G4V6P0_SCHMA Loading...

Putative spfh domain / Band 7 family protein

AlphaFold DB , UniProt , Accession G4V6P0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 560 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	56.8	Low	67.3	Low	231 Å²	231	136.7 Å²	136.7	100%	1.138	65%	0.652	S	S	*	*				0	-25.8	0	-107.3	179.2	-174.2	0	0	115.7	P4	M1-P4 WeakPolarHBondContact O-CD 3.46Å
2	R	55	Low	67.8	Low	218 Å²	218	134.7 Å²	134.7	82%	0.823	64%	0.641	S	S	*	*			trans	-86.9	-9	-174.6	-74.4	-174.1	177.8	178	-0.1	117.1
3	L	60.4	Low	67.8	Low	142 Å²	142	133.4 Å²	133.4	74%	0.743	63%	0.634	S	S	*	*	H	α-helix	trans	-63.6	-42.3	-176.1	-142.7	79.9	0	0	0	115.2	I5 L6 L7	L3-I5 VanDerWaalsContact C-N 3.34Å; L3-I5 PolarHBondContact O-N 3.43Å; L3-L6 PolarHBondContact O-N 3.39Å; L3-L7 PolarHBondContact O-N 3.28Å
4	P	67.5	Low	68.3	Low	91 Å²	91	132.1 Å²	132.1	59%	0.591	63%	0.625	S	S	*	*	H	α-helix	trans	-67.1	-34.2	-176.8	-6	15.2	0	0	0	113	M1 L7 N8	M1-P4 WeakPolarHBondContact O-CD 3.46Å; P4-L7 PolarHBondContact O-N 3.1Å; P4-N8 PolarHBondContact O-N 3.37Å; P4-N8 VanDerWaalsContact O-N 3.1Å
5	I	70.7	Confident	68.6	Low	111 Å²	111	129.6 Å²	129.6	57%	0.569	62%	0.616	S	S	*	*	H	α-helix	trans	-69.4	-36.5	-177.7	-62	166.7	0	0	0	111.1	L3 R9	L3-I5 VanDerWaalsContact C-N 3.34Å; L3-I5 PolarHBondContact O-N 3.43Å; I5-R9 PolarHBondContact O-N 3Å
6	L	65.6	Low	68	Low	104 Å²	104	128.1 Å²	128.1	55%	0.545	61%	0.612	S	S	.	*	H	α-helix	trans	-70.7	-37.9	176.2	-69	179.2	0	0	0	111.7	L3 N8 R9 Y10	L3-L6 PolarHBondContact O-N 3.39Å; L6-N8 VanDerWaalsContact C-N 3.33Å; L6-N8 PolarHBondContact O-N 3.5Å; L6-R9 PolarHBondContact O-N 3.24Å; L6-Y10 PolarHBondContact O-N 3.48Å
7	L	70.2	Confident	67.8	Low	116 Å²	116	127 Å²	127	61%	0.607	61%	0.609	S	S	*	*	H	α-helix	trans	-63	-40.9	176.5	-136	88.9	0	0	0	111.6	L3 P4 Y10 N11	L3-L7 PolarHBondContact O-N 3.28Å; P4-L7 PolarHBondContact O-N 3.1Å; L7-Y10 PolarHBondContact O-N 3.01Å; L7-N11 PolarHBondContact O-N 3.08Å; L7-N11 VanDerWaalsContact O-N 3.08Å
8	N	75.4	Confident	67.7	Low	94 Å²	94	126.2 Å²	126.2	50%	0.503	60%	0.604	S	S	.	*	H	α-helix	trans	-65.3	-43.1	178.3	-162.5	53.1	0	0	0	112.2	P4 L6 Y10 N11 E12	P4-N8 PolarHBondContact O-N 3.37Å; P4-N8 VanDerWaalsContact O-N 3.1Å; L6-N8 VanDerWaalsContact C-N 3.33Å; L6-N8 PolarHBondContact O-N 3.5Å; N8-Y10 VanDerWaalsContact C-N 3.3Å; N8-Y10 PolarHBondContact O-N 3.25Å; N8-N11 PolarHBondContact O-N 3.4Å; N8-E12 PolarHBondContact O-N 3.24Å
9	R	69.4	Low	67.5	Low	149 Å²	149	125.4 Å²	125.4	56%	0.562	60%	0.6	S	S	*	*	H	α-helix	trans	-62.8	-36.8	175.7	-102.5	-164.1	-70.9	-167.3	-3	112.9	I5 L6 E12 Q13	I5-R9 PolarHBondContact O-N 3Å; L6-R9 PolarHBondContact O-N 3.24Å; R9-E12 PolarHBondContact O-N 3.48Å; R9-Q13 WeakPolarHBondContact O-CG 3.47Å; R9-Q13 PolarHBondContact O-N 3.34Å
10	Y	73.8	Confident	67	Low	164 Å²	164	125.3 Å²	125.3	64%	0.643	60%	0.602	S	S	*	*	H	α-helix	trans	-66.5	-39.8	177.1	-163.2	-94.2	0	0	0	111.6	L6 L7 N8 Q13 K14	L6-Y10 PolarHBondContact O-N 3.48Å; L7-Y10 PolarHBondContact O-N 3.01Å; N8-Y10 VanDerWaalsContact C-N 3.3Å; N8-Y10 PolarHBondContact O-N 3.25Å; Y10-Q13 PolarHBondContact O-N 2.96Å; Y10-K14 WeakPolarHBondContact O-CB 3.27Å; Y10-K14 PolarHBondContact O-N 2.98Å
11	N	75.3	Confident	66.9	Low	84 Å²	84	124.1 Å²	124.1	45%	0.449	60%	0.599	S	S	.	*	H	α-helix	trans	-66.2	-42.7	175.2	-79.3	-15.1	0	0	0	112.6	L7 N8 Q13 K14 I15	L7-N11 PolarHBondContact O-N 3.08Å; L7-N11 VanDerWaalsContact O-N 3.08Å; N8-N11 PolarHBondContact O-N 3.4Å; N11-Q13 PolarHBondContact O-N 3.33Å; N11-K14 PolarHBondContact O-N 3.05Å; N11-I15 WeakPolarHBondContact O-CG1 3.33Å; N11-I15 PolarHBondContact O-N 3.39Å
12	E	73.1	Confident	67	Low	112 Å²	112	119.9 Å²	119.9	52%	0.523	58%	0.576	S	S	.	*	H	α-helix	trans	-61.1	-43.3	174.9	-79	-175.7	174.1	0	0	112	N8 R9 K14 I15 L16	N8-E12 PolarHBondContact O-N 3.24Å; R9-E12 PolarHBondContact O-N 3.48Å; E12-K14 VanDerWaalsContact C-N 3.32Å; E12-K14 PolarHBondContact O-N 3.45Å; E12-I15 PolarHBondContact O-N 3.04Å; E12-L16 WeakPolarHBondContact O-CG 3.48Å; E12-L16 PolarHBondContact O-N 2.94Å
13	Q	68.1	Low	67.3	Low	118 Å²	118	114.4 Å²	114.4	55%	0.551	56%	0.563	S	S	*	*	H	α-helix	trans	-62.5	-39.9	175.7	-76.8	-173.6	-26.2	0	0	112.1	R9 Y10 N11 L16 I17	R9-Q13 WeakPolarHBondContact O-CG 3.47Å; R9-Q13 PolarHBondContact O-N 3.34Å; Y10-Q13 PolarHBondContact O-N 2.96Å; N11-Q13 PolarHBondContact O-N 3.33Å; Q13-L16 PolarHBondContact O-N 3.32Å; Q13-I17 VanDerWaalsContact O-CG1 3.27Å; Q13-I17 WeakPolarHBondContact O-CG1 3.5Å; Q13-I17 PolarHBondContact O-N 3.48Å
14	K	74.2	Confident	67	Low	115 Å²	115	110 Å²	110	50%	0.5	55%	0.545	S	S	.	.	H	α-helix	trans	-63	-43.4	177.2	-170.3	-179.5	176.8	-171.6	0	111.9	Y10 N11 E12 L16 I17 E18	Y10-K14 WeakPolarHBondContact O-CB 3.27Å; Y10-K14 PolarHBondContact O-N 2.98Å; N11-K14 PolarHBondContact O-N 3.05Å; E12-K14 VanDerWaalsContact C-N 3.32Å; E12-K14 PolarHBondContact O-N 3.45Å; K14-L16 VanDerWaalsContact C-N 3.34Å; K14-L16 PolarHBondContact O-N 3Å; K14-I17 PolarHBondContact O-N 3.37Å; K14-E18 WeakPolarHBondContact CE-OE1 3.43Å; K14-E18 PolarHBondContact O-N 3.46Å
15	I	73	Confident	66.5	Low	95 Å²	95	109.8 Å²	109.8	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-63.1	-41.7	177.8	-66.5	164.8	0	0	0	110.7	N11 E12 E18 Q19	N11-I15 WeakPolarHBondContact O-CG1 3.33Å; N11-I15 PolarHBondContact O-N 3.39Å; E12-I15 PolarHBondContact O-N 3.04Å; I15-E18 PolarHBondContact O-N 3.35Å; I15-Q19 WeakPolarHBondContact O-CG 3.5Å; I15-Q19 PolarHBondContact O-N 3.05Å
16	L	60	Low	66	Low	105 Å²	105	107.1 Å²	107.1	55%	0.55	53%	0.528	S	S	.	.	H	α-helix	trans	-65.9	-38.7	177.2	-73	175.1	0	0	0	112.8	E12 Q13 K14 Q19 L20	E12-L16 WeakPolarHBondContact O-CG 3.48Å; E12-L16 PolarHBondContact O-N 2.94Å; Q13-L16 PolarHBondContact O-N 3.32Å; K14-L16 VanDerWaalsContact C-N 3.34Å; K14-L16 PolarHBondContact O-N 3Å; L16-Q19 PolarHBondContact O-N 2.98Å; L16-L20 WeakPolarHBondContact O-CB 3.43Å; L16-L20 PolarHBondContact O-N 3.34Å
17	I	64.4	Low	65.6	Low	110 Å²	110	107.9 Å²	107.9	56%	0.564	53%	0.533	S	S	*	.	H	α-helix	trans	-67	-42.2	176.4	-67.8	165.9	0	0	0	110.6	Q13 K14 L20 N21	Q13-I17 VanDerWaalsContact O-CG1 3.27Å; Q13-I17 WeakPolarHBondContact O-CG1 3.5Å; Q13-I17 PolarHBondContact O-N 3.48Å; K14-I17 PolarHBondContact O-N 3.37Å; I17-L20 PolarHBondContact O-N 3.5Å; I17-N21 PolarHBondContact O-N 3.32Å
18	E	65.5	Low	65.2	Low	113 Å²	113	108.8 Å²	108.8	53%	0.528	53%	0.533	S	S	.	.	H	α-helix	trans	-63.3	-40.5	175.1	-82.8	177.4	-175.1	0	0	111.9	K14 I15 N21 H22	K14-E18 WeakPolarHBondContact CE-OE1 3.43Å; K14-E18 PolarHBondContact O-N 3.46Å; I15-E18 PolarHBondContact O-N 3.35Å; E18-N21 PolarHBondContact O-N 2.92Å; E18-H22 PolarHBondContact O-N 3.4Å
19	Q	63.3	Low	64.7	Low	111 Å²	111	108.9 Å²	108.9	52%	0.519	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-41.7	174.5	-78.4	-177.8	-28.7	0	0	112.6	I15 L16 N21 H22 N23	I15-Q19 WeakPolarHBondContact O-CG 3.5Å; I15-Q19 PolarHBondContact O-N 3.05Å; L16-Q19 PolarHBondContact O-N 2.98Å; Q19-N21 VanDerWaalsContact C-N 3.34Å; Q19-N21 PolarHBondContact O-N 3.03Å; Q19-H22 PolarHBondContact O-N 3.46Å; Q19-N23 VanDerWaalsContact O-CG 3.3Å; Q19-N23 PolarHBondContact O-N 3.41Å
20	L	58.4	Low	64.4	Low	122 Å²	122	106.3 Å²	106.3	64%	0.639	53%	0.53	S	S	*	.	H	α-helix	trans	-62.6	-41.2	175.4	-92.9	168	0	0	0	112	L16 I17 N23 S24	L16-L20 WeakPolarHBondContact O-CB 3.43Å; L16-L20 PolarHBondContact O-N 3.34Å; I17-L20 PolarHBondContact O-N 3.5Å; L20-N23 PolarHBondContact O-N 3.15Å; L20-S24 PolarHBondContact O-N 3.16Å
21	N	64.8	Low	64.1	Low	101 Å²	101	104.5 Å²	104.5	54%	0.54	53%	0.528	S	S	.	.	H	α-helix	trans	-68	-36	176.4	-113.6	5.3	0	0	0	112.4	I17 E18 Q19 N23 S24 I25	I17-N21 PolarHBondContact O-N 3.32Å; E18-N21 PolarHBondContact O-N 2.92Å; Q19-N21 VanDerWaalsContact C-N 3.34Å; Q19-N21 PolarHBondContact O-N 3.03Å; N21-N23 VanDerWaalsContact C-N 3.28Å; N21-N23 PolarHBondContact O-N 3.44Å; N21-S24 WeakPolarHBondContact CA-OG 3.42Å; N21-S24 PolarHBondContact O-N 2.96Å; N21-S24 PolarHBondContact O-OG 3.39Å; N21-I25 WeakPolarHBondContact O-CD1 3.42Å; N21-I25 VanDerWaalsContact O-CG1 3.27Å; N21-I25 WeakPolarHBondContact O-CG1 3.27Å; N21-I25 PolarHBondContact O-N 2.86Å; N21-I25 VanDerWaalsContact O-N 3.15Å
22	H	59.5	Low	63.6	Low	142 Å²	142	103.5 Å²	103.5	66%	0.657	53%	0.527	S	S	*	.	H	α-helix	trans	-65.8	-36	175.1	-129.6	-67.3	0	0	0	111.7	E18 Q19 S26	E18-H22 PolarHBondContact O-N 3.4Å; Q19-H22 PolarHBondContact O-N 3.46Å; H22-S26 PolarHBondContact O-N 3.02Å; H22-S26 VanDerWaalsContact O-N 3.16Å
23	N	60	Low	63.3	Low	103 Å²	103	100.9 Å²	100.9	55%	0.551	52%	0.522	S	S	*	.	H	α-helix	trans	-71.3	-37.8	176	-69.6	-14.2	0	0	0	112.2	Q19 L20 N21 S26 L27	Q19-N23 VanDerWaalsContact O-CG 3.3Å; Q19-N23 PolarHBondContact O-N 3.41Å; L20-N23 PolarHBondContact O-N 3.15Å; N21-N23 VanDerWaalsContact C-N 3.28Å; N21-N23 PolarHBondContact O-N 3.44Å; N23-S26 PolarHBondContact O-N 2.67Å; N23-S26 PolarHBondContact O-OG 3.49Å; N23-L27 PolarHBondContact O-N 3.23Å
24	S	54.8	Low	63.2	Low	51 Å²	51	99.9 Å²	99.9	36%	0.357	52%	0.519	S	S	.	.	H	α-helix	trans	-64.7	-41.2	176.1	60.8	0	0	0	0	112.1	L20 N21 S26 L27 E28	L20-S24 PolarHBondContact O-N 3.16Å; N21-S24 WeakPolarHBondContact CA-OG 3.42Å; N21-S24 PolarHBondContact O-N 2.96Å; N21-S24 PolarHBondContact O-OG 3.39Å; S24-S26 VanDerWaalsContact C-N 3.28Å; S24-S26 PolarHBondContact O-N 2.96Å; S24-L27 WeakPolarHBondContact O-CB 3.26Å; S24-L27 PolarHBondContact O-N 3.31Å; S24-L27 VanDerWaalsContact O-N 3.08Å; S24-E28 PolarHBondContact O-N 3.1Å
25	I	57.4	Low	62.9	Low	86 Å²	86	97.9 Å²	97.9	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-61.7	-38.6	174.1	-63.4	162.4	0	0	0	110.7	N21 L27 N29	N21-I25 WeakPolarHBondContact O-CD1 3.42Å; N21-I25 VanDerWaalsContact O-CG1 3.27Å; N21-I25 WeakPolarHBondContact O-CG1 3.27Å; N21-I25 PolarHBondContact O-N 2.86Å; N21-I25 VanDerWaalsContact O-N 3.15Å; I25-L27 VanDerWaalsContact C-N 3.3Å; I25-L27 PolarHBondContact O-N 3.45Å; I25-N29 WeakPolarHBondContact O-CB 3.46Å; I25-N29 VanDerWaalsContact O-CG 3.32Å; I25-N29 PolarHBondContact O-N 3.04Å; I25-N29 PolarHBondContact O-ND2 3.04Å
26	S	59.3	Low	62.9	Low	54 Å²	54	96.5 Å²	96.5	38%	0.378	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-35.6	175.4	80.2	0	0	0	0	112.3	H22 N23 S24 I30	H22-S26 PolarHBondContact O-N 3.02Å; H22-S26 VanDerWaalsContact O-N 3.16Å; N23-S26 PolarHBondContact O-N 2.67Å; N23-S26 PolarHBondContact O-OG 3.49Å; S24-S26 VanDerWaalsContact C-N 3.28Å; S24-S26 PolarHBondContact O-N 2.96Å; S26-I30 WeakPolarHBondContact O-CD1 3.4Å; S26-I30 WeakPolarHBondContact O-CG1 3.42Å; S26-I30 PolarHBondContact O-N 3.44Å; S26-I30 VanDerWaalsContact O-N 3.07Å
27	L	56.7	Low	63.4	Low	121 Å²	121	99.4 Å²	99.4	63%	0.634	52%	0.52	S	S	*	.	H	α-helix	trans	-70.7	-44.2	178.7	-145.7	84.9	0	0	0	111.6	N23 S24 I25 N29 I30 E31	N23-L27 PolarHBondContact O-N 3.23Å; S24-L27 WeakPolarHBondContact O-CB 3.26Å; S24-L27 PolarHBondContact O-N 3.31Å; S24-L27 VanDerWaalsContact O-N 3.08Å; I25-L27 VanDerWaalsContact C-N 3.3Å; I25-L27 PolarHBondContact O-N 3.45Å; L27-N29 VanDerWaalsContact C-N 3.32Å; L27-N29 PolarHBondContact O-N 3.16Å; L27-I30 PolarHBondContact O-N 2.89Å; L27-I30 VanDerWaalsContact O-N 3.16Å; L27-E31 PolarHBondContact O-N 2.83Å
28	E	63.2	Low	63.6	Low	134 Å²	134	100.7 Å²	100.7	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-37.2	175.1	-77.4	-173.3	164.2	0	0	112.1	S24 I30 E31 S32	S24-E28 PolarHBondContact O-N 3.1Å; E28-I30 VanDerWaalsContact C-N 3.33Å; E28-I30 PolarHBondContact O-N 3.38Å; E28-E31 PolarHBondContact O-N 2.84Å; E28-S32 WeakPolarHBondContact O-CB 3.36Å; E28-S32 PolarHBondContact O-N 3.5Å; E28-S32 PolarHBondContact O-OG 3.08Å
29	N	64.8	Low	63.9	Low	96 Å²	96	100.5 Å²	100.5	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-66.3	-35.2	174.3	-77.4	-15.1	0	0	0	112.4	I25 L27 S32 S33	I25-N29 WeakPolarHBondContact O-CB 3.46Å; I25-N29 VanDerWaalsContact O-CG 3.32Å; I25-N29 PolarHBondContact O-N 3.04Å; I25-N29 PolarHBondContact O-ND2 3.04Å; L27-N29 VanDerWaalsContact C-N 3.32Å; L27-N29 PolarHBondContact O-N 3.16Å; N29-S32 WeakPolarHBondContact CA-OG 3.22Å; N29-S32 PolarHBondContact O-OG 2.94Å; N29-S32 VanDerWaalsContact O-OG 3.1Å; N29-S33 VanDerWaalsContact O-CB 3.26Å; N29-S33 WeakPolarHBondContact O-CB 3.4Å; N29-S33 PolarHBondContact O-N 3.07Å; N29-S33 PolarHBondContact O-OG 3.44Å
30	I	63.4	Low	64.4	Low	95 Å²	95	101.2 Å²	101.2	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-70.3	-43.6	174.6	-69.9	164	0	0	0	110.1	S26 L27 E28 S33 I34	S26-I30 WeakPolarHBondContact O-CD1 3.4Å; S26-I30 WeakPolarHBondContact O-CG1 3.42Å; S26-I30 PolarHBondContact O-N 3.44Å; S26-I30 VanDerWaalsContact O-N 3.07Å; L27-I30 PolarHBondContact O-N 2.89Å; L27-I30 VanDerWaalsContact O-N 3.16Å; E28-I30 VanDerWaalsContact C-N 3.33Å; E28-I30 PolarHBondContact O-N 3.38Å; I30-S33 PolarHBondContact O-N 3.26Å; I30-I34 HydrophobicContact CG2-CD1 3.66Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CB 3.24Å; I30-I34 VanDerWaalsContact O-CG1 3.23Å; I30-I34 WeakPolarHBondContact O-CG1 3.45Å; I30-I34 PolarHBondContact O-N 2.93Å
31	E	66.6	Low	64.9	Low	127 Å²	127	99.6 Å²	99.6	59%	0.593	52%	0.523	S	S	*	.	H	α-helix	trans	-66.5	-42.3	-179.5	-163.9	174.3	-167.5	0	0	112.2	L27 E28 I34 T35	L27-E31 PolarHBondContact O-N 2.83Å; E28-E31 PolarHBondContact O-N 2.84Å; E31-I34 PolarHBondContact O-N 2.98Å; E31-T35 PolarHBondContact O-N 3.3Å; E31-T35 PolarHBondContact O-OG1 3.38Å
32	S	65.3	Low	65.3	Low	62 Å²	62	99.2 Å²	99.2	43%	0.434	52%	0.52	S	S	.	.	H	α-helix	trans	-65.9	-36.9	173.3	57.9	0	0	0	0	112.6	E28 N29 T35 S36	E28-S32 WeakPolarHBondContact O-CB 3.36Å; E28-S32 PolarHBondContact O-N 3.5Å; E28-S32 PolarHBondContact O-OG 3.08Å; N29-S32 WeakPolarHBondContact CA-OG 3.22Å; N29-S32 PolarHBondContact O-OG 2.94Å; N29-S32 VanDerWaalsContact O-OG 3.1Å; S32-T35 VanDerWaalsContact CA-OG1 3.28Å; S32-T35 WeakPolarHBondContact CA-OG1 3.28Å; S32-T35 PolarHBondContact O-OG1 2.88Å; S32-T35 VanDerWaalsContact O-OG1 3.04Å; S32-S36 VanDerWaalsContact O-CB 3.24Å; S32-S36 WeakPolarHBondContact O-CB 3.02Å; S32-S36 PolarHBondContact O-N 2.88Å
33	S	65.6	Low	66	Low	58 Å²	58	100.4 Å²	100.4	41%	0.406	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-47.2	172.9	-68	0	0	0	0	111.2	N29 I30 T35 S36 Y37	N29-S33 VanDerWaalsContact O-CB 3.26Å; N29-S33 WeakPolarHBondContact O-CB 3.4Å; N29-S33 PolarHBondContact O-N 3.07Å; N29-S33 PolarHBondContact O-OG 3.44Å; I30-S33 PolarHBondContact O-N 3.26Å; S33-T35 PolarHBondContact O-N 3.04Å; S33-S36 WeakPolarHBondContact O-CB 3.23Å; S33-S36 PolarHBondContact O-N 3.37Å; S33-Y37 WeakPolarHBondContact O-CD2 3.41Å; S33-Y37 PolarHBondContact O-N 3.01Å
34	I	66.8	Low	66.4	Low	96 Å²	96	100.4 Å²	100.4	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-60	-45.8	178.8	-70.1	166.8	0	0	0	110.6	I30 E31 Y37 F38	I30-I34 HydrophobicContact CG2-CD1 3.66Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CB 3.24Å; I30-I34 VanDerWaalsContact O-CG1 3.23Å; I30-I34 WeakPolarHBondContact O-CG1 3.45Å; I30-I34 PolarHBondContact O-N 2.93Å; E31-I34 PolarHBondContact O-N 2.98Å; I34-Y37 PolarHBondContact O-N 3.39Å; I34-F38 WeakPolarHBondContact O-CB 3.46Å; I34-F38 PolarHBondContact O-N 2.92Å
35	T	68.1	Low	67.2	Low	74 Å²	74	102.8 Å²	102.8	45%	0.454	53%	0.527	S	S	.	.	H	α-helix	trans	-66.2	-37.5	178.2	43.5	0	0	0	0	112.7	E31 S32 S33 F38 N39	E31-T35 PolarHBondContact O-N 3.3Å; E31-T35 PolarHBondContact O-OG1 3.38Å; S32-T35 VanDerWaalsContact CA-OG1 3.28Å; S32-T35 WeakPolarHBondContact CA-OG1 3.28Å; S32-T35 PolarHBondContact O-OG1 2.88Å; S32-T35 VanDerWaalsContact O-OG1 3.04Å; S33-T35 PolarHBondContact O-N 3.04Å; T35-F38 PolarHBondContact O-N 2.79Å; T35-N39 WeakPolarHBondContact O-CB 3.31Å; T35-N39 PolarHBondContact O-N 3.24Å; T35-N39 PolarHBondContact O-ND2 2.96Å
36	S	73.7	Confident	67.9	Low	65 Å²	65	106.3 Å²	106.3	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-60.5	-51.1	171.5	172.8	0	0	0	0	111.8	S32 S33 F38 N39 Q40	S32-S36 VanDerWaalsContact O-CB 3.24Å; S32-S36 WeakPolarHBondContact O-CB 3.02Å; S32-S36 PolarHBondContact O-N 2.88Å; S33-S36 WeakPolarHBondContact O-CB 3.23Å; S33-S36 PolarHBondContact O-N 3.37Å; S36-F38 VanDerWaalsContact C-N 3.32Å; S36-F38 PolarHBondContact O-N 2.84Å; S36-N39 PolarHBondContact O-N 3.48Å; S36-Q40 WeakPolarHBondContact O-CB 3.48Å; S36-Q40 PolarHBondContact O-N 3.4Å
37	Y	69.6	Low	68.4	Low	166 Å²	166	108.4 Å²	108.4	65%	0.651	55%	0.545	S	S	*	.	H	α-helix	trans	-59.1	-43.7	176.2	-77.9	-67.2	0	0	0	111	S33 I34 N39 Q40 T41	S33-Y37 WeakPolarHBondContact O-CD2 3.41Å; S33-Y37 PolarHBondContact O-N 3.01Å; I34-Y37 PolarHBondContact O-N 3.39Å; Y37-N39 PolarHBondContact O-N 2.97Å; Y37-Q40 PolarHBondContact O-N 3.45Å; Y37-T41 PolarHBondContact O-N 2.77Å; Y37-T41 PolarHBondContact O-OG1 2.9Å
38	F	69.5	Low	68.7	Low	138 Å²	138	107.3 Å²	107.3	61%	0.605	54%	0.54	S	S	*	.	H	α-helix	trans	-60	-46.9	177.4	-126.1	-86.3	0	0	0	112.3	I34 T35 S36 Q40 T41 I42	I34-F38 WeakPolarHBondContact O-CB 3.46Å; I34-F38 PolarHBondContact O-N 2.92Å; T35-F38 PolarHBondContact O-N 2.79Å; S36-F38 VanDerWaalsContact C-N 3.32Å; S36-F38 PolarHBondContact O-N 2.84Å; F38-Q40 VanDerWaalsContact C-N 3.32Å; F38-Q40 PolarHBondContact O-N 3.42Å; F38-T41 PolarHBondContact O-N 3.31Å; F38-I42 HydrophobicContact CD1-CD1 4.09Å; F38-I42 VanDerWaalsContact O-CG1 3.31Å; F38-I42 WeakPolarHBondContact O-CG1 3.46Å; F38-I42 PolarHBondContact O-N 3.44Å
39	N	70.2	Confident	68.9	Low	109 Å²	109	104 Å²	104	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-64	-37.3	177.4	-83	-31.8	0	0	0	112.2	T35 S36 Y37 I42 K43	T35-N39 WeakPolarHBondContact O-CB 3.31Å; T35-N39 PolarHBondContact O-N 3.24Å; T35-N39 PolarHBondContact O-ND2 2.96Å; S36-N39 PolarHBondContact O-N 3.48Å; Y37-N39 PolarHBondContact O-N 2.97Å; N39-I42 PolarHBondContact O-N 3.27Å; N39-K43 WeakPolarHBondContact O-CB 3.43Å; N39-K43 PolarHBondContact O-N 3.47Å
