I654	P502-L639 CarbonylContact C-O 3.51Å; P502-L639 VanDerWaalsContact CA-O 3.29Å; P502-L639 WeakPolarHBondContact CA-O 3.16Å; P502-L639 WeakPolarHBondContact CB-O 3.18Å; Y503-L639 PolarHBondContact N-O 3.27Å; Y503-L639 PolarHBondContact O-N 3.01Å; V505-L639 HydrophobicContact CG2-CD1 3.87Å; V505-L639 HydrophobicContact CG2-CG 4.14Å; V591-L639 HydrophobicContact CG2-CD2 4.1Å; L593-L639 HydrophobicContact CD2-CD1 4.16Å; A625-L639 HydrophobicContact CB-CB 4.36Å; I626-L639 CarbonylContact O-C 3.57Å; I626-L639 WeakPolarHBondContact O-CA 3.13Å; C627-L639 HydrophobicContact CB-CD2 3.96Å; I637-L639 HydrophobicContact CD1-CD1 4.29Å; I637-L639 HydrophobicContact CD1-CD2 3.91Å; I637-L639 HydrophobicContact CD1-CG 4.13Å; I637-L639 HydrophobicContact CG1-CD2 4.31Å; I637-L639 HydrophobicContact CG1-CG 4.25Å; L639-I654 HydrophobicContact CD1-CD1 3.71Å
640	T	96.4	Very high	92.4	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118.1	169.1	-54.4	0	0	0	0	109	L474 L497 C500 A625 I626	L474-T640 HydrophobicContact CD1-CG2 3.96Å; L474-T640 HydrophobicContact CD2-CG2 3.86Å; L497-T640 HydrophobicContact CD1-CG2 3.52Å; L497-T640 HydrophobicContact CG-CG2 4.48Å; C500-T640 HydrophobicContact CB-CG2 3.9Å; A625-T640 WeakPolarHBondContact CA-O 3.17Å; I626-T640 PolarHBondContact N-O 3.41Å; I626-T640 PolarHBondContact O-N 2.76Å
641	T	96.3	Very high	92.7	Very high	7 Å²	7	50.1 Å²	50.1	4%	0.043	28%	0.283	C	S	.	.			trans	-151.8	152.7	179	-172.7	0	0	0	0	109.7	L474 Y503 L593 L624 A625 V643 L648	L474-T641 WeakPolarHBondContact CD2-O 3.43Å; Y503-T641 HydrophobicContact CD2-CG2 4.08Å; Y503-T641 HydrophobicContact CE2-CG2 3.99Å; L593-T641 HydrophobicContact CD1-CG2 4.07Å; L624-T641 PolarHBondContact O-OG1 3.08Å; A625-T641 HydrophobicContact CB-CG2 4.39Å; T641-V643 HydrophobicContact CG2-CB 4.41Å; T641-V643 WeakPolarHBondContact OG1-CG2 3.44Å; T641-V643 PolarHBondContact OG1-N 3.02Å; T641-L648 HydrophobicContact CG2-CD1 4.45Å; T641-L648 HydrophobicContact CG2-CD2 4.1Å
642	G	91.7	Very high	93	Very high	23 Å²	23	50 Å²	50	24%	0.237	28%	0.284	C	S	.	.			trans	-108.1	19	171.3	0	0	0	0	0	113.2	T473	T473-G642 WeakPolarHBondContact O-CA 3.45Å
643	V	94.7	Very high	93.6	Very high	13 Å²	13	46.9 Å²	46.9	8%	0.079	26%	0.264	C	S	.	.			trans	-59	138.2	165.8	174.3	0	0	0	0	108.5	L593 V622 T641 D647 L648	L593-V643 HydrophobicContact CD1-CG2 4.26Å; V622-V643 HydrophobicContact CG1-CG1 3.68Å; T641-V643 HydrophobicContact CG2-CB 4.41Å; T641-V643 WeakPolarHBondContact OG1-CG2 3.44Å; T641-V643 PolarHBondContact OG1-N 3.02Å; V643-D647 HydrophobicContact CG1-CB 3.67Å; V643-L648 HydrophobicContact CB-CD2 3.98Å; V643-L648 HydrophobicContact CB-CG 4.19Å; V643-L648 HydrophobicContact CG1-CD2 3.9Å; V643-L648 HydrophobicContact CG1-CG 3.93Å
644	S	93	Very high	94.1	Very high	50 Å²	50	40.2 Å²	40.2	35%	0.35	22%	0.223	S	C	.	.			trans	-61.2	150.9	-177.4	77.3	0	0	0	0	111.5	D646 D647 L648	S644-D646 VanDerWaalsContact C-N 3.26Å; S644-D646 PolarHBondContact O-N 3.05Å; S644-D647 PolarHBondContact O-N 2.98Å; S644-D647 VanDerWaalsContact O-N 3.14Å; S644-D647 VanDerWaalsContact OG-CB 3.29Å; S644-D647 WeakPolarHBondContact OG-CB 3.36Å; S644-D647 PolarHBondContact OG-N 3.4Å; S644-D647 VanDerWaalsContact OG-N 3.12Å; S644-D647 PolarHBondContact OG-OD2 3.42Å; S644-L648 WeakPolarHBondContact O-CG 3.31Å; S644-L648 PolarHBondContact O-N 2.81Å
645	E	91.6	Very high	94.6	Very high	85 Å²	85	37.8 Å²	37.8	40%	0.397	20%	0.202	S	C	.	.	H	α-helix	trans	-57.5	-41	177.2	-68.3	-172.5	-168.9	0	0	111.5	S530 D647 L648 L649	S530-E645 PolarHBondContact OG-OE1 3.33Å; S530-E645 PolarHBondContact OG-OE2 3.06Å; S530-E645 VanDerWaalsContact OG-OE2 3.08Å; E645-D647 VanDerWaalsContact C-N 3.3Å; E645-D647 PolarHBondContact O-N 3.36Å; E645-L648 PolarHBondContact O-N 2.9Å; E645-L649 WeakPolarHBondContact O-CG 3.29Å; E645-L649 PolarHBondContact O-N 3.42Å; E645-L649 VanDerWaalsContact O-N 3.13Å
646	D	93.9	Very high	94.9	Very high	122 Å²	122	38.6 Å²	38.6	65%	0.652	20%	0.204	S	C	*	.	H	α-helix	trans	-60.8	-37.4	177.2	-68.1	-33.5	0	0	0	113	S644	S644-D646 VanDerWaalsContact C-N 3.26Å; S644-D646 PolarHBondContact O-N 3.05Å
647	D	94.5	Very high	95	Very high	58 Å²	58	38.1 Å²	38.1	31%	0.31	20%	0.201	S	C	.	.	H	α-helix	trans	-79.4	-33.3	177.5	-69.6	-41.3	0	0	0	112.2	V622 V643 S644 E645 L649 K650	V622-D647 HydrophobicContact CG1-CB 3.68Å; V643-D647 HydrophobicContact CG1-CB 3.67Å; S644-D647 PolarHBondContact O-N 2.98Å; S644-D647 VanDerWaalsContact O-N 3.14Å; S644-D647 VanDerWaalsContact OG-CB 3.29Å; S644-D647 WeakPolarHBondContact OG-CB 3.36Å; S644-D647 PolarHBondContact OG-N 3.4Å; S644-D647 VanDerWaalsContact OG-N 3.12Å; S644-D647 PolarHBondContact OG-OD2 3.42Å; E645-D647 VanDerWaalsContact C-N 3.3Å; E645-D647 PolarHBondContact O-N 3.36Å; D647-L649 PolarHBondContact O-N 3.17Å; D647-K650 WeakPolarHBondContact O-CB 3.5Å; D647-K650 PolarHBondContact O-N 2.95Å; D647-K650 IonicContact OD1-NZ 2.69Å; D647-K650 PolarHBondContact OD1-NZ 3.22Å
648	L	94.4	Very high	94.8	Very high	41 Å²	41	41.3 Å²	41.3	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-35.6	173.9	-75	176.4	0	0	0	111.8	Y503 L593 T641 V643 S644 E645 K650 V651	Y503-L648 HydrophobicContact CD1-CD1 4.48Å; Y503-L648 HydrophobicContact CD2-CD1 4.48Å; Y503-L648 HydrophobicContact CE1-CD1 3.91Å; Y503-L648 HydrophobicContact CE2-CD1 3.9Å; L593-L648 HydrophobicContact CD1-CD2 3.63Å; T641-L648 HydrophobicContact CG2-CD1 4.45Å; T641-L648 HydrophobicContact CG2-CD2 4.1Å; V643-L648 HydrophobicContact CB-CD2 3.98Å; V643-L648 HydrophobicContact CB-CG 4.19Å; V643-L648 HydrophobicContact CG1-CD2 3.9Å; V643-L648 HydrophobicContact CG1-CG 3.93Å; S644-L648 WeakPolarHBondContact O-CG 3.31Å; S644-L648 PolarHBondContact O-N 2.81Å; E645-L648 PolarHBondContact O-N 2.9Å; L648-K650 PolarHBondContact O-N 2.76Å; L648-K650 VanDerWaalsContact O-N 3.16Å; L648-V651 WeakPolarHBondContact O-CB 3.42Å; L648-V651 PolarHBondContact O-N 3.15Å; L648-V651 VanDerWaalsContact O-N 3.09Å
649	L	93.6	Very high	94.7	Very high	127 Å²	127	38.7 Å²	38.7	67%	0.665	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19	175.8	-69.1	173.4	0	0	0	113.7	E645 D647	E645-L649 WeakPolarHBondContact O-CG 3.29Å; E645-L649 PolarHBondContact O-N 3.42Å; E645-L649 VanDerWaalsContact O-N 3.13Å; D647-L649 PolarHBondContact O-N 3.17Å
650	K	95.1	Very high	94.3	Very high	116 Å²	116	41.7 Å²	41.7	50%	0.504	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-17.6	177.8	-56.1	169.6	-169.4	163	0	112.4	V595 D647 L648 T652	V595-K650 HydrophobicContact CG2-CB 4.24Å; D647-K650 WeakPolarHBondContact O-CB 3.5Å; D647-K650 PolarHBondContact O-N 2.95Å; D647-K650 IonicContact OD1-NZ 2.69Å; D647-K650 PolarHBondContact OD1-NZ 3.22Å; L648-K650 PolarHBondContact O-N 2.76Å; L648-K650 VanDerWaalsContact O-N 3.16Å; K650-T652 PolarHBondContact O-N 3.1Å
651	V	97	Very high	94.2	Very high	14 Å²	14	42.1 Å²	42.1	9%	0.085	23%	0.227	C	C	.	.			trans	-70.2	127.4	-173.8	178.9	0	0	0	0	109.6	L557 L593 V622 L648	L557-V651 HydrophobicContact CD1-CG1 4.46Å; L557-V651 HydrophobicContact CD2-CG1 4.04Å; L557-V651 WeakPolarHBondContact CD2-O 3.29Å; L593-V651 HydrophobicContact CB-CG1 3.98Å; L593-V651 HydrophobicContact CB-CG2 3.87Å; V622-V651 HydrophobicContact CB-CG2 4.16Å; V622-V651 HydrophobicContact CG1-CG2 4.37Å; V622-V651 HydrophobicContact CG2-CG2 3.99Å; L648-V651 WeakPolarHBondContact O-CB 3.42Å; L648-V651 PolarHBondContact O-N 3.15Å; L648-V651 VanDerWaalsContact O-N 3.09Å
652	T	96.7	Very high	94.1	Very high	47 Å²	47	41.8 Å²	41.8	29%	0.288	23%	0.225	S	C	.	.			trans	-118.2	-9.2	177.2	59.7	0	0	0	0	112.8	A558 C594 V596 K650	A558-T652 PolarHBondContact N-O 2.87Å; C594-T652 PolarHBondContact O-N 3.3Å; V596-T652 WeakPolarHBondContact CA-OG1 3.44Å; V596-T652 PolarHBondContact N-OG1 3.26Å; V596-T652 PolarHBondContact O-OG1 3.18Å; K650-T652 PolarHBondContact O-N 3.1Å
653	G	96.3	Very high	94	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	159.3	175.5	0	0	0	0	0	115.5	A558 C594	A558-G653 CarbonylContact O-C 3.56Å; A558-G653 WeakPolarHBondContact O-CA 3.48Å; C594-G653 PolarHBondContact N-O 3.39Å; C594-G653 PolarHBondContact O-N 2.99Å