40	Q	74.9	Confident	69.2	Low	125 Å²	125	105.2 Å²	105.2	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-67.7	-41.3	176.4	-170.4	138.3	-12.4	0	0	111.9	S36 Y37 F38 K43 L44	S36-Q40 WeakPolarHBondContact O-CB 3.48Å; S36-Q40 PolarHBondContact O-N 3.4Å; Y37-Q40 PolarHBondContact O-N 3.45Å; F38-Q40 VanDerWaalsContact C-N 3.32Å; F38-Q40 PolarHBondContact O-N 3.42Å; Q40-K43 PolarHBondContact O-N 2.94Å; Q40-L44 HydrophobicContact CG-CD1 4.48Å; Q40-L44 PolarHBondContact O-N 3.23Å
41	T	68.9	Low	69	Low	89 Å²	89	106.1 Å²	106.1	55%	0.546	53%	0.531	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.1	-42.1	0	0	0	0	111.3	Y37 F38 K43 L44 F45	Y37-T41 PolarHBondContact O-N 2.77Å; Y37-T41 PolarHBondContact O-OG1 2.9Å; F38-T41 PolarHBondContact O-N 3.31Å; T41-K43 VanDerWaalsContact C-N 3.31Å; T41-K43 PolarHBondContact O-N 2.87Å; T41-L44 PolarHBondContact O-N 3.01Å; T41-F45 VanDerWaalsContact O-CB 3.3Å; T41-F45 WeakPolarHBondContact O-CB 3.47Å; T41-F45 PolarHBondContact O-N 3.15Å
42	I	73.2	Confident	68.7	Low	92 Å²	92	105.7 Å²	105.7	47%	0.472	53%	0.53	S	S	.	.	H	α-helix	trans	-60.4	-42	173.7	-70.5	168.4	0	0	0	110.7	F38 N39 F45 K46	F38-I42 HydrophobicContact CD1-CD1 4.09Å; F38-I42 VanDerWaalsContact O-CG1 3.31Å; F38-I42 WeakPolarHBondContact O-CG1 3.46Å; F38-I42 PolarHBondContact O-N 3.44Å; N39-I42 PolarHBondContact O-N 3.27Å; I42-F45 PolarHBondContact O-N 3.3Å; I42-K46 WeakPolarHBondContact O-CB 3.46Å; I42-K46 PolarHBondContact O-N 2.93Å
43	K	74.1	Confident	68.7	Low	167 Å²	167	106.9 Å²	106.9	73%	0.726	53%	0.531	S	S	*	.	H	α-helix	trans	-66.6	-42.5	179.8	-157.1	176.5	-174.3	-178.6	0	112	N39 Q40 T41 K46 L47	N39-K43 WeakPolarHBondContact O-CB 3.43Å; N39-K43 PolarHBondContact O-N 3.47Å; Q40-K43 PolarHBondContact O-N 2.94Å; T41-K43 VanDerWaalsContact C-N 3.31Å; T41-K43 PolarHBondContact O-N 2.87Å; K43-K46 PolarHBondContact O-N 2.87Å; K43-L47 PolarHBondContact O-N 2.89Å
44	L	67.7	Low	68.5	Low	103 Å²	103	107.1 Å²	107.1	54%	0.539	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-40.2	173.3	-79.9	165.5	0	0	0	111.8	Q40 T41 L47 N48	Q40-L44 HydrophobicContact CG-CD1 4.48Å; Q40-L44 PolarHBondContact O-N 3.23Å; T41-L44 PolarHBondContact O-N 3.01Å; L44-L47 PolarHBondContact O-N 3.32Å; L44-N48 PolarHBondContact O-N 2.86Å
45	F	73.2	Confident	68	Low	102 Å²	102	107.3 Å²	107.3	45%	0.447	53%	0.53	S	S	.	.	H	α-helix	trans	-65.7	-41.9	177.4	-160.7	-101.4	0	0	0	111.7	T41 I42 L47 N48 I49 L248	T41-F45 VanDerWaalsContact O-CB 3.3Å; T41-F45 WeakPolarHBondContact O-CB 3.47Å; T41-F45 PolarHBondContact O-N 3.15Å; I42-F45 PolarHBondContact O-N 3.3Å; F45-L47 VanDerWaalsContact C-N 3.3Å; F45-L47 PolarHBondContact O-N 3.26Å; F45-N48 PolarHBondContact O-N 3.32Å; F45-I49 HydrophobicContact CD1-CD1 3.7Å; F45-I49 HydrophobicContact CD1-CG1 4.3Å; F45-I49 HydrophobicContact CE1-CD1 3.53Å; F45-I49 HydrophobicContact CE1-CG1 4.18Å; F45-I49 HydrophobicContact CZ-CD1 4.48Å; F45-I49 PolarHBondContact O-N 3.36Å; F45-L248 HydrophobicContact CE1-CD2 4.4Å
46	K	70.4	Confident	67.4	Low	159 Å²	159	110 Å²	110	69%	0.691	54%	0.537	S	S	*	.	H	α-helix	trans	-63.8	-36.4	175.8	-152.6	174.3	-171.2	179	0	111.9	I42 K43 F50	I42-K46 WeakPolarHBondContact O-CB 3.46Å; I42-K46 PolarHBondContact O-N 2.93Å; K43-K46 PolarHBondContact O-N 2.87Å; K46-F50 WeakPolarHBondContact O-CB 3.37Å; K46-F50 PolarHBondContact O-N 2.89Å
47	L	70.8	Confident	66.4	Low	98 Å²	98	112 Å²	112	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-67.1	-42.9	173	-173.1	68.4	0	0	0	111.6	K43 L44 F45 F50 M51	K43-L47 PolarHBondContact O-N 2.89Å; L44-L47 PolarHBondContact O-N 3.32Å; F45-L47 VanDerWaalsContact C-N 3.3Å; F45-L47 PolarHBondContact O-N 3.26Å; L47-F50 PolarHBondContact O-N 3.35Å; L47-M51 WeakPolarHBondContact O-CB 3.41Å; L47-M51 VanDerWaalsContact O-CG 3.24Å; L47-M51 WeakPolarHBondContact O-CG 3.33Å; L47-M51 PolarHBondContact O-N 2.86Å
48	N	63.3	Low	65.5	Low	98 Å²	98	106.4 Å²	106.4	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-64.9	-40.9	177.3	-91.3	-17.8	0	0	0	112.6	L44 F45 F50 M51 M52	L44-N48 PolarHBondContact O-N 2.86Å; F45-N48 PolarHBondContact O-N 3.32Å; N48-F50 VanDerWaalsContact C-N 3.35Å; N48-M51 PolarHBondContact O-N 3.31Å; N48-M52 VanDerWaalsContact O-CG 3.3Å; N48-M52 WeakPolarHBondContact O-CG 3.36Å; N48-M52 PolarHBondContact O-N 3.04Å
49	I	66.9	Low	64.6	Low	65 Å²	65	104.2 Å²	104.2	33%	0.333	52%	0.519	S	S	.	.	H	α-helix	trans	-59.6	-48.2	172.5	-71.7	174.7	0	0	0	109.9	F45 M51 M52 D53	F45-I49 HydrophobicContact CD1-CD1 3.7Å; F45-I49 HydrophobicContact CD1-CG1 4.3Å; F45-I49 HydrophobicContact CE1-CD1 3.53Å; F45-I49 HydrophobicContact CE1-CG1 4.18Å; F45-I49 HydrophobicContact CZ-CD1 4.48Å; F45-I49 PolarHBondContact O-N 3.36Å; I49-M51 VanDerWaalsContact C-N 3.29Å; I49-M51 PolarHBondContact O-N 2.92Å; I49-M52 PolarHBondContact O-N 3.42Å; I49-M52 VanDerWaalsContact O-N 3.14Å; I49-D53 PolarHBondContact O-N 3.17Å
50	F	70.2	Confident	63.5	Low	122 Å²	122	104.5 Å²	104.5	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-60.5	-37.2	177.9	-177.4	-105.5	0	0	0	112.8	K46 L47 N48 N54	K46-F50 WeakPolarHBondContact O-CB 3.37Å; K46-F50 PolarHBondContact O-N 2.89Å; L47-F50 PolarHBondContact O-N 3.35Å; N48-F50 VanDerWaalsContact C-N 3.35Å; F50-N54 WeakPolarHBondContact CD1-ND2 3.3Å; F50-N54 WeakPolarHBondContact CE1-ND2 3.33Å; F50-N54 WeakPolarHBondContact CZ-ND2 3.48Å; F50-N54 WeakPolarHBondContact O-CB 3.31Å; F50-N54 VanDerWaalsContact O-CG 3.27Å; F50-N54 PolarHBondContact O-N 3.34Å; F50-N54 PolarHBondContact O-ND2 3.36Å; F50-N54 VanDerWaalsContact O-ND2 3.08Å
51	M	60.1	Low	62.4	Low	113 Å²	113	104.9 Å²	104.9	56%	0.557	52%	0.52	S	S	*	.	H	α-helix	trans	-68.4	-39.2	175.4	-72	-72.8	-73.3	0	0	112.1	L47 N48 I49 L55	L47-M51 WeakPolarHBondContact O-CB 3.41Å; L47-M51 VanDerWaalsContact O-CG 3.24Å; L47-M51 WeakPolarHBondContact O-CG 3.33Å; L47-M51 PolarHBondContact O-N 2.86Å; N48-M51 PolarHBondContact O-N 3.31Å; I49-M51 VanDerWaalsContact C-N 3.29Å; I49-M51 PolarHBondContact O-N 2.92Å; M51-L55 WeakPolarHBondContact O-CB 3.41Å; M51-L55 PolarHBondContact O-N 3.38Å
52	M	60.3	Low	61.5	Low	119 Å²	119	104 Å²	104	59%	0.586	51%	0.514	S	S	*	.	H	α-helix	trans	-69.7	-42.8	177.6	-69.5	-65.5	177.7	0	0	111.8	N48 I49 N54 L55 E56	N48-M52 VanDerWaalsContact O-CG 3.3Å; N48-M52 WeakPolarHBondContact O-CG 3.36Å; N48-M52 PolarHBondContact O-N 3.04Å; I49-M52 PolarHBondContact O-N 3.42Å; I49-M52 VanDerWaalsContact O-N 3.14Å; M52-N54 PolarHBondContact O-N 2.96Å; M52-L55 WeakPolarHBondContact O-CB 3.43Å; M52-L55 PolarHBondContact O-N 3.23Å; M52-L55 VanDerWaalsContact O-N 3.16Å; M52-E56 PolarHBondContact O-N 2.95Å
53	D	65.4	Low	60.2	Low	86 Å²	86	106.6 Å²	106.6	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-62.4	-42.9	175.5	-74	-15.7	0	0	0	111.1	I49 L55 E56 Q57	I49-D53 PolarHBondContact O-N 3.17Å; D53-L55 VanDerWaalsContact C-N 3.34Å; D53-L55 PolarHBondContact O-N 3.43Å; D53-E56 PolarHBondContact O-N 3.43Å; D53-Q57 WeakPolarHBondContact O-CB 3.34Å; D53-Q57 PolarHBondContact O-N 2.89Å
54	N	62.1	Low	58.6	Low	64 Å²	64	105.2 Å²	105.2	34%	0.342	52%	0.521	S	S	.	.	H	α-helix	trans	-65	-36.7	173.8	-76.8	-33.2	0	0	0	112.2	F50 M52 Q57 S58	F50-N54 WeakPolarHBondContact CD1-ND2 3.3Å; F50-N54 WeakPolarHBondContact CE1-ND2 3.33Å; F50-N54 WeakPolarHBondContact CZ-ND2 3.48Å; F50-N54 WeakPolarHBondContact O-CB 3.31Å; F50-N54 VanDerWaalsContact O-CG 3.27Å; F50-N54 PolarHBondContact O-N 3.34Å; F50-N54 PolarHBondContact O-ND2 3.36Å; F50-N54 VanDerWaalsContact O-ND2 3.08Å; M52-N54 PolarHBondContact O-N 2.96Å; N54-Q57 PolarHBondContact O-N 2.94Å; N54-S58 WeakPolarHBondContact O-CB 3.34Å; N54-S58 PolarHBondContact O-N 3.34Å; N54-S58 PolarHBondContact O-OG 3.47Å
55	L	54.5	Low	57.4	Low	99 Å²	99	103 Å²	103	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-65.6	-42.9	176.1	-163.8	78.3	0	0	0	110.5	M51 M52 D53 S58 N59	M51-L55 WeakPolarHBondContact O-CB 3.41Å; M51-L55 PolarHBondContact O-N 3.38Å; M52-L55 WeakPolarHBondContact O-CB 3.43Å; M52-L55 PolarHBondContact O-N 3.23Å; M52-L55 VanDerWaalsContact O-N 3.16Å; D53-L55 VanDerWaalsContact C-N 3.34Å; D53-L55 PolarHBondContact O-N 3.43Å; L55-S58 PolarHBondContact O-N 3.49Å; L55-S58 PolarHBondContact O-OG 3.35Å; L55-N59 WeakPolarHBondContact O-CB 3.48Å; L55-N59 VanDerWaalsContact O-CG 3.25Å; L55-N59 PolarHBondContact O-N 2.86Å; L55-N59 PolarHBondContact O-ND2 3.01Å; L55-N59 VanDerWaalsContact O-ND2 3.15Å
56	E	56	Low	56	Low	132 Å²	132	103.3 Å²	103.3	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-63	-43.4	173.7	-72.9	-163.7	173.1	0	0	112.1	M52 D53 N59 M60	M52-E56 PolarHBondContact O-N 2.95Å; D53-E56 PolarHBondContact O-N 3.43Å; E56-N59 PolarHBondContact O-N 3.45Å; E56-M60 WeakPolarHBondContact O-CB 3.35Å; E56-M60 PolarHBondContact O-N 2.95Å
57	Q	53.9	Low	54.6	Low	105 Å²	105	99.2 Å²	99.2	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-41.9	175	-93.4	165	-33.4	0	0	112.2	D53 N54 N59 M60 E61	D53-Q57 WeakPolarHBondContact O-CB 3.34Å; D53-Q57 PolarHBondContact O-N 2.89Å; N54-Q57 PolarHBondContact O-N 2.94Å; Q57-N59 VanDerWaalsContact C-N 3.33Å; Q57-N59 PolarHBondContact O-N 2.86Å; Q57-M60 CarbonylContact O-C 3.5Å; Q57-M60 WeakPolarHBondContact O-CB 3.3Å; Q57-M60 PolarHBondContact O-N 3.43Å; Q57-M60 VanDerWaalsContact O-N 3.1Å; Q57-E61 WeakPolarHBondContact O-CB 3.33Å; Q57-E61 WeakPolarHBondContact O-CG 3.32Å; Q57-E61 PolarHBondContact O-N 3.33Å
58	S	49.6	Very low	53.3	Low	49 Å²	49	99.8 Å²	99.8	34%	0.343	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-37.7	176.4	76.1	0	0	0	0	112	N54 L55 M60 E61 T62	N54-S58 WeakPolarHBondContact O-CB 3.34Å; N54-S58 PolarHBondContact O-N 3.34Å; N54-S58 PolarHBondContact O-OG 3.47Å; L55-S58 PolarHBondContact O-N 3.49Å; L55-S58 PolarHBondContact O-OG 3.35Å; S58-M60 VanDerWaalsContact C-N 3.34Å; S58-E61 PolarHBondContact O-N 2.89Å; S58-T62 WeakPolarHBondContact O-CB 3.46Å; S58-T62 VanDerWaalsContact O-CG2 3.29Å; S58-T62 WeakPolarHBondContact O-CG2 3.21Å; S58-T62 PolarHBondContact O-N 3.25Å; S58-T62 PolarHBondContact O-OG1 2.96Å
59	N	51.9	Low	52	Low	92 Å²	92	101.1 Å²	101.1	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-35.5	172.6	-71.5	-31	0	0	0	112	L55 E56 Q57 T62 M63	L55-N59 WeakPolarHBondContact O-CB 3.48Å; L55-N59 VanDerWaalsContact O-CG 3.25Å; L55-N59 PolarHBondContact O-N 2.86Å; L55-N59 PolarHBondContact O-ND2 3.01Å; L55-N59 VanDerWaalsContact O-ND2 3.15Å; E56-N59 PolarHBondContact O-N 3.45Å; Q57-N59 VanDerWaalsContact C-N 3.33Å; Q57-N59 PolarHBondContact O-N 2.86Å; N59-T62 WeakPolarHBondContact CA-OG1 3.02Å; N59-T62 PolarHBondContact O-OG1 3.15Å; N59-M63 WeakPolarHBondContact O-CG 3.47Å; N59-M63 PolarHBondContact O-N 3.26Å
60	M	45.7	Very low	50.6	Low	115 Å²	115	106.3 Å²	106.3	57%	0.567	54%	0.541	S	S	*	.	H	α-helix	trans	-73.9	-36.6	177.4	-142.8	-174.9	-48.7	0	0	112.3	E56 Q57 S58 M63 K64	E56-M60 WeakPolarHBondContact O-CB 3.35Å; E56-M60 PolarHBondContact O-N 2.95Å; Q57-M60 CarbonylContact O-C 3.5Å; Q57-M60 WeakPolarHBondContact O-CB 3.3Å; Q57-M60 PolarHBondContact O-N 3.43Å; Q57-M60 VanDerWaalsContact O-N 3.1Å; S58-M60 VanDerWaalsContact C-N 3.34Å; M60-M63 PolarHBondContact O-N 3.07Å; M60-K64 PolarHBondContact O-N 2.98Å
61	E	51.7	Low	48.9	Very low	133 Å²	133	103.2 Å²	103.2	62%	0.621	53%	0.534	S	S	*	.	H	α-helix	trans	-72.1	-41.4	176.8	-76.7	-177.2	176	0	0	111.8	Q57 S58 M63 K64 S65	Q57-E61 WeakPolarHBondContact O-CB 3.33Å; Q57-E61 WeakPolarHBondContact O-CG 3.32Å; Q57-E61 PolarHBondContact O-N 3.33Å; S58-E61 PolarHBondContact O-N 2.89Å; E61-M63 VanDerWaalsContact C-N 3.26Å; E61-M63 PolarHBondContact O-N 3.14Å; E61-K64 CarbonylContact O-C 3.58Å; E61-K64 WeakPolarHBondContact O-CA 3.37Å; E61-K64 PolarHBondContact O-N 3.47Å; E61-S65 PolarHBondContact O-N 3.04Å; E61-S65 PolarHBondContact O-OG 2.94Å
62	T	49.7	Very low	47.7	Very low	70 Å²	70	104 Å²	104	43%	0.429	54%	0.541	S	S	.	.	H	α-helix	trans	-62.2	-34.6	172	49.3	0	0	0	0	111.8	S58 N59 S65 N66	S58-T62 WeakPolarHBondContact O-CB 3.46Å; S58-T62 VanDerWaalsContact O-CG2 3.29Å; S58-T62 WeakPolarHBondContact O-CG2 3.21Å; S58-T62 PolarHBondContact O-N 3.25Å; S58-T62 PolarHBondContact O-OG1 2.96Å; N59-T62 WeakPolarHBondContact CA-OG1 3.02Å; N59-T62 PolarHBondContact O-OG1 3.15Å; T62-S65 WeakPolarHBondContact CA-OG 3.39Å; T62-S65 PolarHBondContact O-OG 2.97Å; T62-N66 VanDerWaalsContact O-CB 3.26Å; T62-N66 WeakPolarHBondContact O-CB 3.31Å; T62-N66 PolarHBondContact O-N 3.37Å; T62-N66 VanDerWaalsContact O-N 3.13Å; T62-N66 PolarHBondContact O-ND2 3.35Å; T62-N66 VanDerWaalsContact O-ND2 3.14Å
63	M	45.8	Very low	46.3	Very low	148 Å²	148	106.7 Å²	106.7	73%	0.729	55%	0.552	S	S	*	*	H	α-helix	trans	-66.4	-36.7	169.4	-80.6	-168.8	163.5	0	0	113.2	N59 M60 E61 S67	N59-M63 WeakPolarHBondContact O-CG 3.47Å; N59-M63 PolarHBondContact O-N 3.26Å; M60-M63 PolarHBondContact O-N 3.07Å; E61-M63 VanDerWaalsContact C-N 3.26Å; E61-M63 PolarHBondContact O-N 3.14Å; M63-S67 PolarHBondContact O-N 2.8Å; M63-S67 PolarHBondContact O-OG 3.43Å
64	K	41	Very low	44.5	Very low	138 Å²	138	107.8 Å²	107.8	60%	0.6	56%	0.562	S	S	*	*	H	α-helix	trans	-74	-40	176.3	-92.5	-177.9	176.1	176.4	0	113.6	M60 E61 N66 S67 L68	M60-K64 PolarHBondContact O-N 2.98Å; E61-K64 CarbonylContact O-C 3.58Å; E61-K64 WeakPolarHBondContact O-CA 3.37Å; E61-K64 PolarHBondContact O-N 3.47Å; K64-N66 VanDerWaalsContact C-N 3.33Å; K64-S67 PolarHBondContact O-N 3.02Å; K64-S67 PolarHBondContact O-OG 3.07Å; K64-L68 PolarHBondContact O-N 3.24Å
65	S	43.9	Very low	42.9	Very low	55 Å²	55	113.3 Å²	113.3	39%	0.385	59%	0.586	S	S	.	*	H	α-helix	trans	-67.4	-38.6	177.6	60.8	0	0	0	0	110.7	E61 T62 S67 L68 L69	E61-S65 PolarHBondContact O-N 3.04Å; E61-S65 PolarHBondContact O-OG 2.94Å; T62-S65 WeakPolarHBondContact CA-OG 3.39Å; T62-S65 PolarHBondContact O-OG 2.97Å; S65-S67 PolarHBondContact O-N 3.44Å; S65-L68 PolarHBondContact O-N 2.85Å; S65-L69 WeakPolarHBondContact O-CB 3.24Å; S65-L69 PolarHBondContact O-N 2.9Å
66	N	43.3	Very low	41.7	Very low	109 Å²	109	114.3 Å²	114.3	58%	0.583	60%	0.601	S	S	*	*	H	α-helix	trans	-69.2	-21	175.9	-68.2	-12.6	0	0	0	112.9	T62 K64	T62-N66 VanDerWaalsContact O-CB 3.26Å; T62-N66 WeakPolarHBondContact O-CB 3.31Å; T62-N66 PolarHBondContact O-N 3.37Å; T62-N66 VanDerWaalsContact O-N 3.13Å; T62-N66 PolarHBondContact O-ND2 3.35Å; T62-N66 VanDerWaalsContact O-ND2 3.14Å; K64-N66 VanDerWaalsContact C-N 3.33Å
67	S	41	Very low	40.5	Very low	74 Å²	74	115 Å²	115	52%	0.517	61%	0.614	S	S	.	*	H	α-helix	trans	-87	-36.2	171	67	0	0	0	0	113	M63 K64 S65 K70	M63-S67 PolarHBondContact O-N 2.8Å; M63-S67 PolarHBondContact O-OG 3.43Å; K64-S67 PolarHBondContact O-N 3.02Å; K64-S67 PolarHBondContact O-OG 3.07Å; S65-S67 PolarHBondContact O-N 3.44Å; S67-K70 PolarHBondContact O-N 2.85Å
68	L	42.2	Very low	39.3	Very low	109 Å²	109	114.9 Å²	114.9	57%	0.571	63%	0.625	S	S	*	*	H	α-helix	trans	-72.5	-34.1	176	-86.9	169.6	0	0	0	113.5	K64 S65 K70 S71	K64-L68 PolarHBondContact O-N 3.24Å; S65-L68 PolarHBondContact O-N 2.85Å; L68-K70 PolarHBondContact O-N 3.33Å; L68-S71 PolarHBondContact O-N 3.37Å; L68-S71 PolarHBondContact O-OG 3.46Å
69	L	37.8	Very low	38.3	Very low	126 Å²	126	122.1 Å²	122.1	66%	0.66	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-14.6	173.4	-99.3	164.7	0	0	0	113.1	S65	S65-L69 WeakPolarHBondContact O-CB 3.24Å; S65-L69 PolarHBondContact O-N 2.9Å
70	K	37.5	Very low	37.2	Very low	175 Å²	175	124.8 Å²	124.8	76%	0.761	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-13.2	173.2	-84	179.4	174.2	176.5	0	114.6	S67 L68	S67-K70 PolarHBondContact O-N 2.85Å; L68-K70 PolarHBondContact O-N 3.33Å
71	S	32.6	Very low	36.5	Very low	56 Å²	56	125 Å²	125	39%	0.392	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.4	-27.4	178.7	54.8	0	0	0	0	113.7	L68 T74	L68-S71 PolarHBondContact O-N 3.37Å; L68-S71 PolarHBondContact O-OG 3.46Å; S71-T74 PolarHBondContact O-OG1 3.28Å
72	D	35.4	Very low	35.3	Very low	130 Å²	130	127.7 Å²	127.7	70%	0.695	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-9.4	-168.3	-70.4	-1	0	0	0	114.5	T74	D72-T74 PolarHBondContact O-N 3.21Å; D72-T74 VanDerWaalsContact O-N 3.13Å
73	E	31	Very low	34.6	Very low	175 Å²	175	130.3 Å²	130.3	82%	0.818	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	4	177.4	-70.8	-170.4	157.6	0	0	114.3
74	T	28.5	Very low	33.9	Very low	109 Å²	109	128.7 Å²	128.7	67%	0.669	71%	0.705	S	S	*	*	S	Bend	trans	-114	46.5	-177.8	59.8	0	0	0	0	114	S71 D72	S71-T74 PolarHBondContact O-OG1 3.28Å; D72-T74 PolarHBondContact O-N 3.21Å; D72-T74 VanDerWaalsContact O-N 3.13Å
75	Q	28.9	Very low	33.4	Very low	180 Å²	180	130.6 Å²	130.6	84%	0.841	72%	0.721	S	S	*	*	S	Bend	trans	-164.9	85.5	167	-109.4	156.9	69.4	0	0	113.3
76	S	28.2	Very low	32.6	Very low	120 Å²	120	132.2 Å²	132.2	84%	0.839	73%	0.732	S	S	*	*			trans	169.2	94.4	140.6	49.8	0	0	0	0	111.7
77	V	32.1	Very low	32	Very low	147 Å²	147	135.8 Å²	135.8	89%	0.891	75%	0.745	S	S	*	*			trans	-125.1	106	155.7	-179.6	0	0	0	0	107.7
78	S	27.8	Very low	31.5	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	76%	0.764	S	S	*	*			trans	-61	136.4	179.3	-176.9	0	0	0	0	111.4	N80	S78-N80 PolarHBondContact O-N 3.4Å
79	K	28	Very low	30.9	Very low	201 Å²	201	141.8 Å²	141.8	87%	0.874	78%	0.776	S	S	*	*			trans	-75	107.2	174.9	-69.1	175.3	176.7	177	0	109.3
80	N	29.7	Very low	30.4	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-95.3	135.7	163.5	-84.1	-6.1	0	0	0	111	S78	S78-N80 PolarHBondContact O-N 3.4Å
81	P	29.9	Very low	30.4	Very low	118 Å²	118	141.2 Å²	141.2	77%	0.766	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-80.2	142.5	-168.5	30.9	-34	0	0	0	113.5
82	M	26.9	Very low	30.7	Very low	190 Å²	190	147.5 Å²	147.5	94%	0.936	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-72.2	120.2	-175.2	-158.5	147.6	174.5	0	0	111.1
83	V	35.1	Very low	30.9	Very low	126 Å²	126	151 Å²	151	76%	0.764	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.5	132.6	172.7	-180	0	0	0	0	109.4
84	P	31	Very low	31.6	Very low	113 Å²	113	148 Å²	148	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-75	132.1	-170.9	-15.3	31	0	0	0	114.3	S86	P84-S86 PolarHBondContact O-N 3.42Å
85	L	31.6	Very low	32.5	Very low	178 Å²	178	153 Å²	153	93%	0.932	83%	0.826	S	S	*	*			trans	-71.9	111.3	166.7	-99.7	76.5	0	0	0	110.2
86	S	27.4	Very low	33.8	Very low	89 Å²	89	148.4 Å²	148.4	62%	0.622	81%	0.81	S	S	*	*			trans	-157.1	39.9	166.1	70.2	0	0	0	0	115.9	P84	P84-S86 PolarHBondContact O-N 3.42Å