654	I	97.3	Very high	93.8	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.6	179.1	-65.3	176.3	0	0	0	108.6	L557 A558 F559 R560 V591 A592 L593 I637 L639	L557-I654 HydrophobicContact CB-CD1 4.39Å; L557-I654 HydrophobicContact CB-CG1 4.4Å; L557-I654 HydrophobicContact CD1-CD1 3.51Å; L557-I654 HydrophobicContact CD1-CG1 3.8Å; A558-I654 PolarHBondContact O-N 3.01Å; F559-I654 WeakPolarHBondContact CA-O 3.4Å; F559-I654 HydrophobicContact CD1-CB 3.95Å; F559-I654 HydrophobicContact CD1-CD1 4.45Å; F559-I654 HydrophobicContact CD1-CG2 4.32Å; F559-I654 HydrophobicContact CE1-CB 4.08Å; F559-I654 HydrophobicContact CE1-CD1 3.7Å; F559-I654 HydrophobicContact CE1-CG1 4.35Å; F559-I654 HydrophobicContact CE1-CG2 4.47Å; F559-I654 HydrophobicContact CZ-CD1 4.28Å; R560-I654 PolarHBondContact N-O 3.03Å; V591-I654 HydrophobicContact CB-CG2 3.63Å; V591-I654 HydrophobicContact CG1-CG2 3.94Å; V591-I654 HydrophobicContact CG2-CG2 3.83Å; A592-I654 WeakPolarHBondContact O-CA 3.42Å; L593-I654 HydrophobicContact CD2-CG1 4.09Å; I637-I654 HydrophobicContact CD1-CD1 3.88Å; L639-I654 HydrophobicContact CD1-CD1 3.71Å
655	L	97	Very high	93.6	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.5	179.7	-44.9	-177.4	0	0	0	110.2	F329 R560 M562 V591 A592 C594 V596 I613 P617	F329-L655 HydrophobicContact CD1-CB 4.25Å; R560-L655 HydrophobicContact CB-CD2 3.57Å; R560-L655 HydrophobicContact CG-CD2 4.4Å; R560-L655 WeakPolarHBondContact O-CA 3.39Å; M562-L655 HydrophobicContact CG-CB 4.3Å; M562-L655 HydrophobicContact SD-CB 3.9Å; M562-L655 HydrophobicContact SD-CD1 4.3Å; V591-L655 CarbonylContact C-O 3.53Å; V591-L655 WeakPolarHBondContact CA-O 3.41Å; A592-L655 HydrophobicContact CB-CB 4.43Å; A592-L655 PolarHBondContact N-O 3.36Å; A592-L655 PolarHBondContact O-N 3.17Å; C594-L655 HydrophobicContact CB-CD1 4.14Å; C594-L655 HydrophobicContact CB-CG 4.24Å; C594-L655 WeakPolarHBondContact SG-CD1 3.49Å; V596-L655 HydrophobicContact CG2-CD2 4.46Å; I613-L655 HydrophobicContact CD1-CD2 3.61Å; P617-L655 HydrophobicContact CG-CD1 3.86Å; P617-L655 HydrophobicContact CG-CD2 3.78Å
656	R	95.3	Very high	93.3	Very high	22 Å²	22	38.8 Å²	38.8	8%	0.083	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.8	172	-173.6	-91.4	163.9	171.1	1.3	109.5	R560 I561 M562 L586 V591 G699	R560-R656 PolarHBondContact O-N 3.46Å; I561-R656 HydrophobicContact CD1-CB 3.71Å; I561-R656 HydrophobicContact CD1-CG 4.28Å; M562-R656 WeakPolarHBondContact CB-O 2.88Å; M562-R656 PolarHBondContact N-O 2.92Å; L586-R656 HydrophobicContact CD2-CB 3.97Å; L586-R656 HydrophobicContact CD2-CG 4.4Å; V591-R656 HydrophobicContact CG1-CB 4.2Å; V591-R656 HydrophobicContact CG1-CG 4.43Å; R656-G699 VanDerWaalsContact CZ-O 3.3Å; R656-G699 PolarHBondContact NH1-O 3.28Å; R656-G699 VanDerWaalsContact NH1-O 3.17Å; R656-G699 PolarHBondContact NH2-O 3.37Å
657	G	92.9	Very high	92.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	20%	0.196	C	C	.	.			trans	-99.4	-176.3	175.1	0	0	0	0	0	114	G331 V659	G331-G657 CarbonylContact O-C 3.36Å; G331-G657 VanDerWaalsContact O-CA 3.22Å; G331-G657 WeakPolarHBondContact O-CA 3.45Å; G657-V659 PolarHBondContact O-N 3.48Å
658	N	91.5	Very high	92.4	Very high	68 Å²	68	38 Å²	38	36%	0.364	20%	0.197	S	C	.	.	S	Bend	trans	-87.1	49.1	167.4	-168.4	27.9	0	0	0	112	G331	G331-N658 WeakPolarHBondContact O-CA 3.1Å; G331-N658 PolarHBondContact O-N 3.32Å
659	V	92.4	Very high	91.5	Very high	8 Å²	8	40.1 Å²	40.1	5%	0.048	21%	0.206	C	C	.	.			trans	-114.1	122.4	171.5	-177.7	0	0	0	0	107.7	F329 I333 M466 L590 G657	F329-V659 HydrophobicContact CE2-CG2 4.28Å; F329-V659 HydrophobicContact CZ-CG2 4.28Å; I333-V659 HydrophobicContact CG2-CG2 4.33Å; M466-V659 HydrophobicContact CE-CG1 3.9Å; L590-V659 HydrophobicContact CD2-CB 3.86Å; L590-V659 HydrophobicContact CD2-CG1 3.54Å; G657-V659 PolarHBondContact O-N 3.48Å
660	N	89.8	Confident	90.1	Very high	70 Å²	70	37.5 Å²	37.5	37%	0.374	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-89.2	146.5	-174.5	-68.4	-58.7	0	0	0	111.8
661	L	94	Very high	88.3	Confident	10 Å²	10	38.8 Å²	38.8	5%	0.052	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-68	144.1	166.9	-70.1	172.4	0	0	0	110.9	F470 L590 I626 F665 F666	F470-L661 HydrophobicContact CE2-CD2 4.36Å; L590-L661 HydrophobicContact CB-CD2 3.85Å; L590-L661 HydrophobicContact CB-CG 4.11Å; L590-L661 HydrophobicContact CD1-CD2 3.83Å; L590-L661 HydrophobicContact CG-CD2 4.45Å; I626-L661 HydrophobicContact CD1-CD2 3.86Å; I626-L661 HydrophobicContact CG1-CD2 3.83Å; I626-L661 HydrophobicContact CG2-CD1 3.96Å; L661-F665 HydrophobicContact CB-CD2 4.24Å; L661-F665 HydrophobicContact CD2-CD2 4.41Å; L661-F666 HydrophobicContact CB-CE2 3.79Å; L661-F666 HydrophobicContact CB-CZ 3.98Å; L661-F666 HydrophobicContact CD1-CZ 4.05Å
662	P	94.3	Very high	86	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-47.5	139.3	170	-29.9	33.3	0	0	0	112.3	D463 M466 L467 C664 F665	D463-P662 HydrophobicContact CB-CB 4.21Å; D463-P662 HydrophobicContact CB-CG 4.33Å; M466-P662 HydrophobicContact CB-CG 3.87Å; M466-P662 HydrophobicContact CG-CG 3.94Å; L467-P662 HydrophobicContact CD1-CB 4.49Å; L467-P662 HydrophobicContact CD2-CB 4.33Å; L467-P662 HydrophobicContact CD2-CG 4.33Å; L467-P662 HydrophobicContact CG-CB 4.22Å; L467-P662 HydrophobicContact CG-CG 4.02Å; P662-C664 PolarHBondContact O-N 3.44Å; P662-F665 HydrophobicContact CB-CD2 3.95Å; P662-F665 HydrophobicContact CB-CE2 4.14Å; P662-F665 HydrophobicContact CG-CD2 4.04Å; P662-F665 HydrophobicContact CG-CE2 3.83Å; P662-F665 PolarHBondContact O-N 2.64Å
663	N	88.5	Confident	83.3	Confident	72 Å²	72	55.4 Å²	55.4	39%	0.385	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.2	-174.3	-72.4	-29.4	0	0	0	113.1	F665 F666 L667 R703	N663-F665 PolarHBondContact O-N 3.17Å; N663-F666 PolarHBondContact O-N 3.36Å; N663-L667 HydrophobicContact CB-CD1 4.03Å; N663-L667 WeakPolarHBondContact O-CG 3.17Å; N663-L667 PolarHBondContact O-N 2.83Å; N663-R703 PolarHBondContact OD1-NH1 2.58Å; N663-R703 PolarHBondContact OD1-NH2 2.9Å
664	C	89.8	Confident	80.6	Confident	11 Å²	11	60.9 Å²	60.9	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-32.2	179.1	57.3	0	0	0	0	112.5	I182 V494 P662 F666 L667 D668	I182-C664 HydrophobicContact CD1-CB 4.3Å; I182-C664 HydrophobicContact CG2-CB 4.42Å; V494-C664 HydrophobicContact CG2-CB 4.39Å; V494-C664 WeakPolarHBondContact CG2-O 3.46Å; P662-C664 PolarHBondContact O-N 3.44Å; C664-F666 PolarHBondContact O-N 2.72Å; C664-L667 PolarHBondContact O-N 2.84Å; C664-D668 HydrophobicContact CB-CB 4.38Å; C664-D668 WeakPolarHBondContact CB-OD2 3.34Å; C664-D668 WeakPolarHBondContact O-CB 3.3Å; C664-D668 PolarHBondContact O-N 2.93Å
665	F	89.6	Confident	77.9	Confident	9 Å²	9	70.6 Å²	70.6	4%	0.039	34%	0.339	C	S	.	.	H	α-helix	trans	-60.1	-19.7	176.2	-71.3	-53.5	0	0	0	113.9	L467 F470 V494 L497 I626 L661 P662 N663 Q669	L467-F665 HydrophobicContact CD2-CE1 4.31Å; L467-F665 HydrophobicContact CD2-CE2 3.99Å; L467-F665 HydrophobicContact CD2-CZ 3.72Å; F470-F665 HydrophobicContact CD2-CE2 4.43Å; F470-F665 HydrophobicContact CD2-CZ 4.43Å; V494-F665 HydrophobicContact CG2-CD1 3.93Å; V494-F665 HydrophobicContact CG2-CE1 4.49Å; L497-F665 HydrophobicContact CB-CE1 4.25Å; L497-F665 HydrophobicContact CD2-CD1 3.48Å; L497-F665 VanDerWaalsContact CD2-CD1 3.48Å; L497-F665 HydrophobicContact CD2-CE1 3.48Å; L497-F665 VanDerWaalsContact CD2-CE1 3.48Å; L497-F665 HydrophobicContact CD2-CG 4.34Å; L497-F665 HydrophobicContact CD2-CZ 4.28Å; L497-F665 HydrophobicContact CG-CE1 4.36Å; I626-F665 HydrophobicContact CD1-CD2 4.43Å; I626-F665 HydrophobicContact CD1-CE1 4.49Å; I626-F665 HydrophobicContact CD1-CE2 4.07Å; I626-F665 HydrophobicContact CD1-CZ 4.1Å; L661-F665 HydrophobicContact CB-CD2 4.24Å; L661-F665 HydrophobicContact CD2-CD2 4.41Å; P662-F665 HydrophobicContact CB-CD2 3.95Å; P662-F665 HydrophobicContact CB-CE2 4.14Å; P662-F665 HydrophobicContact CG-CD2 4.04Å; P662-F665 HydrophobicContact CG-CE2 3.83Å; P662-F665 PolarHBondContact O-N 2.64Å; N663-F665 PolarHBondContact O-N 3.17Å; F665-Q669 WeakPolarHBondContact O-CG 3.21Å; F665-Q669 PolarHBondContact O-NE2 3.33Å
666	F	85.7	Confident	75.3	Confident	15 Å²	15	74.9 Å²	74.9	7%	0.066	37%	0.365	C	S	.	.	H	α-helix	trans	-104.3	-35.1	176.2	-50.7	-85.4	0	0	0	112.5	A588 L661 N663 C664 L687 R703	A588-F666 HydrophobicContact CB-CE1 4.12Å; L661-F666 HydrophobicContact CB-CE2 3.79Å; L661-F666 HydrophobicContact CB-CZ 3.98Å; L661-F666 HydrophobicContact CD1-CZ 4.05Å; N663-F666 PolarHBondContact O-N 3.36Å; C664-F666 PolarHBondContact O-N 2.72Å; F666-L687 HydrophobicContact CB-CD1 3.91Å; F666-L687 HydrophobicContact CB-CG 4.42Å; F666-R703 VanDerWaalsContact CE2-NH2 3.29Å
667	L	85	Confident	72.8	Confident	102 Å²	102	85 Å²	85	53%	0.534	41%	0.405	S	S	.	.	H	α-helix	trans	-92.4	-27.6	-170	-64.3	174.4	0	0	0	114.1	N663 C664 L687	N663-L667 HydrophobicContact CB-CD1 4.03Å; N663-L667 WeakPolarHBondContact O-CG 3.17Å; N663-L667 PolarHBondContact O-N 2.83Å; C664-L667 PolarHBondContact O-N 2.84Å; L667-L687 HydrophobicContact CD2-CD1 3.59Å; L667-L687 HydrophobicContact CD2-CD2 3.98Å; L667-L687 HydrophobicContact CD2-CG 4.45Å; L667-L687 HydrophobicContact CG-CD1 4.45Å