87	H	29.9	Very low	35.9	Very low	185 Å²	185	148.8 Å²	148.8	86%	0.856	80%	0.803	S	S	*	*			trans	-143.3	144	161.2	-72.5	-64.6	0	0	0	111.8
88	L	30	Very low	38	Very low	173 Å²	173	146.8 Å²	146.8	91%	0.906	79%	0.793	S	S	*	*			trans	98	69.2	175.6	-56.8	163.1	0	0	0	115.6
89	T	29.2	Very low	40	Very low	135 Å²	135	148 Å²	148	83%	0.828	79%	0.79	S	S	*	*			trans	-64.2	149.2	145.4	45.8	0	0	0	0	110.9
90	N	28.4	Very low	42.3	Very low	148 Å²	148	140.2 Å²	140.2	79%	0.791	77%	0.767	S	S	*	*			trans	87	84.1	157.7	-140.2	8.3	0	0	0	118.3
91	T	37.1	Very low	44.4	Very low	141 Å²	141	136.4 Å²	136.4	87%	0.865	75%	0.747	S	S	*	*			trans	-132.3	115	149.1	47.8	0	0	0	0	109.3
92	K	38.3	Very low	46.7	Very low	188 Å²	188	135.3 Å²	135.3	82%	0.817	74%	0.738	S	S	*	*			trans	-45.4	144	172.7	-73.1	173.3	172.4	178.3	0	111.8	V94	K92-V94 PolarHBondContact O-N 2.99Å
93	E	40.2	Very low	49	Very low	203 Å²	203	130.7 Å²	130.7	95%	0.949	72%	0.716	S	S	*	*			trans	-51	98.2	178	-63.2	176.6	160.2	0	0	111.9
94	V	46	Very low	51	Low	114 Å²	114	126.7 Å²	126.7	69%	0.691	70%	0.696	S	S	*	*			trans	-95.1	120	160.4	179.6	0	0	0	0	106.1	K92 T96	K92-V94 PolarHBondContact O-N 2.99Å; V94-T96 HydrophobicContact CB-CG2 4.47Å; V94-T96 HydrophobicContact CG1-CG2 4.06Å; V94-T96 PolarHBondContact O-N 2.89Å
95	K	47.8	Very low	53.2	Low	214 Å²	214	127.4 Å²	127.4	93%	0.93	69%	0.688	S	S	*	*			trans	-65.1	80.2	176.9	-162.9	179.1	-172.3	-178.2	0	108.9
96	T	54.9	Low	55.5	Low	83 Å²	83	127.4 Å²	127.4	51%	0.509	68%	0.675	S	S	.	*			trans	-89.4	131.8	177.4	51	0	0	0	0	109.8	V94	V94-T96 HydrophobicContact CB-CG2 4.47Å; V94-T96 HydrophobicContact CG1-CG2 4.06Å; V94-T96 PolarHBondContact O-N 2.89Å
97	D	72.8	Confident	57.8	Low	127 Å²	127	129.2 Å²	129.2	68%	0.679	67%	0.672	S	S	*	*			trans	-47.2	142.9	176.6	-66.4	-34.6	0	0	0	112.4	L99 G100 L101	D97-L99 PolarHBondContact O-N 3.2Å; D97-G100 WeakPolarHBondContact O-CA 3.4Å; D97-G100 PolarHBondContact O-N 3.43Å; D97-L101 PolarHBondContact O-N 3.03Å
98	P	76.3	Confident	60	Low	106 Å²	106	128.9 Å²	128.9	69%	0.688	66%	0.663	S	S	*	*	H	α-helix	trans	-57.6	-36.5	-175.3	21.3	-32.3	0	0	0	112.4	L101 V102	P98-L101 PolarHBondContact O-N 3.15Å; P98-V102 WeakPolarHBondContact O-CG2 3.3Å; P98-V102 PolarHBondContact O-N 2.84Å
99	L	69.2	Low	62.1	Low	127 Å²	127	128.9 Å²	128.9	67%	0.665	66%	0.656	S	S	*	*	H	α-helix	trans	-66.2	-43.6	176.3	-170.5	68	0	0	0	111.8	D97 L101 V102 I103	D97-L99 PolarHBondContact O-N 3.2Å; L99-L101 VanDerWaalsContact C-N 3.27Å; L99-L101 PolarHBondContact O-N 3.08Å; L99-V102 PolarHBondContact O-N 2.85Å; L99-I103 HydrophobicContact CG-CD1 4.09Å; L99-I103 VanDerWaalsContact O-CG1 3.29Å; L99-I103 WeakPolarHBondContact O-CG1 3.36Å; L99-I103 PolarHBondContact O-N 3.32Å
100	G	76.6	Confident	64	Low	38 Å²	38	126.3 Å²	126.3	39%	0.392	63%	0.634	S	S	.	*	H	α-helix	trans	-61.2	-37.4	175.5	0	0	0	0	0	112	D97 I103 A104	D97-G100 WeakPolarHBondContact O-CA 3.4Å; D97-G100 PolarHBondContact O-N 3.43Å; G100-I103 PolarHBondContact O-N 3.29Å; G100-A104 VanDerWaalsContact O-CB 3.24Å; G100-A104 WeakPolarHBondContact O-CB 3.48Å; G100-A104 PolarHBondContact O-N 3.07Å
101	L	74.9	Confident	66.2	Low	69 Å²	69	124.9 Å²	124.9	36%	0.361	62%	0.624	S	S	.	*	H	α-helix	trans	-67.2	-41	175.6	-173.2	66.5	0	0	0	112.4	D97 P98 L99 A104 K105	D97-L101 PolarHBondContact O-N 3.03Å; P98-L101 PolarHBondContact O-N 3.15Å; L99-L101 VanDerWaalsContact C-N 3.27Å; L99-L101 PolarHBondContact O-N 3.08Å; L101-A104 PolarHBondContact O-N 2.91Å; L101-K105 HydrophobicContact CG-CD 4.44Å; L101-K105 WeakPolarHBondContact O-CB 3.48Å; L101-K105 WeakPolarHBondContact O-CG 3.36Å; L101-K105 PolarHBondContact O-N 3.21Å
102	V	77.8	Confident	68	Low	95 Å²	95	122 Å²	122	58%	0.576	61%	0.614	S	S	*	*	H	α-helix	trans	-63.5	-44.5	175.7	171.5	0	0	0	0	110.6	P98 L99 K105 R106	P98-V102 WeakPolarHBondContact O-CG2 3.3Å; P98-V102 PolarHBondContact O-N 2.84Å; L99-V102 PolarHBondContact O-N 2.85Å; V102-K105 PolarHBondContact O-N 3.43Å; V102-R106 WeakPolarHBondContact O-CB 3.48Å; V102-R106 PolarHBondContact O-N 2.92Å
103	I	75.2	Confident	70	Confident	93 Å²	93	116.1 Å²	116.1	48%	0.477	59%	0.592	S	S	.	*	H	α-helix	trans	-63.1	-44.4	177	-65.4	165.7	0	0	0	110.5	L99 G100 R106 K107	L99-I103 HydrophobicContact CG-CD1 4.09Å; L99-I103 VanDerWaalsContact O-CG1 3.29Å; L99-I103 WeakPolarHBondContact O-CG1 3.36Å; L99-I103 PolarHBondContact O-N 3.32Å; G100-I103 PolarHBondContact O-N 3.29Å; I103-R106 PolarHBondContact O-N 3.27Å; I103-K107 PolarHBondContact O-N 2.92Å
104	A	76.6	Confident	71.8	Confident	42 Å²	42	111.2 Å²	111.2	35%	0.347	58%	0.578	S	S	.	*	H	α-helix	trans	-65.2	-39.6	177.9	0	0	0	0	0	112.5	G100 L101 R108	G100-A104 VanDerWaalsContact O-CB 3.24Å; G100-A104 WeakPolarHBondContact O-CB 3.48Å; G100-A104 PolarHBondContact O-N 3.07Å; L101-A104 PolarHBondContact O-N 2.91Å; A104-R108 PolarHBondContact O-N 3.32Å
105	K	78	Confident	73.4	Confident	128 Å²	128	113.1 Å²	113.1	56%	0.557	58%	0.579	S	S	*	*	H	α-helix	trans	-64	-41.9	174.2	-80.1	-178.7	176.6	-177.2	0	111.6	L101 V102 R108 K109	L101-K105 HydrophobicContact CG-CD 4.44Å; L101-K105 WeakPolarHBondContact O-CB 3.48Å; L101-K105 WeakPolarHBondContact O-CG 3.36Å; L101-K105 PolarHBondContact O-N 3.21Å; V102-K105 PolarHBondContact O-N 3.43Å; K105-R108 PolarHBondContact O-N 3.22Å; K105-K109 PolarHBondContact O-N 3.33Å; K105-K109 VanDerWaalsContact O-N 3.07Å
106	R	79.3	Confident	74.8	Confident	177 Å²	177	106.6 Å²	106.6	67%	0.668	55%	0.554	S	S	*	*	H	α-helix	trans	-64.7	-49.4	176	-177.4	179.9	-110.6	168.1	-4.7	111.3	V102 I103 R108 K109 E110	V102-R106 WeakPolarHBondContact O-CB 3.48Å; V102-R106 PolarHBondContact O-N 2.92Å; I103-R106 PolarHBondContact O-N 3.27Å; R106-R108 VanDerWaalsContact C-N 3.29Å; R106-R108 PolarHBondContact O-N 3.3Å; R106-K109 WeakPolarHBondContact O-CA 3.25Å; R106-K109 WeakPolarHBondContact O-CB 3.48Å; R106-K109 PolarHBondContact O-N 2.68Å; R106-E110 HydrophobicContact CG-CG 4.46Å; R106-E110 WeakPolarHBondContact CG-OE1 3.35Å; R106-E110 PolarHBondContact O-N 3.4Å
107	K	75.3	Confident	75.9	Confident	128 Å²	128	103.7 Å²	103.7	56%	0.557	54%	0.538	S	S	*	.	H	α-helix	trans	-56.2	-41.2	175.6	-92.8	-168.3	175.3	-176	0	112.6	I103 K109 E110 M111	I103-K107 PolarHBondContact O-N 2.92Å; K107-K109 VanDerWaalsContact C-N 3.34Å; K107-K109 PolarHBondContact O-N 3.08Å; K107-E110 PolarHBondContact O-N 3.04Å; K107-M111 WeakPolarHBondContact O-CB 3.48Å; K107-M111 VanDerWaalsContact O-CG 3.31Å; K107-M111 WeakPolarHBondContact O-CG 3.17Å; K107-M111 PolarHBondContact O-N 3.3Å
108	R	75.1	Confident	76.2	Confident	178 Å²	178	104.6 Å²	104.6	67%	0.672	54%	0.538	S	S	*	.	H	α-helix	trans	-62.6	-40.1	174	-87.5	-168.5	-159.8	121.6	4.5	112.7	A104 K105 R106 M111 A112	A104-R108 PolarHBondContact O-N 3.32Å; K105-R108 PolarHBondContact O-N 3.22Å; R106-R108 VanDerWaalsContact C-N 3.29Å; R106-R108 PolarHBondContact O-N 3.3Å; R108-M111 PolarHBondContact O-N 2.81Å; R108-A112 WeakPolarHBondContact O-CB 3.32Å; R108-A112 PolarHBondContact O-N 3.4Å
109	K	74.7	Confident	76.4	Confident	173 Å²	173	102 Å²	102	75%	0.752	53%	0.526	S	S	*	.	H	α-helix	trans	-68.4	-39.3	179.5	-167.3	177.4	-179.8	-177.7	0	111.4	K105 R106 K107 A112	K105-K109 PolarHBondContact O-N 3.33Å; K105-K109 VanDerWaalsContact O-N 3.07Å; R106-K109 WeakPolarHBondContact O-CA 3.25Å; R106-K109 WeakPolarHBondContact O-CB 3.48Å; R106-K109 PolarHBondContact O-N 2.68Å; K107-K109 VanDerWaalsContact C-N 3.34Å; K107-K109 PolarHBondContact O-N 3.08Å; K109-A112 PolarHBondContact O-N 3.26Å
110	E	70.1	Confident	76.7	Confident	81 Å²	81	99.3 Å²	99.3	38%	0.379	51%	0.511	S	S	.	.	H	α-helix	trans	-67.9	-37.8	174.9	-71.2	169.4	-175.2	0	0	111.8	R106 K107 A112 I116 I120	R106-E110 HydrophobicContact CG-CG 4.46Å; R106-E110 WeakPolarHBondContact CG-OE1 3.35Å; R106-E110 PolarHBondContact O-N 3.4Å; K107-E110 PolarHBondContact O-N 3.04Å; E110-A112 VanDerWaalsContact C-N 3.33Å; E110-I116 HydrophobicContact CB-CG2 4.43Å; E110-I116 WeakPolarHBondContact O-CB 3.46Å; E110-I116 VanDerWaalsContact O-CG2 3.25Å; E110-I116 WeakPolarHBondContact O-CG2 3.16Å; E110-I120 HydrophobicContact CB-CD1 4.05Å
111	M	73.7	Confident	76.8	Confident	118 Å²	118	102.7 Å²	102.7	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-79.6	-10.1	176.1	-70.7	178.9	171.9	0	0	114.4	K107 R108 D113	K107-M111 WeakPolarHBondContact O-CB 3.48Å; K107-M111 VanDerWaalsContact O-CG 3.31Å; K107-M111 WeakPolarHBondContact O-CG 3.17Å; K107-M111 PolarHBondContact O-N 3.3Å; R108-M111 PolarHBondContact O-N 2.81Å; M111-D113 VanDerWaalsContact C-N 3.31Å
112	A	74.9	Confident	77.1	Confident	79 Å²	79	102.7 Å²	102.7	65%	0.653	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-26.5	-179.1	0	0	0	0	0	112.4	R108 K109 E110	R108-A112 WeakPolarHBondContact O-CB 3.32Å; R108-A112 PolarHBondContact O-N 3.4Å; K109-A112 PolarHBondContact O-N 3.26Å; E110-A112 VanDerWaalsContact C-N 3.33Å
113	D	80.3	Confident	77	Confident	65 Å²	65	100.9 Å²	100.9	35%	0.348	52%	0.521	S	S	.	.	S	Bend	trans	-87.5	117	172.3	-171.3	-31.6	0	0	0	108.7	M111 Q115 I116 A117	M111-D113 VanDerWaalsContact C-N 3.31Å; D113-Q115 PolarHBondContact O-N 3.25Å; D113-Q115 WeakPolarHBondContact OD1-CB 3.39Å; D113-Q115 PolarHBondContact OD1-N 3.46Å; D113-I116 HydrophobicContact CB-CB 4Å; D113-I116 HydrophobicContact CB-CD1 3.75Å; D113-I116 HydrophobicContact CB-CG1 3.91Å; D113-I116 PolarHBondContact O-N 3.26Å; D113-A117 WeakPolarHBondContact O-CB 3.25Å; D113-A117 PolarHBondContact O-N 2.99Å
114	P	78.8	Confident	77.1	Confident	101 Å²	101	101 Å²	101	66%	0.656	53%	0.53	S	S	*	.	H	α-helix	trans	-58.9	-32.1	-178.2	23.2	-32.3	0	0	0	112.5	E118	P114-E118 WeakPolarHBondContact O-CB 3.44Å; P114-E118 PolarHBondContact O-N 3.01Å
115	Q	79.5	Confident	77.4	Confident	154 Å²	154	107.1 Å²	107.1	72%	0.72	55%	0.549	S	S	*	.	H	α-helix	trans	-71	-42.9	178.3	-67.3	-168.4	-35.1	0	0	111.6	D113 A119	D113-Q115 PolarHBondContact O-N 3.25Å; D113-Q115 WeakPolarHBondContact OD1-CB 3.39Å; D113-Q115 PolarHBondContact OD1-N 3.46Å; Q115-A119 WeakPolarHBondContact O-CB 3.3Å; Q115-A119 PolarHBondContact O-N 2.94Å
116	I	76.7	Confident	77.4	Confident	76 Å²	76	107 Å²	107	39%	0.39	55%	0.553	S	S	.	*	H	α-helix	trans	-68	-40.8	177.2	-61.6	171.6	0	0	0	109.9	E110 D113 E118 A119 I120	E110-I116 HydrophobicContact CB-CG2 4.43Å; E110-I116 WeakPolarHBondContact O-CB 3.46Å; E110-I116 VanDerWaalsContact O-CG2 3.25Å; E110-I116 WeakPolarHBondContact O-CG2 3.16Å; D113-I116 HydrophobicContact CB-CB 4Å; D113-I116 HydrophobicContact CB-CD1 3.75Å; D113-I116 HydrophobicContact CB-CG1 3.91Å; D113-I116 PolarHBondContact O-N 3.26Å; I116-E118 PolarHBondContact O-N 3.35Å; I116-A119 PolarHBondContact O-N 3.42Å; I116-I120 HydrophobicContact CG2-CD1 3.64Å; I116-I120 HydrophobicContact CG2-CG1 4.2Å; I116-I120 WeakPolarHBondContact O-CB 3.34Å; I116-I120 VanDerWaalsContact O-CG1 3.24Å; I116-I120 WeakPolarHBondContact O-CG1 3.35Å; I116-I120 PolarHBondContact O-N 3.47Å
117	A	77.6	Confident	77.4	Confident	22 Å²	22	103.6 Å²	103.6	18%	0.182	55%	0.554	C	S	.	*	H	α-helix	trans	-60.1	-46	177.8	0	0	0	0	0	111.7	D113 I120 L121	D113-A117 WeakPolarHBondContact O-CB 3.25Å; D113-A117 PolarHBondContact O-N 2.99Å; A117-I120 PolarHBondContact O-N 2.99Å; A117-L121 WeakPolarHBondContact O-CB 3.48Å; A117-L121 PolarHBondContact O-N 3.25Å
118	E	79.9	Confident	77.4	Confident	146 Å²	146	102.7 Å²	102.7	68%	0.682	56%	0.562	S	S	*	*	H	α-helix	trans	-65	-43.7	176.4	-172.2	174.8	-172.5	0	0	111.7	P114 I116 I120 L121 S122	P114-E118 WeakPolarHBondContact O-CB 3.44Å; P114-E118 PolarHBondContact O-N 3.01Å; I116-E118 PolarHBondContact O-N 3.35Å; E118-I120 PolarHBondContact O-N 2.73Å; E118-L121 PolarHBondContact O-N 2.85Å; E118-S122 WeakPolarHBondContact O-CB 3.48Å; E118-S122 PolarHBondContact O-N 3.29Å; E118-S122 PolarHBondContact O-OG 2.62Å
119	A	80	Confident	77.5	Confident	53 Å²	53	99.6 Å²	99.6	44%	0.438	57%	0.565	S	S	.	*	H	α-helix	trans	-58.9	-45.4	175.7	0	0	0	0	0	111.8	Q115 I116 S122 A123	Q115-A119 WeakPolarHBondContact O-CB 3.3Å; Q115-A119 PolarHBondContact O-N 2.94Å; I116-A119 PolarHBondContact O-N 3.42Å; A119-S122 PolarHBondContact O-N 3.21Å; A119-S122 PolarHBondContact O-OG 3.37Å; A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 3.41Å
120	I	76.2	Confident	77.4	Confident	69 Å²	69	98.6 Å²	98.6	35%	0.354	57%	0.566	S	S	.	*	H	α-helix	trans	-65.5	-43.3	176.8	-66.9	169.1	0	0	0	111.1	E110 I116 A117 E118 S122 A123 S124	E110-I120 HydrophobicContact CB-CD1 4.05Å; I116-I120 HydrophobicContact CG2-CD1 3.64Å; I116-I120 HydrophobicContact CG2-CG1 4.2Å; I116-I120 WeakPolarHBondContact O-CB 3.34Å; I116-I120 VanDerWaalsContact O-CG1 3.24Å; I116-I120 WeakPolarHBondContact O-CG1 3.35Å; I116-I120 PolarHBondContact O-N 3.47Å; A117-I120 PolarHBondContact O-N 2.99Å; E118-I120 PolarHBondContact O-N 2.73Å; I120-S122 VanDerWaalsContact C-N 3.29Å; I120-S122 PolarHBondContact O-N 3.32Å; I120-A123 PolarHBondContact O-N 3.5Å; I120-S124 VanDerWaalsContact O-CB 3.23Å; I120-S124 WeakPolarHBondContact O-CB 3.43Å; I120-S124 PolarHBondContact O-N 3.49Å
121	L	78.1	Confident	77.1	Confident	109 Å²	109	100.5 Å²	100.5	57%	0.571	58%	0.583	S	S	*	*	H	α-helix	trans	-62.6	-37.5	176.7	-113	152.9	0	0	0	111.8	A117 E118 K125	A117-L121 WeakPolarHBondContact O-CB 3.48Å; A117-L121 PolarHBondContact O-N 3.25Å; E118-L121 PolarHBondContact O-N 2.85Å; L121-K125 WeakPolarHBondContact O-CG 3.42Å; L121-K125 PolarHBondContact O-N 3.19Å
122	S	82.2	Confident	76.5	Confident	70 Å²	70	99.3 Å²	99.3	49%	0.49	58%	0.584	S	S	.	*	H	α-helix	trans	-68.8	-42.9	175.4	78.7	0	0	0	0	111.7	E118 A119 I120 K125	E118-S122 WeakPolarHBondContact O-CB 3.48Å; E118-S122 PolarHBondContact O-N 3.29Å; E118-S122 PolarHBondContact O-OG 2.62Å; A119-S122 PolarHBondContact O-N 3.21Å; A119-S122 PolarHBondContact O-OG 3.37Å; I120-S122 VanDerWaalsContact C-N 3.29Å; I120-S122 PolarHBondContact O-N 3.32Å; S122-K125 PolarHBondContact O-N 2.87Å
123	A	74.7	Confident	75.7	Confident	56 Å²	56	104.1 Å²	104.1	46%	0.463	59%	0.593	S	S	.	*	H	α-helix	trans	-69.3	-38	178.8	0	0	0	0	0	111.9	A119 I120 K125 L126	A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 3.41Å; I120-A123 PolarHBondContact O-N 3.5Å; A123-K125 PolarHBondContact O-N 3.11Å; A123-L126 WeakPolarHBondContact O-CB 3.32Å; A123-L126 PolarHBondContact O-N 2.82Å
124	S	77.6	Confident	74.6	Confident	97 Å²	97	105.5 Å²	105.5	68%	0.678	60%	0.604	S	S	*	*	H	α-helix	trans	-64.9	-22.9	175.3	176.1	0	0	0	0	113.2	I120 L126	I120-S124 VanDerWaalsContact O-CB 3.23Å; I120-S124 WeakPolarHBondContact O-CB 3.43Å; I120-S124 PolarHBondContact O-N 3.49Å; S124-L126 VanDerWaalsContact C-N 3.29Å
125	K	81.8	Confident	73.8	Confident	169 Å²	169	106.9 Å²	106.9	74%	0.735	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-12.4	174.2	-77.5	175.4	179.5	179.1	0	112.7	L121 S122 A123	L121-K125 WeakPolarHBondContact O-CG 3.42Å; L121-K125 PolarHBondContact O-N 3.19Å; S122-K125 PolarHBondContact O-N 2.87Å; A123-K125 PolarHBondContact O-N 3.11Å
126	L	80	Confident	72.6	Confident	125 Å²	125	104.6 Å²	104.6	65%	0.654	60%	0.603	S	S	*	*	S	Bend	trans	-75.2	130.5	175.4	-66	162.9	0	0	0	108.7	A123 S124	A123-L126 WeakPolarHBondContact O-CB 3.32Å; A123-L126 PolarHBondContact O-N 2.82Å; S124-L126 VanDerWaalsContact C-N 3.29Å
127	P	79.3	Confident	71.7	Confident	106 Å²	106	105.5 Å²	105.5	69%	0.688	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-58.2	142.4	168.5	25.5	-31.8	0	0	0	108.9
128	P	75.1	Confident	71.1	Confident	109 Å²	109	110.1 Å²	110.1	71%	0.708	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-55.6	140.3	175.3	23.5	-31.9	0	0	0	109.1	I130	P128-I130 PolarHBondContact O-N 3.41Å
129	P	75.5	Confident	70.2	Confident	114 Å²	114	109.4 Å²	109.4	74%	0.74	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-56.8	130.6	178.3	23.2	-31.7	0	0	0	109.1	V131	P129-V131 PolarHBondContact O-N 3.42Å
130	I	73.5	Confident	69.3	Low	152 Å²	152	109 Å²	109	78%	0.779	64%	0.635	S	S	*	*			trans	-59.1	112.7	165.8	-100.4	71.1	0	0	0	105.4	P128 P132	P128-I130 PolarHBondContact O-N 3.41Å; I130-P132 WeakPolarHBondContact O-CD 3.44Å
131	V	63.4	Low	69	Low	120 Å²	120	109.2 Å²	109.2	73%	0.727	64%	0.641	S	S	*	*			trans	-72.5	116	163.4	-176	0	0	0	0	104.2	P129 E133	P129-V131 PolarHBondContact O-N 3.42Å; V131-E133 PolarHBondContact O-N 3.04Å
132	P	62.2	Low	68.7	Low	93 Å²	93	111.7 Å²	111.7	60%	0.604	65%	0.649	S	S	*	*			trans	-59.8	116.6	174.1	24.6	-30.9	0	0	0	107.1	I130 T134	I130-P132 WeakPolarHBondContact O-CD 3.44Å; P132-T134 VanDerWaalsContact C-N 3.28Å; P132-T134 WeakPolarHBondContact O-CG2 3.41Å; P132-T134 PolarHBondContact O-N 2.86Å
133	E	57.2	Low	68.1	Low	180 Å²	180	115.6 Å²	115.6	84%	0.841	66%	0.66	S	S	*	*			trans	-62.6	98.3	166.6	-71.4	178.6	-179.8	0	0	106.1	V131 T135	V131-E133 PolarHBondContact O-N 3.04Å; E133-T135 VanDerWaalsContact C-N 3.31Å; E133-T135 PolarHBondContact O-N 3.49Å
134	T	57.9	Low	67.5	Low	94 Å²	94	117.6 Å²	117.6	58%	0.577	66%	0.662	S	S	*	*			trans	-72.9	91.9	179.5	67.4	0	0	0	0	107.1	P132 N136	P132-T134 VanDerWaalsContact C-N 3.28Å; P132-T134 WeakPolarHBondContact O-CG2 3.41Å; P132-T134 PolarHBondContact O-N 2.86Å; T134-N136 PolarHBondContact O-N 3.34Å
135	T	61	Low	67.1	Low	130 Å²	130	117 Å²	117	80%	0.798	65%	0.651	S	S	*	*			trans	-70.9	-15	170.8	54.6	0	0	0	0	111.8	E133	E133-T135 VanDerWaalsContact C-N 3.31Å; E133-T135 PolarHBondContact O-N 3.49Å
136	N	56.1	Low	66.4	Low	106 Å²	106	115.7 Å²	115.7	57%	0.567	65%	0.648	S	S	*	*			trans	-89.6	107.6	174.9	-80.8	-27.6	0	0	0	110.3	T134 V138	T134-N136 PolarHBondContact O-N 3.34Å; N136-V138 PolarHBondContact O-N 3.49Å
137	S	57.3	Low	65.7	Low	96 Å²	96	115.1 Å²	115.1	67%	0.671	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	3.8	171.9	57	0	0	0	0	114.4
138	V	64.3	Low	65	Low	119 Å²	119	115.5 Å²	115.5	72%	0.721	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-24	-175.5	-173.8	0	0	0	0	112	N136	N136-V138 PolarHBondContact O-N 3.49Å
139	D	60.4	Low	64.8	Low	131 Å²	131	112.9 Å²	112.9	70%	0.701	63%	0.628	S	S	*	*	S	Bend	trans	-100.8	14.3	-174.8	-64.8	-35	0	0	0	113.8