668	D	84.3	Confident	70.3	Confident	62 Å²	62	91.1 Å²	91.1	33%	0.332	43%	0.433	S	S	.	.	S	Bend	trans	-105.5	21.5	-171.9	-59.6	-11.3	0	0	0	111.8	H492 V494 C664	H492-D668 VanDerWaalsContact CE1-CB 3.43Å; H492-D668 WeakPolarHBondContact CE1-CB 3.44Å; H492-D668 IonicContact CE1-OD2 2.7Å; H492-D668 IonicContact NE2-OD2 3.69Å; V494-D668 HydrophobicContact CG2-CB 4.21Å; C664-D668 HydrophobicContact CB-CB 4.38Å; C664-D668 WeakPolarHBondContact CB-OD2 3.34Å; C664-D668 WeakPolarHBondContact O-CB 3.3Å; C664-D668 PolarHBondContact O-N 2.93Å
669	Q	74.9	Confident	68	Low	85 Å²	85	97.4 Å²	97.4	40%	0.397	46%	0.46	S	S	.	.			trans	-69.7	135.2	176.5	-66.1	-170.3	1.9	0	0	110.7	V494 L498 F665 F671	V494-Q669 HydrophobicContact CG1-CG 3.77Å; L498-Q669 HydrophobicContact CD1-CG 4.36Å; F665-Q669 WeakPolarHBondContact O-CG 3.21Å; F665-Q669 PolarHBondContact O-NE2 3.33Å; Q669-F671 PolarHBondContact O-N 3.09Å
670	P	64.8	Low	65.5	Low	72 Å²	72	100.7 Å²	100.7	47%	0.468	48%	0.48	S	S	.	.			trans	-63.6	118.8	178.1	23.5	-30.2	0	0	0	110.5	F672	P670-F672 HydrophobicContact CB-CE2 4.45Å; P670-F672 PolarHBondContact O-N 3.26Å
671	F	56.5	Low	63.2	Low	143 Å²	143	101.7 Å²	101.7	63%	0.627	49%	0.491	S	S	*	.			trans	-88.5	106.3	179.9	-137.7	-84.1	0	0	0	109.6	Q669 R673 L684	Q669-F671 PolarHBondContact O-N 3.09Å; F671-R673 PolarHBondContact O-N 3.16Å; F671-L684 HydrophobicContact CD2-CD2 4.47Å; F671-L684 HydrophobicContact CE2-CD2 3.85Å; F671-L684 HydrophobicContact CE2-CG 4.22Å
672	F	49.7	Very low	60.7	Low	173 Å²	173	110.2 Å²	110.2	76%	0.759	52%	0.522	S	S	*	.			trans	-82	103.9	168.4	-67.3	-80.7	0	0	0	108.4	P670 T674	P670-F672 HydrophobicContact CB-CE2 4.45Å; P670-F672 PolarHBondContact O-N 3.26Å; F672-T674 VanDerWaalsContact C-N 3.26Å; F672-T674 PolarHBondContact O-N 3.06Å
673	R	40.1	Very low	58.4	Low	237 Å²	237	115.4 Å²	115.4	89%	0.894	55%	0.545	S	S	*	.			trans	-67.5	90.4	165	-85.8	-170.2	-176.3	-175.6	1.2	108.2	F671 K675	F671-R673 PolarHBondContact O-N 3.16Å; R673-K675 PolarHBondContact O-N 3.28Å
674	T	40	Very low	56.4	Low	116 Å²	116	115 Å²	115	71%	0.712	54%	0.543	S	S	*	.			trans	-67.3	121	157.6	32.8	0	0	0	0	107.3	F672 V676	F672-T674 VanDerWaalsContact C-N 3.26Å; F672-T674 PolarHBondContact O-N 3.06Å; T674-V676 PolarHBondContact O-N 3.2Å
675	K	40.2	Very low	54.4	Low	205 Å²	205	118.6 Å²	118.6	89%	0.891	57%	0.566	S	S	*	*			trans	-64.7	85.2	169.2	-74.2	-178.8	176.5	179.2	0	107.9	R673	R673-K675 PolarHBondContact O-N 3.28Å
676	V	41.8	Very low	52.8	Low	91 Å²	91	121.5 Å²	121.5	55%	0.552	58%	0.577	S	S	*	*			trans	-124.3	121.4	168.5	-176.6	0	0	0	0	108	T674 E678	T674-V676 PolarHBondContact O-N 3.2Å; V676-E678 HydrophobicContact CG1-CG 4.45Å; V676-E678 PolarHBondContact O-N 3.28Å
677	Y	43.1	Very low	51	Low	234 Å²	234	122.3 Å²	122.3	92%	0.918	58%	0.582	S	S	*	*			trans	-71.3	61.1	177.8	-78.5	-94.5	0	0	0	111.2
678	E	39.7	Very low	49	Very low	130 Å²	130	119.4 Å²	119.4	61%	0.607	58%	0.576	S	S	*	*			trans	-127.7	116.4	168.4	-77.5	-175.7	161.6	0	0	109.8	V676 T680	V676-E678 HydrophobicContact CG1-CG 4.45Å; V676-E678 PolarHBondContact O-N 3.28Å; E678-T680 PolarHBondContact O-N 3.12Å
679	E	43.7	Very low	47	Very low	199 Å²	199	120.7 Å²	120.7	93%	0.93	59%	0.588	S	S	*	*			trans	-69.9	27.7	179.9	-65.6	-174.3	150.6	0	0	113.6	P681	E679-P681 VanDerWaalsContact O-CD 3.26Å; E679-P681 WeakPolarHBondContact O-CD 3.44Å
680	T	41.1	Very low	45.5	Very low	77 Å²	77	121.7 Å²	121.7	47%	0.472	60%	0.6	S	S	.	*			trans	-75.7	118.4	165.7	32	0	0	0	0	108.4	E678 W682	E678-T680 PolarHBondContact O-N 3.12Å; T680-W682 PolarHBondContact O-N 3.25Å; T680-W682 PolarHBondContact O-NE1 3.32Å
681	P	40.6	Very low	44.3	Very low	91 Å²	91	123.7 Å²	123.7	59%	0.591	62%	0.616	S	S	*	*			trans	-60.5	107.1	172.6	21.8	-28.5	0	0	0	108.2	E679 F683	E679-P681 VanDerWaalsContact O-CD 3.26Å; E679-P681 WeakPolarHBondContact O-CD 3.44Å; P681-F683 HydrophobicContact CB-CE2 3.94Å; P681-F683 HydrophobicContact CB-CZ 3.9Å; P681-F683 HydrophobicContact CG-CE2 3.73Å; P681-F683 HydrophobicContact CG-CZ 3.91Å; P681-F683 WeakPolarHBondContact O-CD2 3.31Å; P681-F683 VanDerWaalsContact O-CE2 3.31Å; P681-F683 WeakPolarHBondContact O-CE2 3.08Å; P681-F683 PolarHBondContact O-N 2.91Å; P681-F683 VanDerWaalsContact O-N 3.09Å