140	V	62.5	Low	64.3	Low	44 Å²	44	112.8 Å²	112.8	27%	0.267	62%	0.62	S	S	.	*	S	Bend	trans	-88.2	123.8	175.8	-174.7	0	0	0	0	109	L144 L145	V140-L144 HydrophobicContact CG1-CB 3.65Å; V140-L144 HydrophobicContact CG1-CD1 4.5Å; V140-L145 HydrophobicContact CB-CD1 4.48Å; V140-L145 HydrophobicContact CB-CG 4.26Å; V140-L145 HydrophobicContact CG1-CG 4.04Å
141	P	70.2	Confident	63.7	Low	74 Å²	74	108.4 Å²	108.4	48%	0.481	61%	0.606	S	S	.	*			trans	-53.6	141.1	175.1	-23.4	31.4	0	0	0	111.8	E143 L144 L145	P141-E143 PolarHBondContact O-N 3.14Å; P141-E143 VanDerWaalsContact O-N 3.07Å; P141-L144 HydrophobicContact CG-CD1 4.37Å; P141-L144 PolarHBondContact O-N 2.98Å; P141-L145 PolarHBondContact O-N 2.89Å
142	E	70.6	Confident	63.7	Low	160 Å²	160	110.4 Å²	110.4	75%	0.748	61%	0.605	S	S	*	*	H	α-helix	trans	-53.2	-32.4	179	-81.2	-175.6	158.9	0	0	112.9	L144 L145 Q146	E142-L144 PolarHBondContact O-N 3.39Å; E142-L145 PolarHBondContact O-N 2.88Å; E142-Q146 PolarHBondContact O-N 3.43Å
143	E	70.7	Confident	63.6	Low	153 Å²	153	111.9 Å²	111.9	72%	0.715	61%	0.608	S	S	*	*	H	α-helix	trans	-59.7	-44.1	176.4	-65.6	179.9	172.4	0	0	112.4	P141 Q146 I147	P141-E143 PolarHBondContact O-N 3.14Å; P141-E143 VanDerWaalsContact O-N 3.07Å; E143-Q146 PolarHBondContact O-N 3.32Å; E143-I147 VanDerWaalsContact O-CG1 3.32Å; E143-I147 WeakPolarHBondContact O-CG1 3.26Å; E143-I147 PolarHBondContact O-N 2.81Å
144	L	61.4	Low	63.5	Low	97 Å²	97	111.6 Å²	111.6	51%	0.508	60%	0.6	S	S	.	*	H	α-helix	trans	-70.8	-36.7	178.2	-90.9	159.6	0	0	0	111.4	V140 P141 E142 I147 L148	V140-L144 HydrophobicContact CG1-CB 3.65Å; V140-L144 HydrophobicContact CG1-CD1 4.5Å; P141-L144 HydrophobicContact CG-CD1 4.37Å; P141-L144 PolarHBondContact O-N 2.98Å; E142-L144 PolarHBondContact O-N 3.39Å; L144-I147 PolarHBondContact O-N 3.15Å; L144-L148 WeakPolarHBondContact O-CB 3.4Å; L144-L148 PolarHBondContact O-N 3.04Å
145	L	68.7	Low	63.3	Low	86 Å²	86	113.8 Å²	113.8	45%	0.45	61%	0.609	S	S	.	*	H	α-helix	trans	-64.8	-39.1	175.1	-79.1	167.7	0	0	0	112.1	V140 P141 E142 L148 A149	V140-L145 HydrophobicContact CB-CD1 4.48Å; V140-L145 HydrophobicContact CB-CG 4.26Å; V140-L145 HydrophobicContact CG1-CG 4.04Å; P141-L145 PolarHBondContact O-N 2.89Å; E142-L145 PolarHBondContact O-N 2.88Å; L145-L148 PolarHBondContact O-N 3.29Å; L145-A149 WeakPolarHBondContact O-CB 3.29Å; L145-A149 PolarHBondContact O-N 3.16Å
146	Q	67.8	Low	62.9	Low	141 Å²	141	115 Å²	115	66%	0.659	60%	0.603	S	S	*	*	H	α-helix	trans	-62.4	-43.8	174.7	-83.9	-179.1	-1.3	0	0	111.9	E142 E143 L148 A149 L150	E142-Q146 PolarHBondContact O-N 3.43Å; E143-Q146 PolarHBondContact O-N 3.32Å; Q146-L148 VanDerWaalsContact C-N 3.31Å; Q146-L148 PolarHBondContact O-N 3.28Å; Q146-A149 PolarHBondContact O-N 3.09Å; Q146-L150 VanDerWaalsContact O-CB 3.31Å; Q146-L150 WeakPolarHBondContact O-CB 3.47Å; Q146-L150 PolarHBondContact O-N 3.22Å
147	I	64.1	Low	62.6	Low	112 Å²	112	117.3 Å²	117.3	57%	0.574	62%	0.615	S	S	*	*	H	α-helix	trans	-62.7	-41	177.3	-64.3	164.1	0	0	0	110.6	E143 L144 L150 A151	E143-I147 VanDerWaalsContact O-CG1 3.32Å; E143-I147 WeakPolarHBondContact O-CG1 3.26Å; E143-I147 PolarHBondContact O-N 2.81Å; L144-I147 PolarHBondContact O-N 3.15Å; I147-L150 PolarHBondContact O-N 3.36Å; I147-A151 WeakPolarHBondContact O-CB 3.44Å; I147-A151 PolarHBondContact O-N 3.2Å
148	L	66.5	Low	62.2	Low	114 Å²	114	117.2 Å²	117.2	60%	0.597	61%	0.607	S	S	*	*	H	α-helix	trans	-70.5	-38.5	180	-130.3	151.8	0	0	0	112.2	L144 L145 Q146 A151 K152	L144-L148 WeakPolarHBondContact O-CB 3.4Å; L144-L148 PolarHBondContact O-N 3.04Å; L145-L148 PolarHBondContact O-N 3.29Å; Q146-L148 VanDerWaalsContact C-N 3.31Å; Q146-L148 PolarHBondContact O-N 3.28Å; L148-A151 PolarHBondContact O-N 3.35Å; L148-K152 WeakPolarHBondContact O-CB 3.33Å; L148-K152 PolarHBondContact O-N 2.97Å
149	A	70.1	Confident	61.7	Low	55 Å²	55	116.9 Å²	116.9	46%	0.455	61%	0.606	S	S	.	*	H	α-helix	trans	-64.3	-45.2	173.2	0	0	0	0	0	111.3	L145 Q146 A151 K152 D153	L145-A149 WeakPolarHBondContact O-CB 3.29Å; L145-A149 PolarHBondContact O-N 3.16Å; Q146-A149 PolarHBondContact O-N 3.09Å; A149-A151 VanDerWaalsContact C-N 3.31Å; A149-A151 PolarHBondContact O-N 3.02Å; A149-K152 PolarHBondContact O-N 3.16Å; A149-K152 VanDerWaalsContact O-N 3.15Å; A149-D153 PolarHBondContact O-N 3.29Å
150	L	64.4	Low	61.3	Low	112 Å²	112	118.4 Å²	118.4	59%	0.586	61%	0.609	S	S	*	*	H	α-helix	trans	-56.9	-47	174.5	-166.4	87.1	0	0	0	110.5	Q146 I147 K152 D153 Y154	Q146-L150 VanDerWaalsContact O-CB 3.31Å; Q146-L150 WeakPolarHBondContact O-CB 3.47Å; Q146-L150 PolarHBondContact O-N 3.22Å; I147-L150 PolarHBondContact O-N 3.36Å; L150-K152 VanDerWaalsContact C-N 3.33Å; L150-K152 PolarHBondContact O-N 2.77Å; L150-D153 PolarHBondContact O-N 3Å; L150-Y154 HydrophobicContact CG-CD2 4.47Å; L150-Y154 HydrophobicContact CG-CE2 4.37Å; L150-Y154 VanDerWaalsContact O-CD2 3.3Å; L150-Y154 WeakPolarHBondContact O-CD2 3.25Å; L150-Y154 PolarHBondContact O-N 2.79Å
151	A	60.4	Low	60.5	Low	59 Å²	59	119.9 Å²	119.9	49%	0.488	62%	0.615	S	S	.	*	H	α-helix	trans	-62.8	-38	177.9	0	0	0	0	0	112.8	I147 L148 A149 Y154 D155	I147-A151 WeakPolarHBondContact O-CB 3.44Å; I147-A151 PolarHBondContact O-N 3.2Å; L148-A151 PolarHBondContact O-N 3.35Å; A149-A151 VanDerWaalsContact C-N 3.31Å; A149-A151 PolarHBondContact O-N 3.02Å; A151-Y154 PolarHBondContact O-N 3.47Å; A151-D155 PolarHBondContact O-N 3.32Å
152	K	63.8	Low	59.6	Low	163 Å²	163	122.1 Å²	122.1	71%	0.709	62%	0.622	S	S	*	*	H	α-helix	trans	-71.2	-30.7	-179.3	-143.9	177.6	-169.9	176.9	0	112.9	L148 A149 L150 Y154 D155	L148-K152 WeakPolarHBondContact O-CB 3.33Å; L148-K152 PolarHBondContact O-N 2.97Å; A149-K152 PolarHBondContact O-N 3.16Å; A149-K152 VanDerWaalsContact O-N 3.15Å; L150-K152 VanDerWaalsContact C-N 3.33Å; L150-K152 PolarHBondContact O-N 2.77Å; K152-Y154 VanDerWaalsContact C-N 3.27Å; K152-D155 PolarHBondContact O-N 3.21Å
153	D	59.7	Low	58.6	Low	123 Å²	123	118.8 Å²	118.8	66%	0.658	61%	0.609	S	S	*	*	H	α-helix	trans	-69.3	-28	172.1	-83.3	-20.9	0	0	0	112.1	A149 L150	A149-D153 PolarHBondContact O-N 3.29Å; L150-D153 PolarHBondContact O-N 3Å
154	Y	55.6	Low	57.8	Low	174 Å²	174	116.4 Å²	116.4	68%	0.682	60%	0.596	S	S	*	*	H	α-helix	trans	-80.9	-14.2	175.4	-87	-75.6	0	0	0	114.6	L150 A151 K152 K156	L150-Y154 HydrophobicContact CG-CD2 4.47Å; L150-Y154 HydrophobicContact CG-CE2 4.37Å; L150-Y154 VanDerWaalsContact O-CD2 3.3Å; L150-Y154 WeakPolarHBondContact O-CD2 3.25Å; L150-Y154 PolarHBondContact O-N 2.79Å; A151-Y154 PolarHBondContact O-N 3.47Å; K152-Y154 VanDerWaalsContact C-N 3.27Å; Y154-K156 PolarHBondContact O-N 2.76Å
155	D	54	Low	57	Low	141 Å²	141	119.2 Å²	119.2	75%	0.754	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	7.5	-179.8	-152.5	32.3	0	0	0	113.2	A151 K152 D157	A151-D155 PolarHBondContact O-N 3.32Å; K152-D155 PolarHBondContact O-N 3.21Å; D155-D157 PolarHBondContact O-N 3.1Å
156	K	52.5	Low	56	Low	156 Å²	156	122.8 Å²	122.8	68%	0.678	62%	0.617	S	S	*	*	S	Bend	trans	-81.6	91.7	168	-77.8	180	179.7	168.6	0	109.9	Y154 D158	Y154-K156 PolarHBondContact O-N 2.76Å; K156-D158 VanDerWaalsContact C-N 3.27Å; K156-D158 PolarHBondContact O-N 2.88Å
157	D	48.7	Very low	55.1	Low	153 Å²	153	122 Å²	122	82%	0.818	62%	0.617	S	S	*	*	S	Bend	trans	54	14.1	145.9	-76.9	-21.2	0	0	0	120.4	D155 T159	D155-D157 PolarHBondContact O-N 3.1Å; D157-T159 PolarHBondContact O-N 3.21Å
158	D	49.1	Very low	54	Low	95 Å²	95	124 Å²	124	51%	0.508	62%	0.619	S	S	.	*			trans	-85.2	68.6	170.9	-70.9	-7.6	0	0	0	110.7	K156 E160 N161	K156-D158 VanDerWaalsContact C-N 3.27Å; K156-D158 PolarHBondContact O-N 2.88Å; D158-E160 PolarHBondContact O-N 3.23Å; D158-N161 HydrophobicContact CB-CB 4.35Å; D158-N161 PolarHBondContact O-N 2.97Å; D158-N161 PolarHBondContact OD2-ND2 3.45Å
159	T	53.7	Low	52.6	Low	112 Å²	112	122.7 Å²	122.7	69%	0.687	62%	0.619	S	S	*	*	H	α-helix	trans	-53.3	-15.9	162.7	37	0	0	0	0	112.5	D157	D157-T159 PolarHBondContact O-N 3.21Å
160	E	52.4	Low	51.2	Low	163 Å²	163	128.1 Å²	128.1	76%	0.762	64%	0.639	S	S	*	*	H	α-helix	trans	-71.6	-28	173.7	-65.4	-170.4	165.3	0	0	113.7	D158 F164	D158-E160 PolarHBondContact O-N 3.23Å; E160-F164 PolarHBondContact O-N 2.98Å
161	N	47.2	Very low	49.8	Very low	75 Å²	75	129.7 Å²	129.7	40%	0.401	65%	0.647	S	S	.	*	H	α-helix	trans	-83.1	-20.7	-176.7	-81.9	-34.7	0	0	0	113.9	D158 D163 F164 F165	D158-N161 HydrophobicContact CB-CB 4.35Å; D158-N161 PolarHBondContact O-N 2.97Å; D158-N161 PolarHBondContact OD2-ND2 3.45Å; N161-D163 VanDerWaalsContact C-N 3.33Å; N161-F164 WeakPolarHBondContact O-CB 3.42Å; N161-F164 PolarHBondContact O-N 3.43Å; N161-F165 WeakPolarHBondContact O-CD2 3.45Å
162	I	50.3	Low	48.9	Very low	121 Å²	121	134.6 Å²	134.6	62%	0.621	66%	0.66	S	S	*	*	H	α-helix	trans	-71.8	-34.7	173.9	-57.4	178.7	0	0	0	110.1	F164 F165 K166	I162-F164 VanDerWaalsContact C-N 3.33Å; I162-F165 PolarHBondContact O-N 2.79Å; I162-K166 PolarHBondContact O-N 3.43Å
163	D	50.5	Low	47.8	Very low	90 Å²	90	131.8 Å²	131.8	48%	0.481	66%	0.658	S	S	.	*	H	α-helix	trans	-73.4	-24.6	175.3	-79.2	-13.4	0	0	0	112.9	N161 K166 N167	N161-D163 VanDerWaalsContact C-N 3.33Å; D163-K166 PolarHBondContact O-N 3.34Å; D163-N167 WeakPolarHBondContact O-CB 3.36Å; D163-N167 PolarHBondContact O-N 2.82Å
164	F	53.9	Low	46.8	Very low	102 Å²	102	137.7 Å²	137.7	45%	0.447	67%	0.671	S	S	.	*	H	α-helix	trans	-58.2	-49.3	170.5	178.4	-97.2	0	0	0	111.6	E160 N161 I162 Y168	E160-F164 PolarHBondContact O-N 2.98Å; N161-F164 WeakPolarHBondContact O-CB 3.42Å; N161-F164 PolarHBondContact O-N 3.43Å; I162-F164 VanDerWaalsContact C-N 3.33Å; F164-Y168 HydrophobicContact CD1-CD2 4.47Å; F164-Y168 HydrophobicContact CD1-CE2 4.49Å; F164-Y168 HydrophobicContact CD2-CE2 4.36Å; F164-Y168 HydrophobicContact CE1-CD2 4.14Å; F164-Y168 AromaticContact CE1-CE2 3.8Å; F164-Y168 HydrophobicContact CE1-CE2 3.8Å; F164-Y168 HydrophobicContact CE2-CD2 4.35Å; F164-Y168 AromaticContact CE2-CE2 3.66Å; F164-Y168 HydrophobicContact CE2-CE2 3.66Å; F164-Y168 HydrophobicContact CZ-CD2 4.09Å; F164-Y168 AromaticContact CZ-CE2 3.34Å; F164-Y168 HydrophobicContact CZ-CE2 3.34Å; F164-Y168 WeakPolarHBondContact O-CD2 3.35Å; F164-Y168 PolarHBondContact O-N 3.27Å
165	F	43.3	Very low	45.8	Very low	157 Å²	157	138.9 Å²	138.9	69%	0.689	68%	0.68	S	S	*	*	H	α-helix	trans	-72	-30.3	178.2	-70.7	-73	0	0	0	113	N161 I162	N161-F165 WeakPolarHBondContact O-CD2 3.45Å; I162-F165 PolarHBondContact O-N 2.79Å
166	K	48.6	Very low	45	Very low	161 Å²	161	137.6 Å²	137.6	70%	0.7	68%	0.679	S	S	*	*	H	α-helix	trans	-70.6	-32.8	178.7	-130.7	177	-175.6	178.2	0	112.7	I162 D163	I162-K166 PolarHBondContact O-N 3.43Å; D163-K166 PolarHBondContact O-N 3.34Å
167	N	47.9	Very low	44.4	Very low	125 Å²	125	138 Å²	138	67%	0.668	69%	0.688	S	S	*	*	H	α-helix	trans	-94.4	2.2	-178.6	-72.2	-18.5	0	0	0	114.4	D163 S169	D163-N167 WeakPolarHBondContact O-CB 3.36Å; D163-N167 PolarHBondContact O-N 2.82Å; N167-S169 PolarHBondContact O-N 3.46Å
168	Y	42.2	Very low	43.8	Very low	154 Å²	154	138 Å²	138	60%	0.604	69%	0.688	S	S	*	*			trans	-71.2	72.4	164.8	-108.1	-97.9	0	0	0	110.5	F164 L170	F164-Y168 HydrophobicContact CD1-CD2 4.47Å; F164-Y168 HydrophobicContact CD1-CE2 4.49Å; F164-Y168 HydrophobicContact CD2-CE2 4.36Å; F164-Y168 HydrophobicContact CE1-CD2 4.14Å; F164-Y168 AromaticContact CE1-CE2 3.8Å; F164-Y168 HydrophobicContact CE1-CE2 3.8Å; F164-Y168 HydrophobicContact CE2-CD2 4.35Å; F164-Y168 AromaticContact CE2-CE2 3.66Å; F164-Y168 HydrophobicContact CE2-CE2 3.66Å; F164-Y168 HydrophobicContact CZ-CD2 4.09Å; F164-Y168 AromaticContact CZ-CE2 3.34Å; F164-Y168 HydrophobicContact CZ-CE2 3.34Å; F164-Y168 WeakPolarHBondContact O-CD2 3.35Å; F164-Y168 PolarHBondContact O-N 3.27Å; Y168-L170 PolarHBondContact O-N 3.44Å; Y168-L170 VanDerWaalsContact O-N 3.13Å
169	S	36.6	Very low	43.1	Very low	85 Å²	85	139.5 Å²	139.5	59%	0.594	70%	0.7	S	S	*	*			trans	-66	108.5	163.6	-62.8	0	0	0	0	107.7	N167 I171	N167-S169 PolarHBondContact O-N 3.46Å; S169-I171 PolarHBondContact O-N 2.71Å
170	L	40.1	Very low	42.3	Very low	170 Å²	170	141.9 Å²	141.9	89%	0.89	70%	0.704	S	S	*	*	S	Bend	trans	-57	11.6	-172	-90.6	159.6	0	0	0	117.3	Y168	Y168-L170 PolarHBondContact O-N 3.44Å; Y168-L170 VanDerWaalsContact O-N 3.13Å
171	I	36.4	Very low	41.5	Very low	144 Å²	144	138.8 Å²	138.8	74%	0.738	70%	0.696	S	S	*	*			trans	-145.8	85.9	-174.3	-49.2	174.4	0	0	0	108.8	S169 P173	S169-I171 PolarHBondContact O-N 2.71Å; I171-P173 WeakPolarHBondContact O-CD 3.29Å
172	Q	41	Very low	41	Very low	163 Å²	163	141.6 Å²	141.6	76%	0.762	71%	0.711	S	S	*	*			trans	-97.3	104.3	164.1	-67.1	-66.8	-11.7	0	0	108	R174	Q172-R174 PolarHBondContact O-N 3.16Å
173	P	39.9	Very low	40.2	Very low	104 Å²	104	142.2 Å²	142.2	68%	0.675	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-63.2	126.2	174.5	24.9	-30.9	0	0	0	109.2	I171 K175	I171-P173 WeakPolarHBondContact O-CD 3.29Å; P173-K175 PolarHBondContact O-N 3.27Å; P173-K175 VanDerWaalsContact O-N 3.12Å
174	R	38.4	Very low	39.5	Very low	246 Å²	246	144.2 Å²	144.2	93%	0.928	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-51.3	119.4	176.5	-92.9	-179.5	175.4	165.4	-1	109.9	Q172	Q172-R174 PolarHBondContact O-N 3.16Å
175	K	35.3	Very low	38.4	Very low	200 Å²	200	144.7 Å²	144.7	87%	0.87	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-65.8	128.3	172.1	-151.1	172	-172.6	177.5	0	108.6	P173 L177	P173-K175 PolarHBondContact O-N 3.27Å; P173-K175 VanDerWaalsContact O-N 3.12Å; K175-L177 PolarHBondContact O-N 2.98Å
176	P	37.8	Very low	38	Very low	113 Å²	113	148.4 Å²	148.4	73%	0.734	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-66.2	129.7	-174.6	24.4	-32.2	0	0	0	110.7	N178	P176-N178 PolarHBondContact O-N 2.84Å
177	L	40.2	Very low	37.4	Very low	166 Å²	166	148.9 Å²	148.9	87%	0.869	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.9	123.6	175.1	-142.3	90.7	0	0	0	108.2	K175 T179	K175-L177 PolarHBondContact O-N 2.98Å; L177-T179 PolarHBondContact O-N 3.47Å
178	N	35.1	Very low	36.7	Very low	153 Å²	153	151.9 Å²	151.9	82%	0.818	77%	0.767	S	S	*	*			trans	-57.8	112	179.1	-86.3	-27.7	0	0	0	110.9	P176 Q180	P176-N178 PolarHBondContact O-N 2.84Å; N178-Q180 VanDerWaalsContact C-N 3.31Å; N178-Q180 PolarHBondContact O-N 2.92Å
179	T	34.8	Very low	36.2	Very low	125 Å²	125	156.9 Å²	156.9	77%	0.767	78%	0.784	S	S	*	*			trans	-66.5	87.7	166.8	-41.2	0	0	0	0	108.5	L177 V181	L177-T179 PolarHBondContact O-N 3.47Å; T179-V181 VanDerWaalsContact C-N 3.31Å; T179-V181 HydrophobicContact CG2-CG2 4.15Å; T179-V181 PolarHBondContact O-N 2.79Å
180	Q	37.3	Very low	36.2	Very low	163 Å²	163	161.5 Å²	161.5	76%	0.762	80%	0.797	S	S	*	*			trans	-74.1	95.1	163.2	-81.9	-90.1	-38.5	0	0	107.5	N178 N182	N178-Q180 VanDerWaalsContact C-N 3.31Å; N178-Q180 PolarHBondContact O-N 2.92Å; Q180-N182 PolarHBondContact O-N 3.1Å
181	V	34.8	Very low	35.8	Very low	98 Å²	98	164.3 Å²	164.3	59%	0.594	80%	0.795	S	S	*	*			trans	-60.9	91.3	173.2	175.7	0	0	0	0	108.9	T179 N183	T179-V181 VanDerWaalsContact C-N 3.31Å; T179-V181 HydrophobicContact CG2-CG2 4.15Å; T179-V181 PolarHBondContact O-N 2.79Å; V181-N183 WeakPolarHBondContact CG1-OD1 3.43Å
182	N	36.3	Very low	35.6	Very low	134 Å²	134	163.8 Å²	163.8	72%	0.717	79%	0.793	S	S	*	*			trans	-106	99.8	166.5	-79.2	-12.8	0	0	0	109.2	Q180 V184	Q180-N182 PolarHBondContact O-N 3.1Å; N182-V184 VanDerWaalsContact C-N 3.31Å; N182-V184 PolarHBondContact O-N 2.93Å
183	N	35	Very low	35.5	Very low	134 Å²	134	161.8 Å²	161.8	72%	0.717	80%	0.796	S	S	*	*			trans	-69.5	82.9	175.6	-52.7	-25.5	0	0	0	109	V181	V181-N183 WeakPolarHBondContact CG1-OD1 3.43Å
184	V	34.6	Very low	35.3	Very low	131 Å²	131	166.3 Å²	166.3	79%	0.794	81%	0.805	S	S	*	*			trans	-101.4	81.6	164.7	-175.1	0	0	0	0	108	N182	N182-V184 VanDerWaalsContact C-N 3.31Å; N182-V184 PolarHBondContact O-N 2.93Å
185	T	31	Very low	35.2	Very low	112 Å²	112	160 Å²	160	69%	0.687	79%	0.789	S	S	*	*			trans	15.6	113.9	144.4	-17.4	0	0	0	0	116.4	M187	T185-M187 VanDerWaalsContact C-N 3.33Å; T185-M187 PolarHBondContact O-N 3.19Å
186	Y	35.6	Very low	35.4	Very low	235 Å²	235	155 Å²	155	92%	0.922	78%	0.779	S	S	*	*			trans	-50.9	86.6	163.5	-67.7	-92	0	0	0	111.9
187	M	35.9	Very low	35.7	Very low	171 Å²	171	154.2 Å²	154.2	84%	0.842	78%	0.777	S	S	*	*			trans	-144.6	128.1	164.8	-83.6	-59.1	-139.8	0	0	110.2	T185	T185-M187 VanDerWaalsContact C-N 3.33Å; T185-M187 PolarHBondContact O-N 3.19Å
188	K	32.9	Very low	35.6	Very low	188 Å²	188	152.7 Å²	152.7	82%	0.817	77%	0.769	S	S	*	*			trans	93	55.6	153.7	-142.6	168.7	-167.5	171.1	0	117.5	E190	K188-E190 VanDerWaalsContact C-N 3.31Å; K188-E190 PolarHBondContact O-N 3.43Å
189	R	31.1	Very low	35.5	Very low	259 Å²	259	153.4 Å²	153.4	98%	0.977	77%	0.765	S	S	*	*			trans	-83.9	13.1	170.8	-150.2	170.8	-175.8	159.6	0.6	115.1
190	E	36.3	Very low	35.5	Very low	182 Å²	182	156.6 Å²	156.6	85%	0.85	77%	0.768	S	S	*	*			trans	-113.9	17.2	-160.9	-119.4	-179.2	-166.3	0	0	118.3	K188	K188-E190 VanDerWaalsContact C-N 3.31Å; K188-E190 PolarHBondContact O-N 3.43Å
191	R	32.7	Very low	35.4	Very low	229 Å²	229	158.2 Å²	158.2	86%	0.864	77%	0.769	S	S	*	*	S	Bend	trans	-127.9	16.4	-179.1	-82.9	-166.8	173.8	174.2	-0.2	119.1
192	L	31.7	Very low	35.4	Very low	133 Å²	133	162.1 Å²	162.1	70%	0.696	78%	0.778	S	S	*	*			trans	-115.7	18.8	174.8	-85.6	161.8	0	0	0	115.9	K194 L195	L192-K194 PolarHBondContact O-N 3.33Å; L192-L195 HydrophobicContact CD2-CB 4.31Å; L192-L195 HydrophobicContact CD2-CD1 3.92Å
193	C	38	Very low	35.3	Very low	121 Å²	121	162.9 Å²	162.9	82%	0.818	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	2.9	171.2	-78.4	0	0	0	0	115.1
194	K	37.4	Very low	35.2	Very low	199 Å²	199	162.9 Å²	162.9	87%	0.865	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	1.1	173.8	-89.8	-173	176.4	-178.7	0	115.4	L192	L192-K194 PolarHBondContact O-N 3.33Å
195	L	34.9	Very low	35.2	Very low	113 Å²	113	165.7 Å²	165.7	59%	0.592	79%	0.787	S	S	*	*	S	Bend	trans	-108.7	4.1	176.7	-102.8	123.9	0	0	0	114.4	L192 S197	L192-L195 HydrophobicContact CD2-CB 4.31Å; L192-L195 HydrophobicContact CD2-CD1 3.92Å; L195-S197 VanDerWaalsContact C-N 3.3Å; L195-S197 PolarHBondContact O-N 2.8Å
196	S	39.6	Very low	35.3	Very low	95 Å²	95	167.1 Å²	167.1	66%	0.664	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-12.8	-178.6	62.7	0	0	0	0	114.6