682	W	42	Very low	43.4	Very low	189 Å²	189	119.1 Å²	119.1	72%	0.716	60%	0.6	S	S	*	*			trans	-71.3	104	179.6	-63.7	93.1	0	0	0	108.5	T680	T680-W682 PolarHBondContact O-N 3.25Å; T680-W682 PolarHBondContact O-NE1 3.32Å
683	F	44.9	Very low	43.2	Very low	111 Å²	111	112.5 Å²	112.5	49%	0.487	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-85.1	128.4	175.9	-63.2	-77.7	0	0	0	109.7	P681 P685 T692	P681-F683 HydrophobicContact CB-CE2 3.94Å; P681-F683 HydrophobicContact CB-CZ 3.9Å; P681-F683 HydrophobicContact CG-CE2 3.73Å; P681-F683 HydrophobicContact CG-CZ 3.91Å; P681-F683 WeakPolarHBondContact O-CD2 3.31Å; P681-F683 VanDerWaalsContact O-CE2 3.31Å; P681-F683 WeakPolarHBondContact O-CE2 3.08Å; P681-F683 PolarHBondContact O-N 2.91Å; P681-F683 VanDerWaalsContact O-N 3.09Å; F683-P685 WeakPolarHBondContact O-CD 3.44Å; F683-T692 HydrophobicContact CD1-CG2 4.38Å; F683-T692 HydrophobicContact CE1-CG2 3.75Å; F683-T692 HydrophobicContact CE2-CG2 4.43Å; F683-T692 HydrophobicContact CZ-CG2 3.78Å
684	L	46	Very low	43.3	Very low	63 Å²	63	104.1 Å²	104.1	33%	0.33	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-56.9	123.1	167.5	-82.5	164.5	0	0	0	108.3	F671 Y686 L687	F671-L684 HydrophobicContact CD2-CD2 4.47Å; F671-L684 HydrophobicContact CE2-CD2 3.85Å; F671-L684 HydrophobicContact CE2-CG 4.22Å; L684-Y686 PolarHBondContact O-N 3.2Å; L684-L687 HydrophobicContact CB-CB 3.86Å; L684-L687 HydrophobicContact CB-CD1 4.1Å; L684-L687 HydrophobicContact CD1-CD1 3.96Å; L684-L687 PolarHBondContact O-N 2.75Å; L684-L687 VanDerWaalsContact O-O 3.05Å
685	P	48.4	Very low	43.4	Very low	86 Å²	86	108.2 Å²	108.2	56%	0.558	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.2	133.5	175.2	-24.7	33.3	0	0	0	109.4	F683 L687	F683-P685 WeakPolarHBondContact O-CD 3.44Å; P685-L687 PolarHBondContact O-N 3.35Å; P685-L687 VanDerWaalsContact O-N 3.15Å
686	Y	56	Low	43.5	Very low	70 Å²	70	99.4 Å²	99.4	28%	0.275	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	0.5	178.1	-34.4	-73.8	0	0	0	116.4	N587 A588 L684 Q693 L700	N587-Y686 PolarHBondContact ND2-OH 3.19Å; A588-Y686 HydrophobicContact CB-CD2 3.93Å; A588-Y686 HydrophobicContact CB-CE1 4.47Å; A588-Y686 HydrophobicContact CB-CE2 3.5Å; L684-Y686 PolarHBondContact O-N 3.2Å; Y686-Q693 PolarHBondContact O-NE2 3.12Å; Y686-L700 HydrophobicContact CD1-CD1 4.26Å
687	L	48	Very low	43.6	Very low	32 Å²	32	98 Å²	98	17%	0.168	52%	0.518	C	S	.	.			trans	-121.3	127.1	175	-66.5	167.1	0	0	0	112.6	F666 L667 L684 P685 Q693	F666-L687 HydrophobicContact CB-CD1 3.91Å; F666-L687 HydrophobicContact CB-CG 4.42Å; L667-L687 HydrophobicContact CD2-CD1 3.59Å; L667-L687 HydrophobicContact CD2-CD2 3.98Å; L667-L687 HydrophobicContact CD2-CG 4.45Å; L667-L687 HydrophobicContact CG-CD1 4.45Å; L684-L687 HydrophobicContact CB-CB 3.86Å; L684-L687 HydrophobicContact CB-CD1 4.1Å; L684-L687 HydrophobicContact CD1-CD1 3.96Å; L684-L687 PolarHBondContact O-N 2.75Å; L684-L687 VanDerWaalsContact O-O 3.05Å; P685-L687 PolarHBondContact O-N 3.35Å; P685-L687 VanDerWaalsContact O-N 3.15Å; L687-Q693 PolarHBondContact O-NE2 2.86Å; L687-Q693 VanDerWaalsContact O-NE2 3.16Å
688	G	43.4	Very low	43.6	Very low	41 Å²	41	91.1 Å²	91.1	42%	0.423	51%	0.51	S	S	.	.	S	Bend	trans	133.6	167.2	-170.7	0	0	0	0	0	116.4	Q693	G688-Q693 PolarHBondContact O-NE2 3.18Å
689	P	41.9	Very low	43.6	Very low	89 Å²	89	85.5 Å²	85.5	58%	0.578	49%	0.487	S	S	*	.			trans	-63.3	147.5	177	24.1	-30.3	0	0	0	111.8	S691 T692	P689-S691 PolarHBondContact O-N 3.04Å; P689-T692 WeakPolarHBondContact CD-OG1 3.26Å; P689-T692 HydrophobicContact CG-CG2 4.13Å; P689-T692 PolarHBondContact O-N 2.95Å; P689-T692 PolarHBondContact O-OG1 2.72Å
690	V	43.1	Very low	43.4	Very low	107 Å²	107	77.4 Å²	77.4	65%	0.648	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-49	-36.3	-169.6	-178.1	0	0	0	0	113.4	T692 Q693	V690-T692 PolarHBondContact O-N 3.36Å; V690-Q693 PolarHBondContact O-N 2.71Å
691	S	40.5	Very low	43.3	Very low	114 Å²	114	77.1 Å²	77.1	80%	0.797	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.9	179.8	51.5	0	0	0	0	114.9	P689	P689-S691 PolarHBondContact O-N 3.04Å