197	S	44.9	Very low	35.4	Very low	98 Å²	98	165.3 Å²	165.3	69%	0.685	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-13.7	177.6	63.8	0	0	0	0	114.3	L195	L195-S197 VanDerWaalsContact C-N 3.3Å; L195-S197 PolarHBondContact O-N 2.8Å
198	L	37.5	Very low	35.2	Very low	133 Å²	133	163.3 Å²	163.3	70%	0.696	78%	0.778	S	S	*	*	S	Bend	trans	-111.3	-2	-173.4	-97	154	0	0	0	115.5
199	K	33.8	Very low	35.3	Very low	168 Å²	168	163.2 Å²	163.2	73%	0.73	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-91	-0.7	177.1	-90.5	-170.2	173.6	-167.4	0	115.7	Y201	K199-Y201 PolarHBondContact O-N 3.3Å
200	K	33.3	Very low	35.5	Very low	193 Å²	193	155.4 Å²	155.4	84%	0.839	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-74.8	-5.3	-179.8	-110.5	178.4	-179.1	177	0	115.3
201	Y	36.7	Very low	35.4	Very low	197 Å²	197	150.7 Å²	150.7	77%	0.773	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-108.8	7.7	179.7	-70.1	-74.3	0	0	0	114.9	K199	K199-Y201 PolarHBondContact O-N 3.3Å
202	F	34.5	Very low	35.8	Very low	180 Å²	180	148 Å²	148	79%	0.789	74%	0.739	S	S	*	*	S	Bend	trans	-126.5	21.6	-169.8	-101.2	-81.4	0	0	0	116.8
203	I	33.2	Very low	36.2	Very low	150 Å²	150	148.7 Å²	148.7	77%	0.769	74%	0.738	S	S	*	*	S	Bend	trans	-131.9	70.9	172.4	-49.5	177.8	0	0	0	109.6
204	T	33.2	Very low	36.2	Very low	133 Å²	133	147 Å²	147	82%	0.816	73%	0.725	S	S	*	*	S	Bend	trans	-152	28.1	161	40.4	0	0	0	0	111.9
205	K	34	Very low	36.1	Very low	190 Å²	190	144.9 Å²	144.9	83%	0.826	71%	0.711	S	S	*	*	S	Bend	trans	-120.6	-10.5	173.5	-99.3	-167.4	167.3	-174.6	0	116.4
206	D	34.1	Very low	36.1	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	32.1	-168.2	-60.2	-13.1	0	0	0	114.3
207	F	37.1	Very low	36.1	Very low	197 Å²	197	147.1 Å²	147.1	86%	0.864	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.6	34.1	168.6	-125.5	-85.7	0	0	0	113.7
208	M	32.9	Very low	36	Very low	130 Å²	130	148.2 Å²	148.2	64%	0.64	72%	0.721	S	S	*	*			trans	-128	53.1	159.3	-69.6	-91.3	86.2	0	0	107.9	D210	M208-D210 PolarHBondContact O-N 2.88Å
209	E	34.8	Very low	36	Very low	185 Å²	185	149.1 Å²	149.1	86%	0.864	72%	0.722	S	S	*	*			trans	-87.2	47.1	157.1	-157.4	164.4	-158.4	0	0	108	T211	E209-T211 VanDerWaalsContact C-N 3.26Å; E209-T211 PolarHBondContact O-N 3.31Å; E209-T211 VanDerWaalsContact O-N 3.11Å
210	D	34	Very low	36.3	Very low	96 Å²	96	148.3 Å²	148.3	51%	0.513	73%	0.726	S	S	.	*			trans	-68.5	101.6	150.9	-82.7	-30.9	0	0	0	104.6	M208 E212	M208-D210 PolarHBondContact O-N 2.88Å; D210-E212 PolarHBondContact O-N 3.02Å
211	T	35.6	Very low	36.9	Very low	83 Å²	83	144.7 Å²	144.7	51%	0.509	72%	0.72	S	S	.	*			trans	-23.7	129.3	168.8	-45.8	0	0	0	0	111.3	E209 E213 T214	E209-T211 VanDerWaalsContact C-N 3.26Å; E209-T211 PolarHBondContact O-N 3.31Å; E209-T211 VanDerWaalsContact O-N 3.11Å; T211-E213 HydrophobicContact CG2-CB 3.92Å; T211-E213 HydrophobicContact CG2-CG 3.89Å; T211-E213 PolarHBondContact O-N 3.45Å; T211-T214 PolarHBondContact O-N 2.89Å; T211-T214 PolarHBondContact O-OG1 2.78Å
212	E	41.7	Very low	37.3	Very low	173 Å²	173	141.5 Å²	141.5	81%	0.808	72%	0.721	S	S	*	*	H	α-helix	trans	-49.4	-16.5	176.2	-71.3	-178.1	146.8	0	0	113.6	D210 R215	D210-E212 PolarHBondContact O-N 3.02Å; E212-R215 PolarHBondContact O-N 3.07Å
213	E	38.8	Very low	38.1	Very low	146 Å²	146	139.4 Å²	139.4	68%	0.682	71%	0.713	S	S	*	*	H	α-helix	trans	-69	-28.6	175.8	-63.7	-175.6	173.2	0	0	114.5	T211 T216	T211-E213 HydrophobicContact CG2-CB 3.92Å; T211-E213 HydrophobicContact CG2-CG 3.89Å; T211-E213 PolarHBondContact O-N 3.45Å; E213-T216 PolarHBondContact O-N 3.48Å; E213-T216 PolarHBondContact O-OG1 3.37Å; E213-T216 VanDerWaalsContact O-OG1 3.11Å
214	T	39.1	Very low	39.2	Very low	87 Å²	87	135.9 Å²	135.9	53%	0.534	70%	0.699	S	S	.	*	H	α-helix	trans	-80	-18.7	176.6	52.8	0	0	0	0	113	T211 T216	T211-T214 PolarHBondContact O-N 2.89Å; T211-T214 PolarHBondContact O-OG1 2.78Å; T214-T216 VanDerWaalsContact C-N 3.31Å; T214-T216 PolarHBondContact O-N 2.98Å
215	R	35.2	Very low	40.5	Very low	153 Å²	153	136.3 Å²	136.3	58%	0.577	70%	0.696	S	S	*	*	H	α-helix	trans	-74.2	-19.5	172.7	-79.5	-170.5	164.6	97.2	3.5	113.5	E212	E212-R215 PolarHBondContact O-N 3.07Å
216	T	34.9	Very low	42.2	Very low	102 Å²	102	133.5 Å²	133.5	63%	0.626	69%	0.686	S	S	*	*	H	α-helix	trans	-89.6	-14.8	-176.7	59.9	0	0	0	0	114.3	E213 T214	E213-T216 PolarHBondContact O-N 3.48Å; E213-T216 PolarHBondContact O-OG1 3.37Å; E213-T216 VanDerWaalsContact O-OG1 3.11Å; T214-T216 VanDerWaalsContact C-N 3.31Å; T214-T216 PolarHBondContact O-N 2.98Å
217	L	38.8	Very low	43.8	Very low	154 Å²	154	130.2 Å²	130.2	81%	0.806	67%	0.666	S	S	*	*	H	α-helix	trans	-98.1	-11.2	-177.7	-69.5	-177.7	0	0	0	115.9
218	V	43.7	Very low	45.7	Very low	120 Å²	120	129.2 Å²	129.2	73%	0.727	66%	0.657	S	S	*	*	H	α-helix	trans	-118	-6.1	-177	-175.3	0	0	0	0	114.1	N220	V218-N220 VanDerWaalsContact C-N 3.35Å; V218-N220 PolarHBondContact O-N 2.99Å
219	Q	37.2	Very low	48.2	Very low	152 Å²	152	129 Å²	129	71%	0.71	65%	0.652	S	S	*	*			trans	-88.8	21.9	-169.7	-157.6	142.4	-51.5	0	0	116.5
220	N	40.7	Very low	50.6	Low	152 Å²	152	126.4 Å²	126.4	81%	0.813	64%	0.642	S	S	*	*			trans	-105.3	26.2	179	-71.3	-9.4	0	0	0	114.5	V218	V218-N220 VanDerWaalsContact C-N 3.35Å; V218-N220 PolarHBondContact O-N 2.99Å
221	T	44.1	Very low	53.1	Low	116 Å²	116	123.7 Å²	123.7	71%	0.712	63%	0.626	S	S	*	*			trans	-94.4	98.9	161.9	51	0	0	0	0	108.7	H223	T221-H223 VanDerWaalsContact C-N 3.3Å; T221-H223 PolarHBondContact O-N 3.41Å
222	V	45.2	Very low	55.5	Low	131 Å²	131	121.7 Å²	121.7	79%	0.794	62%	0.615	S	S	*	*			trans	-52.6	92.1	168.5	175.6	0	0	0	0	108.1	T224	V222-T224 PolarHBondContact O-N 3.11Å; V222-T224 VanDerWaalsContact O-N 3.17Å
223	H	52.3	Low	57.9	Low	136 Å²	136	120 Å²	120	63%	0.63	61%	0.606	S	S	*	*			trans	-71	108.5	169.7	-114.8	-59	0	0	0	106.9	T221 E227	T221-H223 VanDerWaalsContact C-N 3.3Å; T221-H223 PolarHBondContact O-N 3.41Å; H223-E227 IonicContact CE1-OE1 3.25Å; H223-E227 PolarHBondContact CE1-OE1 3.18Å; H223-E227 IonicContact CE1-OE2 2.91Å; H223-E227 PolarHBondContact CE1-OE2 3.34Å; H223-E227 IonicContact ND1-OE1 3.22Å; H223-E227 PolarHBondContact ND1-OE1 2.86Å; H223-E227 IonicContact ND1-OE2 3.16Å; H223-E227 PolarHBondContact ND1-OE2 2.88Å
224	T	55.9	Low	60.3	Low	76 Å²	76	116.5 Å²	116.5	47%	0.466	59%	0.591	S	S	.	*			trans	-63.4	130.7	-177.5	47.6	0	0	0	0	111	V222 E226 E227	V222-T224 PolarHBondContact O-N 3.11Å; V222-T224 VanDerWaalsContact O-N 3.17Å; T224-E226 PolarHBondContact O-N 3.02Å; T224-E227 PolarHBondContact O-N 3.45Å; T224-E227 VanDerWaalsContact O-N 3.15Å
225	D	59.8	Low	62.8	Low	142 Å²	142	114 Å²	114	76%	0.759	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.8	-20.2	176.9	-69.6	-39.3	0	0	0	114	E227 F229	D225-E227 VanDerWaalsContact C-N 3.28Å; D225-E227 PolarHBondContact O-N 2.98Å; D225-F229 WeakPolarHBondContact O-CD2 3.46Å
226	E	70.5	Confident	65.5	Low	131 Å²	131	111.4 Å²	111.4	61%	0.612	57%	0.574	S	S	*	*	H	α-helix	trans	-57.2	-30.7	176.5	-62.8	-66	160.2	0	0	114.4	T224 W228 F229 M230	T224-E226 PolarHBondContact O-N 3.02Å; E226-W228 PolarHBondContact O-N 3.47Å; E226-F229 PolarHBondContact O-N 2.92Å; E226-M230 WeakPolarHBondContact O-CG 3.23Å; E226-M230 PolarHBondContact O-N 3.33Å
227	E	68.1	Low	68.3	Low	72 Å²	72	110.5 Å²	110.5	34%	0.336	57%	0.565	S	S	.	*	H	α-helix	trans	-65.1	-40.7	-175.2	-70.8	-174.4	-166.6	0	0	112.6	H223 T224 D225 F229 M230 E231	H223-E227 IonicContact CE1-OE1 3.25Å; H223-E227 PolarHBondContact CE1-OE1 3.18Å; H223-E227 IonicContact CE1-OE2 2.91Å; H223-E227 PolarHBondContact CE1-OE2 3.34Å; H223-E227 IonicContact ND1-OE1 3.22Å; H223-E227 PolarHBondContact ND1-OE1 2.86Å; H223-E227 IonicContact ND1-OE2 3.16Å; H223-E227 PolarHBondContact ND1-OE2 2.88Å; T224-E227 PolarHBondContact O-N 3.45Å; T224-E227 VanDerWaalsContact O-N 3.15Å; D225-E227 VanDerWaalsContact C-N 3.28Å; D225-E227 PolarHBondContact O-N 2.98Å; E227-F229 VanDerWaalsContact C-N 3.29Å; E227-F229 PolarHBondContact O-N 3.31Å; E227-M230 PolarHBondContact O-N 2.75Å; E227-E231 WeakPolarHBondContact O-CG 3.32Å; E227-E231 PolarHBondContact O-N 2.89Å; E227-E231 VanDerWaalsContact O-N 3.14Å
228	W	76.9	Confident	70.7	Confident	176 Å²	176	103.8 Å²	103.8	67%	0.667	53%	0.531	S	S	*	.	H	α-helix	trans	-66.4	-33.5	-178	-176.2	75	0	0	0	112.2	E226 S232	E226-W228 PolarHBondContact O-N 3.47Å; W228-S232 VanDerWaalsContact O-CB 3.3Å; W228-S232 WeakPolarHBondContact O-CB 3.43Å; W228-S232 PolarHBondContact O-N 3.01Å; W228-S232 VanDerWaalsContact O-N 3.15Å; W228-S232 PolarHBondContact O-OG 3.24Å
229	F	85	Confident	72.9	Confident	126 Å²	126	102.2 Å²	102.2	55%	0.553	52%	0.518	S	S	*	.	H	α-helix	trans	-68.2	-44.8	175.8	-72.9	-74.9	0	0	0	112.1	D225 E226 E227 S232 F233	D225-F229 WeakPolarHBondContact O-CD2 3.46Å; E226-F229 PolarHBondContact O-N 2.92Å; E227-F229 VanDerWaalsContact C-N 3.29Å; E227-F229 PolarHBondContact O-N 3.31Å; F229-S232 PolarHBondContact O-N 3.3Å; F229-F233 WeakPolarHBondContact O-CB 3.49Å; F229-F233 PolarHBondContact O-N 3.13Å
230	M	86.1	Confident	75.6	Confident	130 Å²	130	99.2 Å²	99.2	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-67.2	-41.1	-177.1	-65.8	-60.8	-90.4	0	0	112.2	E226 E227 F233 L234	E226-M230 WeakPolarHBondContact O-CG 3.23Å; E226-M230 PolarHBondContact O-N 3.33Å; E227-M230 PolarHBondContact O-N 2.75Å; M230-F233 PolarHBondContact O-N 2.87Å; M230-L234 WeakPolarHBondContact O-CB 3.4Å; M230-L234 PolarHBondContact O-N 3.43Å
231	E	85	Confident	78	Confident	39 Å²	39	96.8 Å²	96.8	18%	0.182	49%	0.493	C	S	.	.	H	α-helix	trans	-63.6	-43.7	174.3	-66.5	174.9	177.4	0	0	111.7	E227 L234 H235 L268 R270	E227-E231 WeakPolarHBondContact O-CG 3.32Å; E227-E231 PolarHBondContact O-N 2.89Å; E227-E231 VanDerWaalsContact O-N 3.14Å; E231-L234 PolarHBondContact O-N 3.39Å; E231-H235 WeakPolarHBondContact O-CB 3.35Å; E231-H235 PolarHBondContact O-CD2 3.02Å; E231-H235 PolarHBondContact O-N 3.45Å; E231-L268 HydrophobicContact CB-CD1 3.87Å; E231-L268 HydrophobicContact CG-CD1 3.87Å; E231-R270 IonicContact OE1-CZ 3.04Å; E231-R270 IonicContact OE1-NH1 3.15Å; E231-R270 PolarHBondContact OE1-NH1 3.03Å; E231-R270 IonicContact OE1-NH2 2.94Å; E231-R270 PolarHBondContact OE1-NH2 2.97Å; E231-R270 IonicContact OE2-CZ 2.85Å; E231-R270 IonicContact OE2-NH1 3.63Å; E231-R270 PolarHBondContact OE2-NH1 3.5Å; E231-R270 IonicContact OE2-NH2 2.97Å
232	S	87.7	Confident	80.2	Confident	41 Å²	41	92.2 Å²	92.2	29%	0.287	46%	0.464	S	S	.	.	H	α-helix	trans	-63.1	-42.7	177.1	-64.1	0	0	0	0	111.8	W228 F229 H235 V236	W228-S232 VanDerWaalsContact O-CB 3.3Å; W228-S232 WeakPolarHBondContact O-CB 3.43Å; W228-S232 PolarHBondContact O-N 3.01Å; W228-S232 VanDerWaalsContact O-N 3.15Å; W228-S232 PolarHBondContact O-OG 3.24Å; F229-S232 PolarHBondContact O-N 3.3Å; S232-H235 WeakPolarHBondContact O-CB 3.35Å; S232-H235 PolarHBondContact O-N 3.14Å; S232-V236 WeakPolarHBondContact O-CG2 3.22Å; S232-V236 PolarHBondContact O-N 3.08Å
233	F	91.5	Very high	82.4	Confident	139 Å²	139	90.9 Å²	90.9	61%	0.61	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-46.3	175.4	178.2	-99	0	0	0	111.6	F229 M230 H235 V236 L237	F229-F233 WeakPolarHBondContact O-CB 3.49Å; F229-F233 PolarHBondContact O-N 3.13Å; M230-F233 PolarHBondContact O-N 2.87Å; F233-H235 VanDerWaalsContact C-N 3.31Å; F233-H235 PolarHBondContact O-N 2.87Å; F233-V236 PolarHBondContact O-N 2.83Å; F233-L237 HydrophobicContact CE1-CD2 4.37Å; F233-L237 WeakPolarHBondContact O-CB 3.47Å; F233-L237 PolarHBondContact O-N 2.74Å
234	L	89.8	Confident	84.4	Confident	71 Å²	71	90.5 Å²	90.5	37%	0.372	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-38.1	177.9	-177.3	60.4	0	0	0	111.8	M230 E231 C238 L268 L288	M230-L234 WeakPolarHBondContact O-CB 3.4Å; M230-L234 PolarHBondContact O-N 3.43Å; E231-L234 PolarHBondContact O-N 3.39Å; L234-C238 VanDerWaalsContact O-CB 3.31Å; L234-C238 WeakPolarHBondContact O-CB 3.49Å; L234-C238 PolarHBondContact O-N 2.92Å; L234-L268 HydrophobicContact CD2-CD1 4.42Å; L234-L268 HydrophobicContact CD2-CD2 3.87Å; L234-L288 HydrophobicContact CD1-CD2 4.13Å; L234-L288 HydrophobicContact CD2-CD2 3.61Å; L234-L288 HydrophobicContact CG-CD1 4.48Å; L234-L288 HydrophobicContact CG-CD2 3.56Å
235	H	89.8	Confident	86.1	Confident	35 Å²	35	89.6 Å²	89.6	16%	0.162	45%	0.447	C	S	.	.	H	α-helix	trans	-61.1	-49.3	172.5	-84.1	-49	0	0	0	112.6	E231 S232 F233 C238 I239 R267 L268 L288	E231-H235 WeakPolarHBondContact O-CB 3.35Å; E231-H235 PolarHBondContact O-CD2 3.02Å; E231-H235 PolarHBondContact O-N 3.45Å; S232-H235 WeakPolarHBondContact O-CB 3.35Å; S232-H235 PolarHBondContact O-N 3.14Å; F233-H235 VanDerWaalsContact C-N 3.31Å; F233-H235 PolarHBondContact O-N 2.87Å; H235-C238 PolarHBondContact O-N 2.91Å; H235-I239 VanDerWaalsContact O-CG1 3.32Å; H235-I239 WeakPolarHBondContact O-CG1 3.39Å; H235-I239 PolarHBondContact O-N 3.31Å; H235-R267 WeakPolarHBondContact CE1-CD 3.34Å; H235-R267 WeakPolarHBondContact CE1-CG 3.4Å; H235-R267 WeakPolarHBondContact NE2-CD 3.41Å; H235-L268 WeakPolarHBondContact NE2-CD1 3.44Å; H235-L288 VanDerWaalsContact CE1-CD1 3.48Å; H235-L288 WeakPolarHBondContact CE1-CD1 3.32Å; H235-L288 WeakPolarHBondContact ND1-CD1 3.26Å
236	V	92.8	Very high	87.5	Confident	99 Å²	99	87.2 Å²	87.2	60%	0.6	43%	0.434	S	S	*	.	H	α-helix	trans	-63.2	-43.7	178.6	172.5	0	0	0	0	111	S232 F233 C238 I239 L240	S232-V236 WeakPolarHBondContact O-CG2 3.22Å; S232-V236 PolarHBondContact O-N 3.08Å; F233-V236 PolarHBondContact O-N 2.83Å; V236-C238 VanDerWaalsContact C-N 3.34Å; V236-C238 PolarHBondContact O-N 3.11Å; V236-I239 PolarHBondContact O-N 3.49Å; V236-L240 WeakPolarHBondContact O-CB 3.24Å; V236-L240 PolarHBondContact O-N 3.4Å
237	L	93	Very high	88.3	Confident	83 Å²	83	86.2 Å²	86.2	44%	0.435	44%	0.438	S	S	.	.	H	α-helix	trans	-60.1	-44.1	177.1	-178.3	66.9	0	0	0	111.6	F233 L240 L241	F233-L237 HydrophobicContact CE1-CD2 4.37Å; F233-L237 WeakPolarHBondContact O-CB 3.47Å; F233-L237 PolarHBondContact O-N 2.74Å; L237-L240 PolarHBondContact O-N 2.69Å; L237-L241 WeakPolarHBondContact O-CB 3.47Å; L237-L241 PolarHBondContact O-N 2.87Å
238	C	90.6	Very high	89.3	Confident	13 Å²	13	87.2 Å²	87.2	9%	0.088	45%	0.445	C	S	.	.	H	α-helix	trans	-63.5	-42.5	177	-175.1	0	0	0	0	111.8	L234 H235 V236 L241 I242 P286 L288	L234-C238 VanDerWaalsContact O-CB 3.31Å; L234-C238 WeakPolarHBondContact O-CB 3.49Å; L234-C238 PolarHBondContact O-N 2.92Å; H235-C238 PolarHBondContact O-N 2.91Å; V236-C238 VanDerWaalsContact C-N 3.34Å; V236-C238 PolarHBondContact O-N 3.11Å; C238-L241 PolarHBondContact O-N 2.81Å; C238-I242 VanDerWaalsContact O-CG1 3.25Å; C238-I242 WeakPolarHBondContact O-CG1 3.48Å; C238-I242 PolarHBondContact O-N 3.34Å; C238-P286 PolarHBondContact SG-O 2.98Å; C238-L288 HydrophobicContact CB-CD1 3.5Å; C238-L288 VanDerWaalsContact CB-CD1 3.5Å; C238-L288 HydrophobicContact CB-CG 4.06Å
239	I	90.2	Very high	89.9	Confident	86 Å²	86	79.4 Å²	79.4	44%	0.441	42%	0.417	S	S	.	.	H	α-helix	trans	-64.2	-42.1	176.3	-68.1	166.4	0	0	0	110.7	H235 V236 L241 I242 I243 L285	H235-I239 VanDerWaalsContact O-CG1 3.32Å; H235-I239 WeakPolarHBondContact O-CG1 3.39Å; H235-I239 PolarHBondContact O-N 3.31Å; V236-I239 PolarHBondContact O-N 3.49Å; I239-L241 VanDerWaalsContact C-N 3.35Å; I239-L241 PolarHBondContact O-N 2.9Å; I239-I242 WeakPolarHBondContact O-CB 3.23Å; I239-I242 PolarHBondContact O-N 3.2Å; I239-I243 HydrophobicContact CG2-CD1 4Å; I239-I243 WeakPolarHBondContact O-CG1 3.26Å; I239-I243 PolarHBondContact O-N 3.45Å; I239-L285 HydrophobicContact CG1-CD2 4.36Å
240	L	93.3	Very high	89.9	Confident	90 Å²	90	77.4 Å²	77.4	47%	0.471	41%	0.412	S	S	.	.	H	α-helix	trans	-60.2	-44.5	176	179.9	65.2	0	0	0	111.5	V236 L237 I242 I243 I244	V236-L240 WeakPolarHBondContact O-CB 3.24Å; V236-L240 PolarHBondContact O-N 3.4Å; L237-L240 PolarHBondContact O-N 2.69Å; L240-I242 VanDerWaalsContact C-N 3.35Å; L240-I242 PolarHBondContact O-N 3.3Å; L240-I243 PolarHBondContact O-N 3.38Å; L240-I244 HydrophobicContact CD1-CD1 4.12Å; L240-I244 HydrophobicContact CD1-CG1 4.44Å; L240-I244 HydrophobicContact CG-CD1 3.89Å; L240-I244 WeakPolarHBondContact O-CG1 3.48Å; L240-I244 PolarHBondContact O-N 3.32Å
241	L	90.8	Very high	90	Very high	101 Å²	101	77.1 Å²	77.1	53%	0.529	41%	0.412	S	S	.	.	H	α-helix	trans	-61.6	-43.7	176.6	-153.6	179.4	0	0	0	110.9	L237 C238 I239 I243 I244 T245	L237-L241 WeakPolarHBondContact O-CB 3.47Å; L237-L241 PolarHBondContact O-N 2.87Å; C238-L241 PolarHBondContact O-N 2.81Å; I239-L241 VanDerWaalsContact C-N 3.35Å; I239-L241 PolarHBondContact O-N 2.9Å; L241-I243 VanDerWaalsContact C-N 3.31Å; L241-I243 PolarHBondContact O-N 3.3Å; L241-I244 PolarHBondContact O-N 2.98Å; L241-T245 HydrophobicContact CD2-CG2 3.64Å; L241-T245 WeakPolarHBondContact O-CB 3.33Å; L241-T245 PolarHBondContact O-N 3.13Å; L241-T245 PolarHBondContact O-OG1 3.22Å
242	I	90.6	Very high	90.1	Very high	20 Å²	20	81.1 Å²	81.1	10%	0.103	43%	0.429	C	S	.	.	H	α-helix	trans	-57.7	-45	175.6	-69.6	163.8	0	0	0	110.6	C238 I239 L240 T245 L246 S249 L285 P286	C238-I242 VanDerWaalsContact O-CG1 3.25Å; C238-I242 WeakPolarHBondContact O-CG1 3.48Å; C238-I242 PolarHBondContact O-N 3.34Å; I239-I242 WeakPolarHBondContact O-CB 3.23Å; I239-I242 PolarHBondContact O-N 3.2Å; L240-I242 VanDerWaalsContact C-N 3.35Å; L240-I242 PolarHBondContact O-N 3.3Å; I242-T245 PolarHBondContact O-N 2.97Å; I242-T245 PolarHBondContact O-OG1 3.35Å; I242-L246 WeakPolarHBondContact O-CG 3.44Å; I242-L246 PolarHBondContact O-N 3.46Å; I242-S249 PolarHBondContact O-OG 3.33Å; I242-L285 HydrophobicContact CD1-CG 4.28Å; I242-P286 HydrophobicContact CD1-CG 4.22Å; I242-P286 HydrophobicContact CG1-CG 4.14Å
243	I	91.8	Very high	90.1	Very high	102 Å²	102	79.1 Å²	79.1	52%	0.523	42%	0.415	S	S	.	.	H	α-helix	trans	-64	-47.3	179.3	-68.3	166.7	0	0	0	111.3	I239 L240 L241 T245 L246	I239-I243 HydrophobicContact CG2-CD1 4Å; I239-I243 WeakPolarHBondContact O-CG1 3.26Å; I239-I243 PolarHBondContact O-N 3.45Å; L240-I243 PolarHBondContact O-N 3.38Å; L241-I243 VanDerWaalsContact C-N 3.31Å; L241-I243 PolarHBondContact O-N 3.3Å; I243-T245 PolarHBondContact O-N 3.03Å; I243-L246 PolarHBondContact O-N 2.92Å
244	I	94.1	Very high	90	Very high	128 Å²	128	75.5 Å²	75.5	66%	0.656	40%	0.402	S	S	*	.	H	α-helix	trans	-61.7	-33.3	-179.7	-69.5	168.1	0	0	0	111.5	L240 L241	L240-I244 HydrophobicContact CD1-CD1 4.12Å; L240-I244 HydrophobicContact CD1-CG1 4.44Å; L240-I244 HydrophobicContact CG-CD1 3.89Å; L240-I244 WeakPolarHBondContact O-CG1 3.48Å; L240-I244 PolarHBondContact O-N 3.32Å; L241-I244 PolarHBondContact O-N 2.98Å
245	T	90.6	Very high	90.1	Very high	58 Å²	58	76.6 Å²	76.6	36%	0.356	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	9.5	-176.5	54.3	0	0	0	0	114.2	L241 I242 I243 L248 S249	L241-T245 HydrophobicContact CD2-CG2 3.64Å; L241-T245 WeakPolarHBondContact O-CB 3.33Å; L241-T245 PolarHBondContact O-N 3.13Å; L241-T245 PolarHBondContact O-OG1 3.22Å; I242-T245 PolarHBondContact O-N 2.97Å; I242-T245 PolarHBondContact O-OG1 3.35Å; I243-T245 PolarHBondContact O-N 3.03Å; T245-L248 PolarHBondContact O-N 2.93Å; T245-L248 VanDerWaalsContact O-N 3.08Å; T245-S249 PolarHBondContact O-N 2.97Å; T245-S249 WeakPolarHBondContact OG1-CB 3.49Å
246	L	88.8	Confident	90.2	Very high	92 Å²	92	79.4 Å²	79.4	48%	0.482	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	140.8	172.1	-82.2	175.1	0	0	0	110.8	I242 I243 L250	I242-L246 WeakPolarHBondContact O-CG 3.44Å; I242-L246 PolarHBondContact O-N 3.46Å; I243-L246 PolarHBondContact O-N 2.92Å; L246-L250 HydrophobicContact CD2-CB 3.8Å; L246-L250 HydrophobicContact CD2-CD1 4.2Å
247	P	88.6	Confident	90.2	Very high	109 Å²	109	75 Å²	75	71%	0.708	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.7	-6.4	8.8	35.2	-36	0	0	0	115	S249 L250	P247-S249 VanDerWaalsContact C-N 3.35Å; P247-S249 PolarHBondContact O-N 2.91Å; P247-L250 WeakPolarHBondContact O-CB 3.33Å; P247-L250 PolarHBondContact O-N 3.44Å
248	L	88	Confident	90.2	Very high	94 Å²	94	73.4 Å²	73.4	49%	0.492	39%	0.39	S	S	.	.	H	α-helix	trans	-63.4	-38.7	-169.9	-177.8	63.1	0	0	0	112.6	F45 T245 L250 I251 F252	F45-L248 HydrophobicContact CE1-CD2 4.4Å; T245-L248 PolarHBondContact O-N 2.93Å; T245-L248 VanDerWaalsContact O-N 3.08Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.49Å; L248-I251 PolarHBondContact O-N 2.9Å; L248-F252 HydrophobicContact CD1-CE2 4.4Å; L248-F252 HydrophobicContact CG-CE2 4.43Å
249	S	89	Confident	90.4	Very high	11 Å²	11	80.1 Å²	80.1	8%	0.077	42%	0.42	C	S	.	.	H	α-helix	trans	-60.5	-33.3	178.5	57	0	0	0	0	113.4	I242 T245 P247 I251 F252 C253	I242-S249 PolarHBondContact O-OG 3.33Å; T245-S249 PolarHBondContact O-N 2.97Å; T245-S249 WeakPolarHBondContact OG1-CB 3.49Å; P247-S249 VanDerWaalsContact C-N 3.35Å; P247-S249 PolarHBondContact O-N 2.91Å; S249-I251 VanDerWaalsContact C-N 3.28Å; S249-I251 PolarHBondContact O-N 2.74Å; S249-F252 PolarHBondContact O-N 2.86Å; S249-F252 VanDerWaalsContact O-N 3.09Å; S249-C253 PolarHBondContact O-N 2.89Å; S249-C253 PolarHBondContact O-SG 3.32Å
250	L	86.8	Confident	90.6	Very high	84 Å²	84	80.8 Å²	80.8	44%	0.44	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-34.8	-175.6	-171.1	152.6	0	0	0	112.2	L246 P247 L248 F252 C253 L254	L246-L250 HydrophobicContact CD2-CB 3.8Å; L246-L250 HydrophobicContact CD2-CD1 4.2Å; P247-L250 WeakPolarHBondContact O-CB 3.33Å; P247-L250 PolarHBondContact O-N 3.44Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.49Å; L250-F252 VanDerWaalsContact C-N 3.3Å; L250-F252 PolarHBondContact O-N 3.15Å; L250-C253 PolarHBondContact O-N 3.25Å; L250-L254 HydrophobicContact CD2-CD1 3.3Å; L250-L254 HydrophobicContact CD2-CG 3.88Å; L250-L254 HydrophobicContact CG-CD1 4.08Å; L250-L254 HydrophobicContact CG-CG 4.25Å; L250-L254 WeakPolarHBondContact O-CB 3.36Å; L250-L254 WeakPolarHBondContact O-CG 3.46Å; L250-L254 PolarHBondContact O-N 3.07Å
251	I	87.9	Confident	90.7	Very high	125 Å²	125	79 Å²	79	64%	0.641	41%	0.407	S	S	*	.	H	α-helix	trans	-63.5	-38.6	177	-61.2	173.1	0	0	0	110.9	L248 S249	L248-I251 PolarHBondContact O-N 2.9Å; S249-I251 VanDerWaalsContact C-N 3.28Å; S249-I251 PolarHBondContact O-N 2.74Å
252	F	85.6	Confident	90.9	Very high	122 Å²	122	77.7 Å²	77.7	54%	0.535	40%	0.395	S	S	.	.	H	α-helix	trans	-76.7	-33	177.1	-69.1	-77.6	0	0	0	112.5	L248 S249 L250	L248-F252 HydrophobicContact CD1-CE2 4.4Å; L248-F252 HydrophobicContact CG-CE2 4.43Å; S249-F252 PolarHBondContact O-N 2.86Å; S249-F252 VanDerWaalsContact O-N 3.09Å; L250-F252 VanDerWaalsContact C-N 3.3Å; L250-F252 PolarHBondContact O-N 3.15Å
253	C	87.7	Confident	91.1	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-73.3	-29.6	179.4	-61.4	0	0	0	0	113.3	S249 L250 F283 V284 P286	S249-C253 PolarHBondContact O-N 2.89Å; S249-C253 PolarHBondContact O-SG 3.32Å; L250-C253 PolarHBondContact O-N 3.25Å; C253-F283 HydrophobicContact CB-CD2 3.93Å; C253-F283 HydrophobicContact CB-CE2 3.5Å; C253-F283 HydrophobicContact CB-CZ 4.15Å; C253-V284 VanDerWaalsContact CA-O 3.26Å; C253-V284 WeakPolarHBondContact CA-O 3.06Å; C253-V284 PolarHBondContact O-N 3.36Å; C253-P286 WeakPolarHBondContact SG-CD 3.44Å
254	L	90.8	Very high	91.2	Very high	63 Å²	63	72.1 Å²	72.1	33%	0.33	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	104.7	-175.5	-72.9	-166.2	0	0	0	111.4	L250 L281 F283	L250-L254 HydrophobicContact CD2-CD1 3.3Å; L250-L254 HydrophobicContact CD2-CG 3.88Å; L250-L254 HydrophobicContact CG-CD1 4.08Å; L250-L254 HydrophobicContact CG-CG 4.25Å; L250-L254 WeakPolarHBondContact O-CB 3.36Å; L250-L254 WeakPolarHBondContact O-CG 3.46Å; L250-L254 PolarHBondContact O-N 3.07Å; L254-L281 HydrophobicContact CB-CD1 3.92Å; L254-L281 HydrophobicContact CD1-CD1 4.3Å; L254-L281 HydrophobicContact CD1-CD2 4.13Å; L254-L281 HydrophobicContact CD2-CD1 4.08Å; L254-L281 HydrophobicContact CD2-CD2 3.92Å; L254-L281 HydrophobicContact CD2-CG 3.99Å; L254-L281 HydrophobicContact CG-CD1 4.33Å; L254-F283 HydrophobicContact CD2-CD2 4.07Å
255	K	90.4	Very high	91.1	Very high	94 Å²	94	66.7 Å²	66.7	41%	0.409	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.6	174.6	-174.6	77.1	178.3	73.1	0	109.7	I282	K255-I282 HydrophobicContact CB-CD1 4.34Å; K255-I282 HydrophobicContact CB-CG1 3.93Å; K255-I282 HydrophobicContact CG-CG1 4.48Å; K255-I282 PolarHBondContact N-O 3.34Å; K255-I282 VanDerWaalsContact N-O 3.08Å; K255-I282 VanDerWaalsContact O-CG1 3.23Å; K255-I282 WeakPolarHBondContact O-CG1 3.29Å; K255-I282 PolarHBondContact O-N 3.13Å
256	V	91.9	Very high	91.2	Very high	93 Å²	93	65.6 Å²	65.6	56%	0.564	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	134.5	171.7	-176.3	0	0	0	0	109.8	G280 L281	V256-G280 WeakPolarHBondContact CA-O 3.41Å; V256-L281 HydrophobicContact CG2-CD1 3.96Å
257	V	93.4	Very high	91.3	Very high	6 Å²	6	64.7 Å²	64.7	4%	0.036	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.1	173.8	179.4	0	0	0	0	109.2	E261 A263 G280 I282	V257-E261 HydrophobicContact CG1-CB 3.69Å; V257-A263 HydrophobicContact CG2-CB 4.02Å; V257-G280 PolarHBondContact N-O 3.46Å; V257-G280 PolarHBondContact O-N 3.17Å; V257-I282 HydrophobicContact CG2-CD1 3.57Å; V257-I282 HydrophobicContact CG2-CG1 3.93Å; V257-I282 HydrophobicContact CG2-CG2 4.19Å
258	T	94.1	Very high	91.3	Very high	51 Å²	51	62.5 Å²	62.5	31%	0.313	30%	0.301	S	S	.	.			trans	-75.9	162.9	-178	68.9	0	0	0	0	112.2	Y260 E261 P279	T258-Y260 VanDerWaalsContact C-N 3.3Å; T258-Y260 PolarHBondContact O-N 2.96Å; T258-Y260 WeakPolarHBondContact OG1-CE2 3.31Å; T258-E261 PolarHBondContact O-N 2.84Å; T258-E261 VanDerWaalsContact O-N 3.13Å; T258-E261 WeakPolarHBondContact OG1-CB 3.25Å; T258-E261 VanDerWaalsContact OG1-CG 3.24Å; T258-E261 WeakPolarHBondContact OG1-CG 3.44Å; T258-E261 PolarHBondContact OG1-OE2 2.88Å; T258-P279 VanDerWaalsContact O-CB 3.3Å; T258-P279 WeakPolarHBondContact O-CB 3.36Å
259	H	93.9	Very high	91.2	Very high	154 Å²	154	61.1 Å²	61.1	71%	0.713	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-35.7	-175.2	-168.3	79.7	0	0	0	114.7	E261 P279	H259-E261 VanDerWaalsContact C-N 3.32Å; H259-P279 VanDerWaalsContact CA-CB 3.45Å; H259-P279 HydrophobicContact CB-CB 4.43Å
260	Y	94.7	Very high	91.2	Very high	99 Å²	99	66.8 Å²	66.8	39%	0.388	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	0.4	-178.1	51.9	-94.3	0	0	0	113	T258 L296	T258-Y260 VanDerWaalsContact C-N 3.3Å; T258-Y260 PolarHBondContact O-N 2.96Å; T258-Y260 WeakPolarHBondContact OG1-CE2 3.31Å; Y260-L296 WeakPolarHBondContact O-CB 3.27Å; Y260-L296 PolarHBondContact O-N 2.99Å
261	E	95.4	Very high	91.3	Very high	52 Å²	52	66.3 Å²	66.3	24%	0.243	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	155.5	179.1	-73.6	169.5	166.9	0	0	111.6	V257 T258 H259 V293 L294	V257-E261 HydrophobicContact CG1-CB 3.69Å; T258-E261 PolarHBondContact O-N 2.84Å; T258-E261 VanDerWaalsContact O-N 3.13Å; T258-E261 WeakPolarHBondContact OG1-CB 3.25Å; T258-E261 VanDerWaalsContact OG1-CG 3.24Å; T258-E261 WeakPolarHBondContact OG1-CG 3.44Å; T258-E261 PolarHBondContact OG1-OE2 2.88Å; H259-E261 VanDerWaalsContact C-N 3.32Å; E261-V293 HydrophobicContact CB-CG1 3.68Å; E261-V293 HydrophobicContact CG-CG1 3.84Å; E261-L294 CarbonylContact C-O 3.47Å; E261-L294 VanDerWaalsContact CA-O 3.27Å; E261-L294 WeakPolarHBondContact CA-O 3.36Å
262	R	94.6	Very high	91.2	Very high	75 Å²	75	63 Å²	63	28%	0.283	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.4	171.6	-65.5	-66.3	174.4	148.4	-4.2	110.4	A276 V293 L294 L296 P329	R262-A276 HydrophobicContact CB-CB 4.01Å; R262-V293 WeakPolarHBondContact O-CA 3.26Å; R262-L294 PolarHBondContact N-O 3.41Å; R262-L294 PolarHBondContact O-N 3.36Å; R262-L296 HydrophobicContact CG-CD1 3.47Å; R262-L296 VanDerWaalsContact CG-CD1 3.47Å; R262-L296 HydrophobicContact CG-CD2 4.01Å; R262-L296 HydrophobicContact CG-CG 3.88Å; R262-P329 HydrophobicContact CB-CB 4.18Å; R262-P329 HydrophobicContact CB-CG 3.88Å; R262-P329 HydrophobicContact CG-CG 4.21Å
263	A	94.1	Very high	91.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.6	175.4	0	0	0	0	0	110.5	V257 L265 K277 I282 R292	V257-A263 HydrophobicContact CG2-CB 4.02Å; A263-L265 HydrophobicContact CB-CD1 4.02Å; A263-L265 WeakPolarHBondContact O-CD1 3.33Å; A263-K277 PolarHBondContact N-O 3.29Å; A263-K277 PolarHBondContact O-N 3.42Å; A263-I282 HydrophobicContact CB-CD1 3.74Å; A263-R292 WeakPolarHBondContact CA-O 3.45Å
264	V	93.7	Very high	91.1	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.024	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.4	167.4	-175	0	0	0	0	107.4	F266 A276 Y291 R292 P329 V330 V333	V264-F266 HydrophobicContact CB-CE2 4.24Å; V264-F266 HydrophobicContact CG1-CD2 4.47Å; V264-F266 HydrophobicContact CG1-CE1 4.43Å; V264-F266 HydrophobicContact CG1-CE2 3.67Å; V264-F266 HydrophobicContact CG1-CZ 3.64Å; V264-A276 HydrophobicContact CG2-CB 4.22Å; V264-Y291 CarbonylContact O-C 3.55Å; V264-Y291 WeakPolarHBondContact O-CA 3.46Å; V264-R292 PolarHBondContact N-O 2.84Å; V264-R292 PolarHBondContact O-N 3.27Å; V264-P329 HydrophobicContact CG2-CB 4.21Å; V264-P329 WeakPolarHBondContact CG2-O 3.44Å; V264-V330 HydrophobicContact CG2-CG2 4.43Å; V264-V333 HydrophobicContact CG2-CG2 4.14Å
265	L	93.1	Very high	91	Very high	14 Å²	14	65.8 Å²	65.8	7%	0.073	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.1	-176.4	-68.1	81.2	0	0	0	110.4	A263 V272 K277 V284	A263-L265 HydrophobicContact CB-CD1 4.02Å; A263-L265 WeakPolarHBondContact O-CD1 3.33Å; L265-V272 HydrophobicContact CB-CB 4.26Å; L265-V272 HydrophobicContact CB-CG2 4.07Å; L265-V272 PolarHBondContact O-N 3.13Å; L265-K277 HydrophobicContact CD1-CB 3.8Å; L265-K277 HydrophobicContact CD1-CG 3.42Å; L265-K277 VanDerWaalsContact CD1-CG 3.42Å; L265-V284 HydrophobicContact CD2-CG2 4.21Å
266	F	93.2	Very high	91	Very high	35 Å²	35	61.9 Å²	61.9	15%	0.154	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.6	172.7	-57.9	-87.1	0	0	0	108.8	V264 R270 L271 D289 R290 R292 V333 V334	V264-F266 HydrophobicContact CB-CE2 4.24Å; V264-F266 HydrophobicContact CG1-CD2 4.47Å; V264-F266 HydrophobicContact CG1-CE1 4.43Å; V264-F266 HydrophobicContact CG1-CE2 3.67Å; V264-F266 HydrophobicContact CG1-CZ 3.64Å; F266-R270 CarbonylContact C-O 3.48Å; F266-R270 VanDerWaalsContact CA-O 3.25Å; F266-R270 WeakPolarHBondContact CA-O 3.24Å; F266-L271 HydrophobicContact CD1-CD1 3.95Å; F266-L271 HydrophobicContact CD1-CG 4.14Å; F266-L271 HydrophobicContact CE1-CD1 3.58Å; F266-L271 HydrophobicContact CE1-CG 3.83Å; F266-D289 CarbonylContact O-C 3.6Å; F266-D289 VanDerWaalsContact O-CA 3.29Å; F266-D289 WeakPolarHBondContact O-CA 3.4Å; F266-R290 PolarHBondContact N-O 3.13Å; F266-R290 PolarHBondContact O-N 2.93Å; F266-R290 VanDerWaalsContact O-O 3.14Å; F266-R292 HydrophobicContact CE2-CG 4.45Å; F266-V333 HydrophobicContact CE2-CG1 3.94Å; F266-V333 HydrophobicContact CZ-CB 4.42Å; F266-V333 HydrophobicContact CZ-CG1 3.7Å; F266-V334 HydrophobicContact CE1-CG2 4.32Å; F266-V334 HydrophobicContact CZ-CG2 4.42Å
267	R	90	Very high	90.9	Very high	73 Å²	73	61.8 Å²	61.8	28%	0.275	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.1	178.5	173	172	-72.6	172.1	13	108.1	H235 G269 R270 V272 D289	H235-R267 WeakPolarHBondContact CE1-CD 3.34Å; H235-R267 WeakPolarHBondContact CE1-CG 3.4Å; H235-R267 WeakPolarHBondContact NE2-CD 3.41Å; R267-G269 PolarHBondContact O-N 3.46Å; R267-G269 VanDerWaalsContact O-N 3.1Å; R267-R270 PolarHBondContact N-O 2.98Å; R267-R270 PolarHBondContact O-N 3.32Å; R267-V272 HydrophobicContact CB-CG2 3.35Å; R267-V272 HydrophobicContact CG-CG2 4.47Å; R267-D289 WeakPolarHBondContact CB-OD1 3.48Å; R267-D289 WeakPolarHBondContact CG-OD1 3.37Å; R267-D289 IonicContact CZ-OD1 2.88Å; R267-D289 IonicContact CZ-OD2 3.13Å; R267-D289 IonicContact NE-OD1 3.3Å; R267-D289 PolarHBondContact NE-OD1 3.07Å; R267-D289 IonicContact NE-OD2 2.69Å; R267-D289 IonicContact NH2-OD1 2.93Å; R267-D289 PolarHBondContact NH2-OD1 2.91Å; R267-D289 IonicContact NH2-OD2 3.01Å; R267-D289 PolarHBondContact NH2-OD2 3.16Å
268	L	88.1	Confident	90.1	Very high	63 Å²	63	62.8 Å²	62.8	33%	0.33	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	37.6	-174.2	-58.4	177.4	0	0	0	112.1	E231 L234 H235 R270 L288	E231-L268 HydrophobicContact CB-CD1 3.87Å; E231-L268 HydrophobicContact CG-CD1 3.87Å; L234-L268 HydrophobicContact CD2-CD1 4.42Å; L234-L268 HydrophobicContact CD2-CD2 3.87Å; H235-L268 WeakPolarHBondContact NE2-CD1 3.44Å; L268-R270 VanDerWaalsContact C-N 3.3Å; L268-R270 PolarHBondContact O-N 3.07Å; L268-L288 HydrophobicContact CD2-CD2 3.95Å; L268-L288 PolarHBondContact N-O 2.98Å
269	G	86.4	Confident	89.7	Confident	66 Å²	66	62.6 Å²	62.6	68%	0.68	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-10.8	-178	0	0	0	0	0	116	R267	R267-G269 PolarHBondContact O-N 3.46Å; R267-G269 VanDerWaalsContact O-N 3.1Å
270	R	88.8	Confident	89.6	Confident	130 Å²	130	56.7 Å²	56.7	49%	0.491	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	147.5	178.6	-57	-157.7	-171.5	99.3	5.8	112.3	E231 F266 R267 L268 V272	E231-R270 IonicContact OE1-CZ 3.04Å; E231-R270 IonicContact OE1-NH1 3.15Å; E231-R270 PolarHBondContact OE1-NH1 3.03Å; E231-R270 IonicContact OE1-NH2 2.94Å; E231-R270 PolarHBondContact OE1-NH2 2.97Å; E231-R270 IonicContact OE2-CZ 2.85Å; E231-R270 IonicContact OE2-NH1 3.63Å; E231-R270 PolarHBondContact OE2-NH1 3.5Å; E231-R270 IonicContact OE2-NH2 2.97Å; F266-R270 CarbonylContact C-O 3.48Å; F266-R270 VanDerWaalsContact CA-O 3.25Å; F266-R270 WeakPolarHBondContact CA-O 3.24Å; R267-R270 PolarHBondContact N-O 2.98Å; R267-R270 PolarHBondContact O-N 3.32Å; L268-R270 VanDerWaalsContact C-N 3.3Å; L268-R270 PolarHBondContact O-N 3.07Å; R270-V272 PolarHBondContact O-N 3.33Å
271	L	88.7	Confident	89.4	Confident	73 Å²	73	57.3 Å²	57.3	38%	0.382	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	125.1	174.4	-78.3	78.2	0	0	0	110.1	F266 S273 V330 V334	F266-L271 HydrophobicContact CD1-CD1 3.95Å; F266-L271 HydrophobicContact CD1-CG 4.14Å; F266-L271 HydrophobicContact CE1-CD1 3.58Å; F266-L271 HydrophobicContact CE1-CG 3.83Å; L271-S273 VanDerWaalsContact C-N 3.34Å; L271-V330 HydrophobicContact CD2-CG1 3.33Å; L271-V334 HydrophobicContact CD1-CG2 3.97Å; L271-V334 HydrophobicContact CD2-CG2 3.91Å; L271-V334 HydrophobicContact CG-CG2 4.41Å
272	V	87.3	Confident	89.2	Confident	55 Å²	55	55.3 Å²	55.3	33%	0.333	32%	0.323	S	S	.	.	S	Bend	trans	-69.9	-34.4	179.4	178	0	0	0	0	111.8	L265 R267 R270	L265-V272 HydrophobicContact CB-CB 4.26Å; L265-V272 HydrophobicContact CB-CG2 4.07Å; L265-V272 PolarHBondContact O-N 3.13Å; R267-V272 HydrophobicContact CB-CG2 3.35Å; R267-V272 HydrophobicContact CG-CG2 4.47Å; R270-V272 PolarHBondContact O-N 3.33Å
273	S	85.2	Confident	89	Confident	50 Å²	50	57 Å²	57	35%	0.35	33%	0.333	S	S	.	.			trans	-144.9	144.1	-177.5	-164.6	0	0	0	0	110.1	L271 T275	L271-S273 VanDerWaalsContact C-N 3.34Å; S273-T275 PolarHBondContact O-N 3.28Å
274	A	85.1	Confident	88.8	Confident	90 Å²	90	57.6 Å²	57.6	74%	0.744	34%	0.336	S	S	*	.	S	Bend	trans	-64.2	-24	176.2	0	0	0	0	0	112.8
275	T	88.8	Confident	88.7	Confident	105 Å²	105	57.8 Å²	57.8	64%	0.644	34%	0.337	S	S	*	.	S	Bend	trans	-112.5	138.5	178.9	-50.5	0	0	0	0	109.8	S273	S273-T275 PolarHBondContact O-N 3.28Å
276	A	89.9	Confident	88.2	Confident	12 Å²	12	59.3 Å²	59.3	10%	0.099	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-61.5	141.4	175	0	0	0	0	0	111.7	R262 V264 G278 P329 V330	R262-A276 HydrophobicContact CB-CB 4.01Å; V264-A276 HydrophobicContact CG2-CB 4.22Å; A276-G278 PolarHBondContact O-N 3.25Å; A276-P329 HydrophobicContact CB-CB 4.25Å; A276-P329 HydrophobicContact CB-CG 3.4Å; A276-V330 HydrophobicContact CB-CG2 3.89Å
277	K	89.7	Confident	87.8	Confident	91 Å²	91	63.9 Å²	63.9	40%	0.396	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-70.2	131.5	-179.8	-66.8	-67.2	-175.3	177.8	0	109.2	A263 L265 I282	A263-K277 PolarHBondContact N-O 3.29Å; A263-K277 PolarHBondContact O-N 3.42Å; L265-K277 HydrophobicContact CD1-CB 3.8Å; L265-K277 HydrophobicContact CD1-CG 3.42Å; L265-K277 VanDerWaalsContact CD1-CG 3.42Å; K277-I282 HydrophobicContact CB-CG2 3.92Å
278	G	76.1	Confident	87.8	Confident	27 Å²	27	61 Å²	61	28%	0.278	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-76.4	173.9	-175.1	0	0	0	0	0	113.8	A276	A276-G278 PolarHBondContact O-N 3.25Å