692	T	37.5	Very low	43.2	Very low	47 Å²	47	77 Å²	77	29%	0.288	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-102.6	4.7	-174.4	58.8	0	0	0	0	113.4	F683 P689 V690	F683-T692 HydrophobicContact CD1-CG2 4.38Å; F683-T692 HydrophobicContact CE1-CG2 3.75Å; F683-T692 HydrophobicContact CE2-CG2 4.43Å; F683-T692 HydrophobicContact CZ-CG2 3.78Å; P689-T692 WeakPolarHBondContact CD-OG1 3.26Å; P689-T692 HydrophobicContact CG-CG2 4.13Å; P689-T692 PolarHBondContact O-N 2.95Å; P689-T692 PolarHBondContact O-OG1 2.72Å; V690-T692 PolarHBondContact O-N 3.36Å
693	Q	44.6	Very low	43	Very low	33 Å²	33	71.9 Å²	71.9	15%	0.154	43%	0.431	C	S	.	.			trans	-121.9	122.9	-168.8	-59.8	-168.3	-30.8	0	0	112	Y686 L687 G688 V690 R697	Y686-Q693 PolarHBondContact O-NE2 3.12Å; L687-Q693 PolarHBondContact O-NE2 2.86Å; L687-Q693 VanDerWaalsContact O-NE2 3.16Å; G688-Q693 PolarHBondContact O-NE2 3.18Å; V690-Q693 PolarHBondContact O-N 2.71Å; Q693-R697 VanDerWaalsContact OE1-CD 3.31Å
694	G	43.6	Very low	42.2	Very low	62 Å²	62	78 Å²	78	64%	0.639	45%	0.451	S	S	*	.			trans	-64.5	177.1	-175	0	0	0	0	0	115.6	G696 R697	G694-G696 PolarHBondContact O-N 2.74Å; G694-R697 PolarHBondContact O-N 2.94Å
695	K	41.9	Very low	41.6	Very low	202 Å²	202	79.2 Å²	79.2	88%	0.878	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-51.6	-22.9	-172.8	-67.9	-175.5	178.2	-179.8	0	115.5	R697 A698	K695-R697 PolarHBondContact O-N 3.06Å; K695-R697 VanDerWaalsContact O-N 3.12Å; K695-A698 PolarHBondContact O-N 2.73Å
696	G	41.8	Very low	40.6	Very low	19 Å²	19	85 Å²	85	20%	0.196	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-62.2	-13.8	179	0	0	0	0	0	115.8	G694 A698	G694-G696 PolarHBondContact O-N 2.74Å; G696-A698 VanDerWaalsContact C-N 3.25Å; G696-A698 PolarHBondContact O-N 3.07Å
697	R	44.3	Very low	39.2	Very low	61 Å²	61	87.1 Å²	87.1	23%	0.23	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-71	-14.6	177.1	-173.7	170	172.2	172	-9.5	114.2	Q693 G694 K695 G699 L700 S702	Q693-R697 VanDerWaalsContact OE1-CD 3.31Å; G694-R697 PolarHBondContact O-N 2.94Å; K695-R697 PolarHBondContact O-N 3.06Å; K695-R697 VanDerWaalsContact O-N 3.12Å; R697-G699 PolarHBondContact O-N 3.27Å; R697-L700 PolarHBondContact O-N 3.39Å; R697-S702 VanDerWaalsContact NH2-CB 3.29Å
698	A	41.9	Very low	38.3	Very low	91 Å²	91	95.1 Å²	95.1	75%	0.752	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-54.5	-20.1	-174.9	0	0	0	0	0	114.4	K695 G696	K695-A698 PolarHBondContact O-N 2.73Å; G696-A698 VanDerWaalsContact C-N 3.25Å; G696-A698 PolarHBondContact O-N 3.07Å
699	G	40.3	Very low	37.5	Very low	12 Å²	12	98.8 Å²	98.8	12%	0.124	55%	0.547	C	S	.	.	G	3₁₀ helix	trans	-91.6	-16.8	174.6	0	0	0	0	0	116.9	R656 R697	R656-G699 VanDerWaalsContact CZ-O 3.3Å; R656-G699 PolarHBondContact NH1-O 3.28Å; R656-G699 VanDerWaalsContact NH1-O 3.17Å; R656-G699 PolarHBondContact NH2-O 3.37Å; R697-G699 PolarHBondContact O-N 3.27Å
700	L	38.8	Very low	36.7	Very low	29 Å²	29	102.9 Å²	102.9	15%	0.152	56%	0.561	C	S	.	*	S	Bend	trans	-106.5	119.8	-169.8	-71.6	166.4	0	0	0	111.6	T589 Y686 R697	T589-L700 HydrophobicContact CG2-CD2 4.42Å; Y686-L700 HydrophobicContact CD1-CD1 4.26Å; R697-L700 PolarHBondContact O-N 3.39Å
701	P	40.7	Very low	36	Very low	70 Å²	70	106.4 Å²	106.4	46%	0.455	57%	0.57	S	S	.	*			trans	-60.3	143.6	177.8	22.8	-30.5	0	0	0	110.9	R703	P701-R703 PolarHBondContact O-N 3.25Å
702	S	37.2	Very low	35.5	Very low	88 Å²	88	108.7 Å²	108.7	62%	0.615	57%	0.567	S	S	*	*			trans	-55.8	115.6	-176.8	78	0	0	0	0	111.3	R697 R704	R697-S702 VanDerWaalsContact NH2-CB 3.29Å; S702-R704 PolarHBondContact O-N 3.18Å; S702-R704 VanDerWaalsContact O-N 3.12Å
703	R	37.7	Very low	35	Very low	82 Å²	82	113.4 Å²	113.4	31%	0.309	60%	0.596	S	S	.	*			trans	-72.8	103	175.4	-69.6	-175.9	175.8	-166.1	-5.1	108.4	N663 F666 P701 S705	N663-R703 PolarHBondContact OD1-NH1 2.58Å; N663-R703 PolarHBondContact OD1-NH2 2.9Å; F666-R703 VanDerWaalsContact CE2-NH2 3.29Å; P701-R703 PolarHBondContact O-N 3.25Å; R703-S705 PolarHBondContact O-N 2.94Å
704	R	28.6	Very low	34.1	Very low	240 Å²	240	117 Å²	117	91%	0.906	62%	0.62	S	S	*	*			trans	-73.1	74.8	156.6	-85.8	-172.6	178	-178.9	0.2	108	S702 Y706	S702-R704 PolarHBondContact O-N 3.18Å; S702-R704 VanDerWaalsContact O-N 3.12Å; R704-Y706 VanDerWaalsContact C-N 3.3Å; R704-Y706 PolarHBondContact O-N 2.88Å