279	P	87.2	Confident	87.9	Confident	47 Å²	47	58.8 Å²	58.8	31%	0.305	36%	0.361	S	S	.	.	S	Bend	trans	-64	157.4	-176.1	30.8	-38.4	0	0	0	111.6	T258 H259	T258-P279 VanDerWaalsContact O-CB 3.3Å; T258-P279 WeakPolarHBondContact O-CB 3.36Å; H259-P279 VanDerWaalsContact CA-CB 3.45Å; H259-P279 HydrophobicContact CB-CB 4.43Å
280	G	92.3	Very high	88.2	Confident	30 Å²	30	65.5 Å²	65.5	31%	0.309	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	101.2	-151.9	-173.2	0	0	0	0	0	111.8	V256 V257 I282	V256-G280 WeakPolarHBondContact CA-O 3.41Å; V257-G280 PolarHBondContact N-O 3.46Å; V257-G280 PolarHBondContact O-N 3.17Å; G280-I282 PolarHBondContact O-N 3.36Å
281	L	90.3	Very high	88.3	Confident	112 Å²	112	63.7 Å²	63.7	59%	0.586	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.5	-171.4	-167.8	67.4	0	0	0	110.7	L254 V256	L254-L281 HydrophobicContact CB-CD1 3.92Å; L254-L281 HydrophobicContact CD1-CD1 4.3Å; L254-L281 HydrophobicContact CD1-CD2 4.13Å; L254-L281 HydrophobicContact CD2-CD1 4.08Å; L254-L281 HydrophobicContact CD2-CD2 3.92Å; L254-L281 HydrophobicContact CD2-CG 3.99Å; L254-L281 HydrophobicContact CG-CD1 4.33Å; V256-L281 HydrophobicContact CG2-CD1 3.96Å
282	I	90.2	Very high	88.5	Confident	10 Å²	10	68.2 Å²	68.2	5%	0.051	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.8	172.2	63.7	166	0	0	0	109.5	K255 V257 A263 K277 G280 V284	K255-I282 HydrophobicContact CB-CD1 4.34Å; K255-I282 HydrophobicContact CB-CG1 3.93Å; K255-I282 HydrophobicContact CG-CG1 4.48Å; K255-I282 PolarHBondContact N-O 3.34Å; K255-I282 VanDerWaalsContact N-O 3.08Å; K255-I282 VanDerWaalsContact O-CG1 3.23Å; K255-I282 WeakPolarHBondContact O-CG1 3.29Å; K255-I282 PolarHBondContact O-N 3.13Å; V257-I282 HydrophobicContact CG2-CD1 3.57Å; V257-I282 HydrophobicContact CG2-CG1 3.93Å; V257-I282 HydrophobicContact CG2-CG2 4.19Å; A263-I282 HydrophobicContact CB-CD1 3.74Å; K277-I282 HydrophobicContact CB-CG2 3.92Å; G280-I282 PolarHBondContact O-N 3.36Å; I282-V284 HydrophobicContact CD1-CG2 3.85Å; I282-V284 HydrophobicContact CG1-CG2 4.11Å
283	F	90.2	Very high	88.8	Confident	110 Å²	110	68.5 Å²	68.5	48%	0.482	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	118.8	174.4	-173.7	-101.4	0	0	0	109.1	C253 L254 L285	C253-F283 HydrophobicContact CB-CD2 3.93Å; C253-F283 HydrophobicContact CB-CE2 3.5Å; C253-F283 HydrophobicContact CB-CZ 4.15Å; L254-F283 HydrophobicContact CD2-CD2 4.07Å; F283-L285 HydrophobicContact CD1-CD1 3.77Å; F283-L285 HydrophobicContact CE1-CD1 3.45Å; F283-L285 VanDerWaalsContact CE1-CD1 3.45Å; F283-L285 HydrophobicContact CE1-CG 4.13Å
284	V	91.5	Very high	89.2	Confident	12 Å²	12	68.1 Å²	68.1	7%	0.073	37%	0.367	C	S	.	.			trans	-119.5	127	-179	-179.2	0	0	0	0	107.8	C253 L265 I282 P286 D289 Y291	C253-V284 VanDerWaalsContact CA-O 3.26Å; C253-V284 WeakPolarHBondContact CA-O 3.06Å; C253-V284 PolarHBondContact O-N 3.36Å; L265-V284 HydrophobicContact CD2-CG2 4.21Å; I282-V284 HydrophobicContact CD1-CG2 3.85Å; I282-V284 HydrophobicContact CG1-CG2 4.11Å; V284-P286 WeakPolarHBondContact O-CD 3.48Å; V284-D289 HydrophobicContact CG1-CB 3.71Å; V284-Y291 HydrophobicContact CG1-CD1 4Å; V284-Y291 HydrophobicContact CG1-CE1 4.45Å; V284-Y291 HydrophobicContact CG2-CD1 4.26Å
285	L	90.2	Very high	89.7	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	34%	0.339	C	S	.	.			trans	-77.9	122.4	176.6	-79.8	71.3	0	0	0	110	I239 I242 F283 C287 L288 D289	I239-L285 HydrophobicContact CG1-CD2 4.36Å; I242-L285 HydrophobicContact CD1-CG 4.28Å; F283-L285 HydrophobicContact CD1-CD1 3.77Å; F283-L285 HydrophobicContact CE1-CD1 3.45Å; F283-L285 VanDerWaalsContact CE1-CD1 3.45Å; F283-L285 HydrophobicContact CE1-CG 4.13Å; L285-C287 PolarHBondContact O-N 3.3Å; L285-L288 HydrophobicContact CB-CB 4.44Å; L285-L288 HydrophobicContact CD2-CD1 4.24Å; L285-D289 WeakPolarHBondContact CD1-OD2 3.49Å; L285-D289 PolarHBondContact N-OD2 3.4Å; L285-D289 PolarHBondContact O-N 2.98Å
286	P	83.4	Confident	90	Very high	46 Å²	46	62.2 Å²	62.2	30%	0.299	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	139.5	171	25.3	-34	0	0	0	109.3	C238 I242 C253 V284 L288	C238-P286 PolarHBondContact SG-O 2.98Å; I242-P286 HydrophobicContact CD1-CG 4.22Å; I242-P286 HydrophobicContact CG1-CG 4.14Å; C253-P286 WeakPolarHBondContact SG-CD 3.44Å; V284-P286 WeakPolarHBondContact O-CD 3.48Å; P286-L288 VanDerWaalsContact C-N 3.35Å; P286-L288 PolarHBondContact O-N 3.46Å
287	C	84.2	Confident	90.3	Very high	130 Å²	130	68.1 Å²	68.1	88%	0.878	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-41.1	-177.1	-45.3	0	0	0	0	117.1	L285	L285-C287 PolarHBondContact O-N 3.3Å
288	L	89.8	Confident	90.6	Very high	14 Å²	14	66.7 Å²	66.7	7%	0.073	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-34.3	-171.9	-54.4	-176.1	0	0	0	114.1	L234 H235 C238 L268 L285 P286	L234-L288 HydrophobicContact CD1-CD2 4.13Å; L234-L288 HydrophobicContact CD2-CD2 3.61Å; L234-L288 HydrophobicContact CG-CD1 4.48Å; L234-L288 HydrophobicContact CG-CD2 3.56Å; H235-L288 VanDerWaalsContact CE1-CD1 3.48Å; H235-L288 WeakPolarHBondContact CE1-CD1 3.32Å; H235-L288 WeakPolarHBondContact ND1-CD1 3.26Å; C238-L288 HydrophobicContact CB-CD1 3.5Å; C238-L288 VanDerWaalsContact CB-CD1 3.5Å; C238-L288 HydrophobicContact CB-CG 4.06Å; L268-L288 HydrophobicContact CD2-CD2 3.95Å; L268-L288 PolarHBondContact N-O 2.98Å; L285-L288 HydrophobicContact CB-CB 4.44Å; L285-L288 HydrophobicContact CD2-CD1 4.24Å; P286-L288 VanDerWaalsContact C-N 3.35Å; P286-L288 PolarHBondContact O-N 3.46Å
289	D	91.5	Very high	91.5	Very high	15 Å²	15	68.9 Å²	68.9	8%	0.08	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.3	-175	-67.8	-8.2	0	0	0	110.1	F266 R267 V284 L285	F266-D289 CarbonylContact O-C 3.6Å; F266-D289 VanDerWaalsContact O-CA 3.29Å; F266-D289 WeakPolarHBondContact O-CA 3.4Å; R267-D289 WeakPolarHBondContact CB-OD1 3.48Å; R267-D289 WeakPolarHBondContact CG-OD1 3.37Å; R267-D289 IonicContact CZ-OD1 2.88Å; R267-D289 IonicContact CZ-OD2 3.13Å; R267-D289 IonicContact NE-OD1 3.3Å; R267-D289 PolarHBondContact NE-OD1 3.07Å; R267-D289 IonicContact NE-OD2 2.69Å; R267-D289 IonicContact NH2-OD1 2.93Å; R267-D289 PolarHBondContact NH2-OD1 2.91Å; R267-D289 IonicContact NH2-OD2 3.01Å; R267-D289 PolarHBondContact NH2-OD2 3.16Å; V284-D289 HydrophobicContact CG1-CB 3.71Å; L285-D289 WeakPolarHBondContact CD1-OD2 3.49Å; L285-D289 PolarHBondContact N-OD2 3.4Å; L285-D289 PolarHBondContact O-N 2.98Å
290	R	90.9	Very high	92	Very high	208 Å²	208	70.8 Å²	70.8	79%	0.785	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.9	164.5	-65.8	-171.2	179.4	-168.7	-0.1	108.1	F266	F266-R290 PolarHBondContact N-O 3.13Å; F266-R290 PolarHBondContact O-N 2.93Å; F266-R290 VanDerWaalsContact O-O 3.14Å
291	Y	91.6	Very high	92.1	Very high	92 Å²	92	70 Å²	70	36%	0.361	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	150.8	177.5	67.6	-91.6	0	0	0	111.6	V264 V284 V293	V264-Y291 CarbonylContact O-C 3.55Å; V264-Y291 WeakPolarHBondContact O-CA 3.46Å; V284-Y291 HydrophobicContact CG1-CD1 4Å; V284-Y291 HydrophobicContact CG1-CE1 4.45Å; V284-Y291 HydrophobicContact CG2-CD1 4.26Å; Y291-V293 HydrophobicContact CD2-CG2 3.74Å; Y291-V293 HydrophobicContact CE2-CG2 3.75Å
292	R	93	Very high	92.4	Very high	168 Å²	168	69 Å²	69	63%	0.634	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.7	169.1	-69.3	-63.5	-171.6	101	-1.3	108.6	A263 V264 F266 V333	A263-R292 WeakPolarHBondContact CA-O 3.45Å; V264-R292 PolarHBondContact N-O 2.84Å; V264-R292 PolarHBondContact O-N 3.27Å; F266-R292 HydrophobicContact CE2-CG 4.45Å; R292-V333 HydrophobicContact CB-CG2 4.39Å; R292-V333 HydrophobicContact CG-CG1 4.37Å
293	V	93.1	Very high	92.7	Very high	60 Å²	60	68.7 Å²	68.7	36%	0.364	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128	175.8	-173.8	0	0	0	0	108.2	E261 R262 Y291	E261-V293 HydrophobicContact CB-CG1 3.68Å; E261-V293 HydrophobicContact CG-CG1 3.84Å; R262-V293 WeakPolarHBondContact O-CA 3.26Å; Y291-V293 HydrophobicContact CD2-CG2 3.74Å; Y291-V293 HydrophobicContact CE2-CG2 3.75Å
294	L	94	Very high	92.9	Very high	42 Å²	42	66.4 Å²	66.4	22%	0.22	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.3	174.8	-73.9	171.2	0	0	0	109.5	E261 R262 P329 A332 V333	E261-L294 CarbonylContact C-O 3.47Å; E261-L294 VanDerWaalsContact CA-O 3.27Å; E261-L294 WeakPolarHBondContact CA-O 3.36Å; R262-L294 PolarHBondContact N-O 3.41Å; R262-L294 PolarHBondContact O-N 3.36Å; L294-P329 HydrophobicContact CB-CB 4.21Å; L294-P329 HydrophobicContact CD1-CB 3.57Å; L294-P329 VanDerWaalsContact CD1-O 3.24Å; L294-P329 WeakPolarHBondContact CD1-O 3.32Å; L294-A332 HydrophobicContact CD1-CB 4.14Å; L294-V333 HydrophobicContact CD1-CG2 3.42Å; L294-V333 VanDerWaalsContact CD1-CG2 3.42Å; L294-V333 HydrophobicContact CG-CG2 4.11Å
295	D	95.1	Very high	93	Very high	27 Å²	27	70.1 Å²	70.1	14%	0.144	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134	173.3	-171.2	-12.7	0	0	0	109.5	R297 F299	D295-R297 VanDerWaalsContact OD1-CB 3.32Å; D295-R297 WeakPolarHBondContact OD1-CB 3.24Å; D295-R297 VanDerWaalsContact OD1-CG 3.26Å; D295-R297 WeakPolarHBondContact OD1-CG 3.44Å; D295-R297 PolarHBondContact OD1-N 2.86Å; D295-R297 IonicContact OD1-NE 3.29Å; D295-R297 PolarHBondContact OD1-NE 2.92Å; D295-R297 VanDerWaalsContact OD1-NE 3.16Å; D295-R297 IonicContact OD2-CZ 3.72Å; D295-R297 IonicContact OD2-NE 2.57Å; D295-R297 PolarHBondContact OD2-NE 3.47Å; D295-R297 IonicContact OD2-NH2 3.86Å; D295-R297 PolarHBondContact OD2-NH2 3.31Å; D295-F299 HydrophobicContact CB-CE2 3.89Å; D295-F299 HydrophobicContact CB-CZ 3.66Å
296	L	95.1	Very high	93.2	Very high	45 Å²	45	70.9 Å²	70.9	24%	0.236	36%	0.355	C	S	.	.			trans	-95.1	-1.9	-178.6	-58.9	-178.3	0	0	0	113.2	Y260 R262 V326 P329	Y260-L296 WeakPolarHBondContact O-CB 3.27Å; Y260-L296 PolarHBondContact O-N 2.99Å; R262-L296 HydrophobicContact CG-CD1 3.47Å; R262-L296 VanDerWaalsContact CG-CD1 3.47Å; R262-L296 HydrophobicContact CG-CD2 4.01Å; R262-L296 HydrophobicContact CG-CG 3.88Å; L296-V326 HydrophobicContact CD2-CB 4.41Å; L296-V326 HydrophobicContact CD2-CG1 4.5Å; L296-V326 WeakPolarHBondContact CD2-O 3.39Å; L296-P329 HydrophobicContact CD2-CG 4.46Å
297	R	96.6	Very high	93.8	Very high	135 Å²	135	76 Å²	76	51%	0.509	38%	0.375	S	S	.	.	S	Bend	trans	-67.2	162.8	177.2	-68	180	-65.4	174.1	-0.1	111.5	D295 F299	D295-R297 VanDerWaalsContact OD1-CB 3.32Å; D295-R297 WeakPolarHBondContact OD1-CB 3.24Å; D295-R297 VanDerWaalsContact OD1-CG 3.26Å; D295-R297 WeakPolarHBondContact OD1-CG 3.44Å; D295-R297 PolarHBondContact OD1-N 2.86Å; D295-R297 IonicContact OD1-NE 3.29Å; D295-R297 PolarHBondContact OD1-NE 2.92Å; D295-R297 VanDerWaalsContact OD1-NE 3.16Å; D295-R297 IonicContact OD2-CZ 3.72Å; D295-R297 IonicContact OD2-NE 2.57Å; D295-R297 PolarHBondContact OD2-NE 3.47Å; D295-R297 IonicContact OD2-NH2 3.86Å; D295-R297 PolarHBondContact OD2-NH2 3.31Å; R297-F299 VanDerWaalsContact O-CD2 3.23Å; R297-F299 WeakPolarHBondContact O-CD2 3.34Å; R297-F299 WeakPolarHBondContact O-CE2 3.49Å; R297-F299 PolarHBondContact O-N 3.38Å
298	T	96.3	Very high	94.3	Very high	61 Å²	61	70.3 Å²	70.3	37%	0.374	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-71.1	123.7	174.1	-53.2	0	0	0	0	109.8	Y323 Y324 E390	T298-Y323 HydrophobicContact CG2-CD1 4.46Å; T298-Y324 CarbonylContact C-O 3.52Å; T298-Y324 WeakPolarHBondContact CA-O 3.23Å; T298-E390 WeakPolarHBondContact CB-OE2 3.3Å; T298-E390 WeakPolarHBondContact CG2-OE2 3.24Å; T298-E390 PolarHBondContact OG1-OE1 2.6Å; T298-E390 PolarHBondContact OG1-OE2 2.86Å
299	F	95.9	Very high	94.6	Very high	73 Å²	73	74 Å²	74	32%	0.32	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	151.3	171.8	-70.5	-78.7	0	0	0	110.2	D295 R297 Y323 Y324	D295-F299 HydrophobicContact CB-CE2 3.89Å; D295-F299 HydrophobicContact CB-CZ 3.66Å; R297-F299 VanDerWaalsContact O-CD2 3.23Å; R297-F299 WeakPolarHBondContact O-CD2 3.34Å; R297-F299 WeakPolarHBondContact O-CE2 3.49Å; R297-F299 PolarHBondContact O-N 3.38Å; F299-Y323 WeakPolarHBondContact O-CA 3.32Å; F299-Y324 HydrophobicContact CB-CD1 4.26Å; F299-Y324 HydrophobicContact CB-CE1 3.57Å; F299-Y324 HydrophobicContact CB-CE2 4.27Å; F299-Y324 PolarHBondContact N-O 3.41Å; F299-Y324 WeakPolarHBondContact O-CD1 3.16Å; F299-Y324 PolarHBondContact O-N 2.92Å
300	T	95.9	Very high	94.8	Very high	87 Å²	87	73.4 Å²	73.4	53%	0.534	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.9	176.3	67.2	0	0	0	0	109.6	V322 Y323	T300-V322 WeakPolarHBondContact CA-O 3.48Å; T300-Y323 HydrophobicContact CG2-CD1 3.19Å; T300-Y323 HydrophobicContact CG2-CE1 3.43Å; T300-Y323 VanDerWaalsContact CG2-CE1 3.43Å; T300-Y323 HydrophobicContact CG2-CG 3.96Å
301	F	96.3	Very high	95	Very high	15 Å²	15	70.1 Å²	70.1	7%	0.066	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150.4	165.7	63.7	-107.3	0	0	0	110.2	V303 V322 Y324 T343 R344	F301-V303 HydrophobicContact CD2-CG2 4.42Å; F301-V303 HydrophobicContact CE2-CG2 3.91Å; F301-V322 HydrophobicContact CE1-CB 4.32Å; F301-V322 HydrophobicContact CE2-CB 3.88Å; F301-V322 HydrophobicContact CE2-CG2 4Å; F301-V322 HydrophobicContact CZ-CB 3.76Å; F301-V322 HydrophobicContact CZ-CG1 4.14Å; F301-V322 HydrophobicContact CZ-CG2 4.14Å; F301-V322 PolarHBondContact N-O 2.98Å; F301-V322 PolarHBondContact O-N 3.35Å; F301-V322 VanDerWaalsContact O-N 3.13Å; F301-Y324 AromaticContact CD1-CD1 3.99Å; F301-Y324 HydrophobicContact CD1-CD1 3.99Å; F301-Y324 AromaticContact CD1-CE1 3.39Å; F301-Y324 HydrophobicContact CD1-CE1 3.39Å; F301-Y324 AromaticContact CE1-CD1 3.73Å; F301-Y324 HydrophobicContact CE1-CD1 3.73Å; F301-Y324 AromaticContact CE1-CE1 3.49Å; F301-Y324 HydrophobicContact CE1-CE1 3.49Å; F301-Y324 VanDerWaalsContact CE1-CE1 3.49Å; F301-T343 HydrophobicContact CE1-CG2 3.95Å; F301-T343 HydrophobicContact CZ-CG2 3.89Å; F301-R344 HydrophobicContact CB-CG 4.29Å; F301-R344 HydrophobicContact CD1-CG 3.81Å; F301-R344 HydrophobicContact CD2-CB 4.46Å; F301-R344 HydrophobicContact CD2-CG 3.27Å; F301-R344 HydrophobicContact CE1-CG 3.93Å; F301-R344 HydrophobicContact CE2-CB 4.17Å; F301-R344 HydrophobicContact CE2-CG 3.38Å; F301-R344 HydrophobicContact CG-CG 3.52Å; F301-R344 HydrophobicContact CZ-CB 4.36Å; F301-R344 HydrophobicContact CZ-CG 3.73Å
302	D	96.5	Very high	95.1	Very high	91 Å²	91	69.3 Å²	69.3	49%	0.487	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	130.1	169.5	-73.9	-32.8	0	0	0	109.4	V321 K395	D302-V321 WeakPolarHBondContact OD1-CG2 3.23Å; D302-K395 IonicContact OD1-NZ 3.57Å; D302-K395 PolarHBondContact OD1-NZ 3.46Å; D302-K395 IonicContact OD2-NZ 2.79Å; D302-K395 PolarHBondContact OD2-NZ 2.77Å
303	V	95	Very high	95.2	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.018	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.6	167.3	-179.9	0	0	0	0	107.5	F301 A320 V322 Q348 L351	F301-V303 HydrophobicContact CD2-CG2 4.42Å; F301-V303 HydrophobicContact CE2-CG2 3.91Å; V303-A320 HydrophobicContact CB-CB 4.36Å; V303-A320 WeakPolarHBondContact CB-O 3.4Å; V303-A320 HydrophobicContact CG2-CB 4.36Å; V303-A320 PolarHBondContact N-O 3Å; V303-V322 HydrophobicContact CG2-CG2 3.76Å; V303-Q348 HydrophobicContact CG1-CB 4.24Å; V303-L351 HydrophobicContact CG1-CD2 3.94Å
304	P	94.1	Very high	95.2	Very high	62 Å²	62	64 Å²	64	40%	0.403	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	144.8	177.7	24	-34	0	0	0	111.1	Q306 Q348	P304-Q306 PolarHBondContact O-N 3.23Å; P304-Q306 PolarHBondContact O-NE2 3.18Å; P304-Q348 HydrophobicContact CG-CB 4.42Å
305	T	94.7	Very high	95.2	Very high	90 Å²	90	65.1 Å²	65.1	55%	0.552	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.8	131.3	179.6	48	0	0	0	0	111.3	V318 N319	T305-V318 WeakPolarHBondContact CA-O 3.36Å; T305-N319 HydrophobicContact CG2-CB 3.78Å
306	Q	95.1	Very high	95.2	Very high	25 Å²	25	63.8 Å²	63.8	12%	0.117	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.6	175.7	-56.8	-52.5	-63	0	0	110.3	P304 V308 V317 V318 Q348 L351	P304-Q306 PolarHBondContact O-N 3.23Å; P304-Q306 PolarHBondContact O-NE2 3.18Å; Q306-V308 HydrophobicContact CB-CG1 3.86Å; Q306-V317 CarbonylContact O-C 3.52Å; Q306-V317 VanDerWaalsContact O-CA 3.3Å; Q306-V317 WeakPolarHBondContact O-CA 3.46Å; Q306-V318 PolarHBondContact N-O 2.83Å; Q306-V318 PolarHBondContact O-N 2.85Å; Q306-Q348 VanDerWaalsContact CD-NE2 3.35Å; Q306-Q348 HydrophobicContact CG-CG 4.33Å; Q306-L351 HydrophobicContact CG-CD2 3.96Å; Q306-L351 HydrophobicContact CG-CG 4.49Å
307	E	95.6	Very high	95.3	Very high	152 Å²	152	64 Å²	64	71%	0.71	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.6	169.7	-177.1	174.2	-174.9	0	0	108.5	V316 V317	E307-V316 WeakPolarHBondContact CA-O 3.43Å; E307-V317 HydrophobicContact CB-CG2 4.16Å; E307-V317 HydrophobicContact CG-CG2 4.1Å
308	V	94.2	Very high	95.2	Very high	11 Å²	11	57.5 Å²	57.5	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.2	-169.5	-51.4	0	0	0	0	111.2	Q306 T315 V316 L352 L355	Q306-V308 HydrophobicContact CB-CG1 3.86Å; V308-T315 WeakPolarHBondContact O-CA 3.5Å; V308-V316 HydrophobicContact CG2-CG2 3.92Å; V308-V316 PolarHBondContact N-O 3.34Å; V308-V316 PolarHBondContact O-N 3.04Å; V308-L352 HydrophobicContact CB-CD1 4.02Å; V308-L352 HydrophobicContact CG1-CD1 3.22Å; V308-L352 HydrophobicContact CG1-CG 4.5Å; V308-L355 HydrophobicContact CG2-CB 3.68Å; V308-L355 HydrophobicContact CG2-CD1 3.75Å; V308-L355 HydrophobicContact CG2-CG 4.37Å
309	L	95.8	Very high	95.2	Very high	91 Å²	91	56 Å²	56	48%	0.476	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123.3	172.1	-165.6	73.3	0	0	0	108.8	S313 T315	L309-S313 WeakPolarHBondContact CD1-O 3.4Å; L309-T315 HydrophobicContact CD1-CG2 4.02Å
310	T	95.2	Very high	95.2	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.025	29%	0.29	C	S	.	.			trans	-70.4	170.1	170.7	63.5	0	0	0	0	110.9	D312 S313 V314 V316 V358	T310-D312 PolarHBondContact O-N 3.01Å; T310-D312 VanDerWaalsContact O-N 3.14Å; T310-S313 PolarHBondContact O-N 3.15Å; T310-V314 PolarHBondContact N-O 3.26Å; T310-V314 PolarHBondContact OG1-N 3.45Å; T310-V314 PolarHBondContact OG1-O 3.35Å; T310-V316 HydrophobicContact CG2-CB 4.41Å; T310-V316 HydrophobicContact CG2-CG1 3.95Å; T310-V316 HydrophobicContact CG2-CG2 3.54Å; T310-V358 WeakPolarHBondContact CB-O 3.38Å