705	S	33.3	Very low	33.3	Very low	88 Å²	88	121.5 Å²	121.5	62%	0.615	62%	0.624	S	S	*	*			trans	-92.8	69.4	168.2	48.6	0	0	0	0	108.9	R703	R703-S705 PolarHBondContact O-N 2.94Å
706	Y	27.3	Very low	32.5	Very low	209 Å²	209	124.1 Å²	124.1	82%	0.82	63%	0.629	S	S	*	*			trans	-112.7	130.4	147.6	-72.2	-80.7	0	0	0	105.4	R704 K708	R704-Y706 VanDerWaalsContact C-N 3.3Å; R704-Y706 PolarHBondContact O-N 2.88Å; Y706-K708 PolarHBondContact O-N 3.5Å
707	P	27.6	Very low	31.8	Very low	113 Å²	113	130 Å²	130	73%	0.734	65%	0.652	S	S	*	*			trans	-51.4	131	157.1	-5.3	19	0	0	0	104.7	T709	P707-T709 PolarHBondContact O-N 2.88Å
708	K	29.1	Very low	30.9	Very low	201 Å²	201	130.9 Å²	130.9	87%	0.874	68%	0.681	S	S	*	*			trans	-56.3	102.3	156.3	-75.8	-175.8	178.4	-178.3	0	103.6	Y706 M710	Y706-K708 PolarHBondContact O-N 3.5Å; K708-M710 PolarHBondContact O-N 2.71Å; K708-M710 VanDerWaalsContact O-N 3.07Å
709	T	26.2	Very low	30.2	Very low	117 Å²	117	132.1 Å²	132.1	72%	0.718	68%	0.679	S	S	*	*			trans	-42.5	123.1	157.7	3	0	0	0	0	103.8	P707 H711	P707-T709 PolarHBondContact O-N 2.88Å; T709-H711 PolarHBondContact O-N 3.27Å
710	M	25.8	Very low	29.6	Very low	176 Å²	176	137 Å²	137	87%	0.867	71%	0.711	S	S	*	*			trans	-53.2	104.6	167.2	-74.3	-177.2	94.2	0	0	103.9	K708 H712	K708-M710 PolarHBondContact O-N 2.71Å; K708-M710 VanDerWaalsContact O-N 3.07Å; M710-H712 PolarHBondContact O-N 2.99Å
711	H	28.5	Very low	29.2	Very low	181 Å²	181	144.1 Å²	144.1	84%	0.838	74%	0.744	S	S	*	*			trans	-52.5	118.1	165.1	-89.1	-77.7	0	0	0	103.5	T709 V713	T709-H711 PolarHBondContact O-N 3.27Å; H711-V713 PolarHBondContact O-N 3.35Å
712	H	29	Very low	28.8	Very low	161 Å²	161	148.3 Å²	148.3	75%	0.745	76%	0.761	S	S	*	*			trans	-40.2	133.8	174.2	-80	-90.5	0	0	0	108.2	M710 T714	M710-H712 PolarHBondContact O-N 2.99Å; H712-T714 HydrophobicContact CB-CG2 4.04Å; H712-T714 PolarHBondContact O-N 3.39Å; H712-T714 PolarHBondContact O-OG1 2.72Å
713	V	27.2	Very low	28.2	Very low	146 Å²	146	152.9 Å²	152.9	89%	0.885	78%	0.775	S	S	*	*			trans	-58.7	82	158.7	177.3	0	0	0	0	105.9	H711	H711-V713 PolarHBondContact O-N 3.35Å
714	T	25.9	Very low	27.9	Very low	110 Å²	110	160 Å²	160	68%	0.675	82%	0.819	S	S	*	*			trans	-108.5	95.9	165.8	43.3	0	0	0	0	105.9	H712	H712-T714 HydrophobicContact CB-CG2 4.04Å; H712-T714 PolarHBondContact O-N 3.39Å; H712-T714 PolarHBondContact O-OG1 2.72Å
715	H	27.1	Very low	27.8	Very low	156 Å²	156	156 Å²	156	72%	0.722	82%	0.815	S	S	*	*			trans	29	95.2	147.9	-76.8	-91.1	0	0	0	116.3	M717	H715-M717 VanDerWaalsContact C-N 3.26Å
716	R	24.7	Very low	27.5	Very low	257 Å²	257	159.6 Å²	159.6	97%	0.97	83%	0.825	S	S	*	*			trans	-88.9	75.3	137.2	-80.9	-172.3	-179.8	-177.2	-0.5	107.9
717	M	26.7	Very low	27.6	Very low	141 Å²	141	156.8 Å²	156.8	70%	0.695	83%	0.825	S	S	*	*			trans	-89	92.5	148.1	-77.9	-81	-161.6	0	0	104.6	H715 T719	H715-M717 VanDerWaalsContact C-N 3.26Å; M717-T719 VanDerWaalsContact C-N 3.3Å; M717-T719 PolarHBondContact O-N 3.24Å
718	G	24.6	Very low	27.6	Very low	80 Å²	80	159.4 Å²	159.4	83%	0.825	83%	0.831	S	S	*	*			trans	-79.4	88.4	163.3	0	0	0	0	0	107.2
719	T	28.9	Very low	27.5	Very low	118 Å²	118	156.8 Å²	156.8	72%	0.724	83%	0.828	S	S	*	*			trans	-104.8	114.3	160	45.2	0	0	0	0	107	M717 E721	M717-T719 VanDerWaalsContact C-N 3.3Å; M717-T719 PolarHBondContact O-N 3.24Å; T719-E721 PolarHBondContact O-N 3.37Å
720	S	26.4	Very low	27.5	Very low	114 Å²	114	159.5 Å²	159.5	80%	0.797	84%	0.835	S	S	*	*			trans	-70.1	104.8	168.9	49.3	0	0	0	0	110.1
721	E	30.6	Very low	27.7	Very low	178 Å²	178	158.3 Å²	158.3	83%	0.832	83%	0.833	S	S	*	*			trans	-144.6	90.1	157.8	-69.3	-172.6	163.3	0	0	105.3	T719	T719-E721 PolarHBondContact O-N 3.37Å
722	I	32.1	Very low	27.6	Very low	158 Å²	158	156.5 Å²	156.5	81%	0.81	83%	0.833	S	S	*	*				46.2	104.4	103.5	-54.9	179.2	0	0	0	111.8	D724	I722-D724 PolarHBondContact O-N 3.41Å
723	M	24.1	Very low	27.5	Very low	184 Å²	184	156.2 Å²	156.2	91%	0.906	84%	0.84	S	S	*	*			trans	-68.4	110.8	154.3	-79.3	179.7	148.9	0	0	107.9
724	D	31.5	Very low	27.5	Very low	232 Å²	232	157.1 Å²	157.1	100%	1.241	84%	0.836	S	S	*	*			trans	-170.3	0	134.3	-94.1	-18.8	0	0	0	109.7	I722	I722-D724 PolarHBondContact O-N 3.41Å

Retrieved 724 of 724 residues in 235 ms (Link to these results)

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