311	K	95.9	Very high	95.3	Very high	138 Å²	138	49.2 Å²	49.2	60%	0.6	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.7	176	178.2	173.1	163.2	-159.7	0	113.4	S313 T357 V358 N359	K311-S313 PolarHBondContact O-N 3.42Å; K311-T357 WeakPolarHBondContact CD-O 3.37Å; K311-V358 WeakPolarHBondContact CB-O 3.48Å; K311-V358 PolarHBondContact N-O 2.9Å; K311-N359 WeakPolarHBondContact CB-OD1 3.49Å; K311-N359 VanDerWaalsContact CD-OD1 3.28Å; K311-N359 WeakPolarHBondContact CD-OD1 3.34Å; K311-N359 WeakPolarHBondContact CG-OD1 3.35Å
312	D	94.6	Very high	95.4	Very high	75 Å²	75	48.5 Å²	48.5	40%	0.401	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	13.5	176.2	-54	-43.3	0	0	0	113.5	T310 V314 N359 L360	T310-D312 PolarHBondContact O-N 3.01Å; T310-D312 VanDerWaalsContact O-N 3.14Å; D312-V314 HydrophobicContact CB-CG2 4.41Å; D312-V314 PolarHBondContact O-N 2.87Å; D312-N359 PolarHBondContact OD1-ND2 2.7Å; D312-N359 PolarHBondContact OD1-OD1 3.5Å; D312-N359 WeakPolarHBondContact OD2-CA 3.41Å; D312-N359 WeakPolarHBondContact OD2-CB 3.41Å; D312-N359 VanDerWaalsContact OD2-CG 3.31Å; D312-L360 PolarHBondContact OD2-N 2.99Å
313	S	93.3	Very high	95.5	Very high	91 Å²	91	47 Å²	47	64%	0.636	25%	0.254	S	S	*	.	S	Bend	trans	60.7	31.3	-177.7	-54.1	0	0	0	0	114	L309 T310 K311	L309-S313 WeakPolarHBondContact CD1-O 3.4Å; T310-S313 PolarHBondContact O-N 3.15Å; K311-S313 PolarHBondContact O-N 3.42Å
314	V	93.4	Very high	95.6	Very high	25 Å²	25	47 Å²	47	15%	0.152	26%	0.255	C	S	.	.			trans	-101.6	127.5	174.2	-179.4	0	0	0	0	110.3	T310 D312 V316 L360 L403	T310-V314 PolarHBondContact N-O 3.26Å; T310-V314 PolarHBondContact OG1-N 3.45Å; T310-V314 PolarHBondContact OG1-O 3.35Å; D312-V314 HydrophobicContact CB-CG2 4.41Å; D312-V314 PolarHBondContact O-N 2.87Å; V314-V316 HydrophobicContact CG1-CG1 4.09Å; V314-V316 PolarHBondContact O-N 3.03Å; V314-L360 HydrophobicContact CB-CD2 4.47Å; V314-L360 HydrophobicContact CG1-CD2 4.15Å; V314-L360 HydrophobicContact CG2-CD2 4.26Å; V314-L403 HydrophobicContact CG1-CD2 3.42Å; V314-L403 VanDerWaalsContact CG1-CD2 3.42Å; V314-L403 HydrophobicContact CG2-CD2 4.46Å
315	T	94.8	Very high	95.7	Very high	66 Å²	66	49.5 Å²	49.5	41%	0.405	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	119.6	173.4	56.2	0	0	0	0	109.7	V308 L309 P400	V308-T315 WeakPolarHBondContact O-CA 3.5Å; L309-T315 HydrophobicContact CD1-CG2 4.02Å; T315-P400 WeakPolarHBondContact O-CD 3.31Å
316	V	95.3	Very high	95.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.6	177.5	-63.3	0	0	0	0	110.3	E307 V308 T310 V314 V318 L360 L363	E307-V316 WeakPolarHBondContact CA-O 3.43Å; V308-V316 HydrophobicContact CG2-CG2 3.92Å; V308-V316 PolarHBondContact N-O 3.34Å; V308-V316 PolarHBondContact O-N 3.04Å; T310-V316 HydrophobicContact CG2-CB 4.41Å; T310-V316 HydrophobicContact CG2-CG1 3.95Å; T310-V316 HydrophobicContact CG2-CG2 3.54Å; V314-V316 HydrophobicContact CG1-CG1 4.09Å; V314-V316 PolarHBondContact O-N 3.03Å; V316-V318 HydrophobicContact CB-CG2 4.29Å; V316-V318 HydrophobicContact CG2-CG2 3.91Å; V316-L360 HydrophobicContact CG1-CD1 3.78Å; V316-L363 HydrophobicContact CG2-CD2 4.1Å
317	V	96.5	Very high	95.8	Very high	48 Å²	48	52.2 Å²	52.2	29%	0.291	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	118.7	171.5	-178.3	0	0	0	0	108.6	Q306 E307 R398	Q306-V317 CarbonylContact O-C 3.52Å; Q306-V317 VanDerWaalsContact O-CA 3.3Å; Q306-V317 WeakPolarHBondContact O-CA 3.46Å; E307-V317 HydrophobicContact CB-CG2 4.16Å; E307-V317 HydrophobicContact CG-CG2 4.1Å; V317-R398 HydrophobicContact CB-CB 4.28Å; V317-R398 PolarHBondContact N-O 3.32Å; V317-R398 PolarHBondContact O-N 3.2Å
318	V	95.6	Very high	95.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.4	-173.3	-176.2	0	0	0	0	110.7	T305 Q306 V316 L351 L355 L363 I394 D396 V397	T305-V318 WeakPolarHBondContact CA-O 3.36Å; Q306-V318 PolarHBondContact N-O 2.83Å; Q306-V318 PolarHBondContact O-N 2.85Å; V316-V318 HydrophobicContact CB-CG2 4.29Å; V316-V318 HydrophobicContact CG2-CG2 3.91Å; V318-L351 HydrophobicContact CG1-CD1 4.23Å; V318-L355 HydrophobicContact CB-CD1 3.59Å; V318-L355 HydrophobicContact CG1-CD1 3.94Å; V318-L355 HydrophobicContact CG1-CD2 4.36Å; V318-L355 HydrophobicContact CG2-CD1 3.75Å; V318-L355 HydrophobicContact CG2-CD2 4.2Å; V318-L363 HydrophobicContact CG2-CD2 4.01Å; V318-I394 HydrophobicContact CG1-CG2 4.08Å; V318-D396 WeakPolarHBondContact CA-O 3.42Å; V318-V397 HydrophobicContact CG1-CG2 4.24Å; V318-V397 HydrophobicContact CG2-CG1 4.2Å; V318-V397 HydrophobicContact CG2-CG2 4.2Å
319	N	95.1	Very high	95.8	Very high	29 Å²	29	47.4 Å²	47.4	16%	0.155	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	157.3	166.4	57.5	-1.5	0	0	0	111.4	T305 K395 D396	T305-N319 HydrophobicContact CG2-CB 3.78Å; N319-K395 PolarHBondContact O-N 2.8Å; N319-K395 WeakPolarHBondContact OD1-CB 3.45Å; N319-D396 PolarHBondContact N-O 2.97Å; N319-D396 VanDerWaalsContact OD1-CA 3.28Å; N319-D396 WeakPolarHBondContact OD1-CA 3.15Å; N319-D396 WeakPolarHBondContact OD1-CB 3.08Å; N319-D396 PolarHBondContact OD1-N 3.31Å; N319-D396 PolarHBondContact OD1-O 3.26Å; N319-D396 VanDerWaalsContact OD1-O 3.09Å
320	A	96.4	Very high	95.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163.3	-177.8	0	0	0	0	0	111	V303 L351 V392 E393	V303-A320 HydrophobicContact CB-CB 4.36Å; V303-A320 WeakPolarHBondContact CB-O 3.4Å; V303-A320 HydrophobicContact CG2-CB 4.36Å; V303-A320 PolarHBondContact N-O 3Å; A320-L351 HydrophobicContact CB-CD1 4.34Å; A320-L351 HydrophobicContact CB-CD2 4.29Å; A320-V392 HydrophobicContact CB-CG1 4.45Å; A320-E393 CarbonylContact C-O 3.52Å; A320-E393 VanDerWaalsContact CA-O 3.22Å; A320-E393 WeakPolarHBondContact CA-O 3.21Å; A320-E393 WeakPolarHBondContact CB-O 3.47Å
321	V	97.7	Very high	95.6	Very high	18 Å²	18	49 Å²	49	11%	0.109	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.8	173.7	-172.7	0	0	0	0	108.3	D302 Y323 V392 E393 K395	D302-V321 WeakPolarHBondContact OD1-CG2 3.23Å; V321-Y323 HydrophobicContact CB-CE2 4.32Å; V321-Y323 HydrophobicContact CG1-CD2 4.38Å; V321-Y323 HydrophobicContact CG1-CE2 3.88Å; V321-V392 WeakPolarHBondContact O-CA 3.39Å; V321-E393 PolarHBondContact N-O 3Å; V321-E393 PolarHBondContact O-N 3.39Å; V321-K395 HydrophobicContact CG2-CB 4.19Å; V321-K395 HydrophobicContact CG2-CD 3.94Å
322	V	98.1	Very high	95.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.2	178.3	-178.2	0	0	0	0	109.2	T300 F301 V303 L378 V389 V392	T300-V322 WeakPolarHBondContact CA-O 3.48Å; F301-V322 HydrophobicContact CE1-CB 4.32Å; F301-V322 HydrophobicContact CE2-CB 3.88Å; F301-V322 HydrophobicContact CE2-CG2 4Å; F301-V322 HydrophobicContact CZ-CB 3.76Å; F301-V322 HydrophobicContact CZ-CG1 4.14Å; F301-V322 HydrophobicContact CZ-CG2 4.14Å; F301-V322 PolarHBondContact N-O 2.98Å; F301-V322 PolarHBondContact O-N 3.35Å; F301-V322 VanDerWaalsContact O-N 3.13Å; V303-V322 HydrophobicContact CG2-CG2 3.76Å; V322-L378 HydrophobicContact CG2-CD1 4.24Å; V322-V389 HydrophobicContact CG1-CG1 3.88Å; V322-V392 HydrophobicContact CG2-CG1 4.5Å; V322-V392 HydrophobicContact CG2-CG2 4.36Å
323	Y	98.4	Very high	95.4	Very high	58 Å²	58	41 Å²	41	23%	0.227	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.2	172.3	-59.3	-107.9	0	0	0	108	T298 F299 T300 V321 E390 R391 E393	T298-Y323 HydrophobicContact CG2-CD1 4.46Å; F299-Y323 WeakPolarHBondContact O-CA 3.32Å; T300-Y323 HydrophobicContact CG2-CD1 3.19Å; T300-Y323 HydrophobicContact CG2-CE1 3.43Å; T300-Y323 VanDerWaalsContact CG2-CE1 3.43Å; T300-Y323 HydrophobicContact CG2-CG 3.96Å; V321-Y323 HydrophobicContact CB-CE2 4.32Å; V321-Y323 HydrophobicContact CG1-CD2 4.38Å; V321-Y323 HydrophobicContact CG1-CE2 3.88Å; Y323-E390 PolarHBondContact O-N 2.84Å; Y323-R391 HydrophobicContact CD2-CG 3.36Å; Y323-R391 HydrophobicContact CE2-CG 4.05Å; Y323-R391 HydrophobicContact CG-CG 3.7Å; Y323-R391 PolarHBondContact N-O 2.8Å; Y323-R391 PolarHBondContact O-N 3.02Å; Y323-E393 HydrophobicContact CE2-CB 4.41Å; Y323-E393 VanDerWaalsContact CE2-CD 3.46Å; Y323-E393 HydrophobicContact CE2-CG 4Å; Y323-E393 VanDerWaalsContact CE2-OE2 3.31Å; Y323-E393 WeakPolarHBondContact CE2-OE2 3.06Å; Y323-E393 PolarHBondContact OH-OE2 3.46Å
324	Y	97.6	Very high	95.4	Very high	5 Å²	5	40.1 Å²	40.1	2%	0.02	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	161.7	-177.4	73.1	-75.5	0	0	0	110.7	T298 F299 F301 N340 V387 K388	T298-Y324 CarbonylContact C-O 3.52Å; T298-Y324 WeakPolarHBondContact CA-O 3.23Å; F299-Y324 HydrophobicContact CB-CD1 4.26Å; F299-Y324 HydrophobicContact CB-CE1 3.57Å; F299-Y324 HydrophobicContact CB-CE2 4.27Å; F299-Y324 PolarHBondContact N-O 3.41Å; F299-Y324 WeakPolarHBondContact O-CD1 3.16Å; F299-Y324 PolarHBondContact O-N 2.92Å; F301-Y324 AromaticContact CD1-CD1 3.99Å; F301-Y324 HydrophobicContact CD1-CD1 3.99Å; F301-Y324 AromaticContact CD1-CE1 3.39Å; F301-Y324 HydrophobicContact CD1-CE1 3.39Å; F301-Y324 AromaticContact CE1-CD1 3.73Å; F301-Y324 HydrophobicContact CE1-CD1 3.73Å; F301-Y324 AromaticContact CE1-CE1 3.49Å; F301-Y324 HydrophobicContact CE1-CE1 3.49Å; F301-Y324 VanDerWaalsContact CE1-CE1 3.49Å; Y324-N340 WeakPolarHBondContact CE2-OD1 3.23Å; Y324-N340 PolarHBondContact OH-OD1 2.8Å; Y324-V387 HydrophobicContact CD2-CG1 3.55Å; Y324-V387 HydrophobicContact CE2-CG1 4.43Å; Y324-V387 HydrophobicContact CG-CG1 4.17Å; Y324-K388 CarbonylContact C-O 3.19Å; Y324-K388 VanDerWaalsContact CA-O 3.23Å; Y324-K388 WeakPolarHBondContact CA-O 3.23Å; Y324-K388 WeakPolarHBondContact CB-O 3.49Å
325	R	96.9	Very high	95.4	Very high	113 Å²	113	43.3 Å²	43.3	43%	0.426	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	156.7	171.6	62.7	174.7	178.8	-177.9	-2.7	110.7	R327 K388 E390	R325-R327 PolarHBondContact O-N 3.13Å; R325-K388 HydrophobicContact CG-CB 4.31Å; R325-K388 PolarHBondContact N-O 3.26Å; R325-K388 PolarHBondContact O-N 3.06Å; R325-E390 WeakPolarHBondContact CD-OE1 3.32Å; R325-E390 HydrophobicContact CG-CG 4.24Å; R325-E390 IonicContact CZ-OE1 3.62Å; R325-E390 IonicContact NE-OE1 3Å; R325-E390 PolarHBondContact NE-OE1 3.15Å; R325-E390 VanDerWaalsContact NE-OE1 3.13Å; R325-E390 IonicContact NH1-OE1 2.67Å
326	V	96.3	Very high	95.3	Very high	10 Å²	10	41.2 Å²	41.2	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	116.6	172.7	-178.9	0	0	0	0	108.7	L296 P329 A332	L296-V326 HydrophobicContact CD2-CB 4.41Å; L296-V326 HydrophobicContact CD2-CG1 4.5Å; L296-V326 WeakPolarHBondContact CD2-O 3.39Å; V326-P329 HydrophobicContact CG1-CB 4.21Å; V326-A332 HydrophobicContact CG1-CB 3.74Å
327	R	94.7	Very high	95.1	Very high	163 Å²	163	48.6 Å²	48.6	62%	0.615	23%	0.23	S	C	*	.	S	Bend	trans	-88.3	-46.1	176.4	-179.2	-178.2	179.1	-172.8	-2	111.3	R325 E383 G386 K388	R325-R327 PolarHBondContact O-N 3.13Å; R327-E383 IonicContact NH1-OE1 2.76Å; R327-E383 PolarHBondContact NH1-OE1 3.32Å; R327-G386 PolarHBondContact N-O 3.11Å; R327-K388 HydrophobicContact CB-CB 4.12Å
328	D	94.7	Very high	94.9	Very high	50 Å²	50	49.9 Å²	49.9	27%	0.267	24%	0.235	S	C	.	.			trans	-117.6	100.2	176.1	-171.9	-12.4	0	0	0	109.7	V330 R331 A332 G386	D328-V330 PolarHBondContact O-N 3.02Å; D328-V330 WeakPolarHBondContact OD1-CB 3.46Å; D328-V330 PolarHBondContact OD1-N 3.46Å; D328-R331 HydrophobicContact CB-CB 4.23Å; D328-R331 HydrophobicContact CB-CG 4.31Å; D328-R331 PolarHBondContact O-N 3.35Å; D328-R331 VanDerWaalsContact OD2-CD 3.26Å; D328-R331 WeakPolarHBondContact OD2-CD 3.42Å; D328-R331 VanDerWaalsContact OD2-CG 3.32Å; D328-R331 WeakPolarHBondContact OD2-CG 3.38Å; D328-R331 IonicContact OD2-NE 3.42Å; D328-R331 PolarHBondContact OD2-NE 3.3Å; D328-A332 PolarHBondContact O-N 2.78Å; D328-A332 VanDerWaalsContact O-N 3.13Å; D328-G386 PolarHBondContact N-O 3.35Å
329	P	94.5	Very high	94.7	Very high	12 Å²	12	50.4 Å²	50.4	8%	0.078	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-24.7	-179.4	27.7	-36.5	0	0	0	113	R262 V264 A276 L294 L296 V326 V333	R262-P329 HydrophobicContact CB-CB 4.18Å; R262-P329 HydrophobicContact CB-CG 3.88Å; R262-P329 HydrophobicContact CG-CG 4.21Å; V264-P329 HydrophobicContact CG2-CB 4.21Å; V264-P329 WeakPolarHBondContact CG2-O 3.44Å; A276-P329 HydrophobicContact CB-CB 4.25Å; A276-P329 HydrophobicContact CB-CG 3.4Å; L294-P329 HydrophobicContact CB-CB 4.21Å; L294-P329 HydrophobicContact CD1-CB 3.57Å; L294-P329 VanDerWaalsContact CD1-O 3.24Å; L294-P329 WeakPolarHBondContact CD1-O 3.32Å; L296-P329 HydrophobicContact CD2-CG 4.46Å; V326-P329 HydrophobicContact CG1-CB 4.21Å; P329-V333 WeakPolarHBondContact O-CG2 3.38Å; P329-V333 PolarHBondContact O-N 3.26Å
330	V	93.9	Very high	94.6	Very high	13 Å²	13	52.4 Å²	52.4	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-69.7	-50	179.5	-178.4	0	0	0	0	109.5	V264 L271 A276 D328 A332 V333 V334	V264-V330 HydrophobicContact CG2-CG2 4.43Å; L271-V330 HydrophobicContact CD2-CG1 3.33Å; A276-V330 HydrophobicContact CB-CG2 3.89Å; D328-V330 PolarHBondContact O-N 3.02Å; D328-V330 WeakPolarHBondContact OD1-CB 3.46Å; D328-V330 PolarHBondContact OD1-N 3.46Å; V330-A332 VanDerWaalsContact C-N 3.29Å; V330-A332 PolarHBondContact O-N 3.31Å; V330-V333 PolarHBondContact O-N 2.69Å; V330-V334 HydrophobicContact CG1-CG2 4.46Å; V330-V334 WeakPolarHBondContact O-CG2 3.3Å; V330-V334 PolarHBondContact O-N 2.83Å; V330-V334 VanDerWaalsContact O-N 3.11Å
331	R	93.9	Very high	94.5	Very high	115 Å²	115	58.3 Å²	58.3	43%	0.434	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-37.1	176.2	-69.2	178	-174	-165	-4	112.5	D328 V333 V334 N335 W385	D328-R331 HydrophobicContact CB-CB 4.23Å; D328-R331 HydrophobicContact CB-CG 4.31Å; D328-R331 PolarHBondContact O-N 3.35Å; D328-R331 VanDerWaalsContact OD2-CD 3.26Å; D328-R331 WeakPolarHBondContact OD2-CD 3.42Å; D328-R331 VanDerWaalsContact OD2-CG 3.32Å; D328-R331 WeakPolarHBondContact OD2-CG 3.38Å; D328-R331 IonicContact OD2-NE 3.42Å; D328-R331 PolarHBondContact OD2-NE 3.3Å; R331-V333 VanDerWaalsContact C-N 3.26Å; R331-V333 PolarHBondContact O-N 3.27Å; R331-V334 PolarHBondContact O-N 3.41Å; R331-N335 WeakPolarHBondContact O-CB 3.26Å; R331-N335 PolarHBondContact O-N 2.82Å; R331-W385 CarbonylContact C-O 3.58Å
332	A	94.2	Very high	94.4	Very high	6 Å²	6	58.7 Å²	58.7	5%	0.05	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-26.1	-178.8	0	0	0	0	0	114.1	L294 V326 D328 V330 W385	L294-A332 HydrophobicContact CD1-CB 4.14Å; V326-A332 HydrophobicContact CG1-CB 3.74Å; D328-A332 PolarHBondContact O-N 2.78Å; D328-A332 VanDerWaalsContact O-N 3.13Å; V330-A332 VanDerWaalsContact C-N 3.29Å; V330-A332 PolarHBondContact O-N 3.31Å; A332-W385 WeakPolarHBondContact CA-O 3.43Å; A332-W385 PolarHBondContact N-O 2.8Å
333	V	92.5	Very high	94.2	Very high	39 Å²	39	58.7 Å²	58.7	24%	0.236	28%	0.278	C	S	.	.	H	α-helix	trans	-92	-34	174.8	-176.3	0	0	0	0	112.1	V264 F266 R292 L294 P329 V330 R331	V264-V333 HydrophobicContact CG2-CG2 4.14Å; F266-V333 HydrophobicContact CE2-CG1 3.94Å; F266-V333 HydrophobicContact CZ-CB 4.42Å; F266-V333 HydrophobicContact CZ-CG1 3.7Å; R292-V333 HydrophobicContact CB-CG2 4.39Å; R292-V333 HydrophobicContact CG-CG1 4.37Å; L294-V333 HydrophobicContact CD1-CG2 3.42Å; L294-V333 VanDerWaalsContact CD1-CG2 3.42Å; L294-V333 HydrophobicContact CG-CG2 4.11Å; P329-V333 WeakPolarHBondContact O-CG2 3.38Å; P329-V333 PolarHBondContact O-N 3.26Å; V330-V333 PolarHBondContact O-N 2.69Å; R331-V333 VanDerWaalsContact C-N 3.26Å; R331-V333 PolarHBondContact O-N 3.27Å
334	V	92.4	Very high	94.1	Very high	73 Å²	73	60.9 Å²	60.9	44%	0.442	29%	0.286	S	S	.	.	H	α-helix	trans	-86.1	-42.7	-172	176.1	0	0	0	0	112.5	F266 L271 V330 R331	F266-V334 HydrophobicContact CE1-CG2 4.32Å; F266-V334 HydrophobicContact CZ-CG2 4.42Å; L271-V334 HydrophobicContact CD1-CG2 3.97Å; L271-V334 HydrophobicContact CD2-CG2 3.91Å; L271-V334 HydrophobicContact CG-CG2 4.41Å; V330-V334 HydrophobicContact CG1-CG2 4.46Å; V330-V334 WeakPolarHBondContact O-CG2 3.3Å; V330-V334 PolarHBondContact O-N 2.83Å; V330-V334 VanDerWaalsContact O-N 3.11Å; R331-V334 PolarHBondContact O-N 3.41Å
335	N	93.6	Very high	94.1	Very high	91 Å²	91	64.5 Å²	64.5	49%	0.487	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-23	-169.9	-65.5	-0.5	0	0	0	112.9	R331 A384	R331-N335 WeakPolarHBondContact O-CB 3.26Å; R331-N335 PolarHBondContact O-N 2.82Å; N335-A384 PolarHBondContact ND2-O 3.13Å
336	V	92.7	Very high	94	Very high	22 Å²	22	60.5 Å²	60.5	13%	0.133	30%	0.296	C	S	.	.			trans	-138.8	136.6	-178.6	-175.9	0	0	0	0	109.4	A342 W385	V336-A342 HydrophobicContact CG1-CB 3.75Å; V336-W385 HydrophobicContact CG2-CB 3.8Å; V336-W385 HydrophobicContact CG2-CD2 3.64Å; V336-W385 HydrophobicContact CG2-CG 3.25Å
337	E	91.6	Very high	94	Very high	155 Å²	155	60 Å²	60	72%	0.724	29%	0.293	S	S	*	.	S	Bend	trans	-57.8	-57.5	175.2	-176.8	-166.7	-166.1	0	0	111.4	R341	E337-R341 IonicContact OE2-CZ 3.76Å; E337-R341 IonicContact OE2-NH1 3.8Å; E337-R341 IonicContact OE2-NH2 2.85Å; E337-R341 PolarHBondContact OE2-NH2 3.19Å
338	D	92.2	Very high	94.1	Very high	75 Å²	75	55.5 Å²	55.5	40%	0.401	28%	0.279	S	S	.	.			trans	-128.9	90.5	179.2	-80.1	-29.4	0	0	0	110.7	N340 R341 A342	D338-N340 PolarHBondContact O-N 2.98Å; D338-R341 HydrophobicContact CB-CB 3.75Å; D338-R341 PolarHBondContact O-N 3.09Å; D338-R341 IonicContact OD2-CZ 2.73Å; D338-R341 IonicContact OD2-NH1 2.62Å; D338-R341 PolarHBondContact OD2-NH1 3.05Å; D338-A342 PolarHBondContact O-N 2.77Å
339	A	91.6	Very high	94.2	Very high	12 Å²	12	56 Å²	56	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-53.4	-39.2	178.3	0	0	0	0	0	112.5	R341 T343 V387	A339-R341 PolarHBondContact O-N 3.11Å; A339-T343 WeakPolarHBondContact O-CB 3.36Å; A339-T343 PolarHBondContact O-N 2.89Å; A339-T343 PolarHBondContact O-OG1 3.13Å; A339-V387 HydrophobicContact CB-CG2 4.03Å
340	N	92.8	Very high	94.3	Very high	71 Å²	71	56.1 Å²	56.1	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-65.2	-39	179.5	-63.2	-20.4	0	0	0	112.9	Y324 D338 R344	Y324-N340 WeakPolarHBondContact CE2-OD1 3.23Å; Y324-N340 PolarHBondContact OH-OD1 2.8Å; D338-N340 PolarHBondContact O-N 2.98Å; N340-R344 PolarHBondContact O-N 3.42Å
341	R	94.5	Very high	94.4	Very high	123 Å²	123	55.6 Å²	55.6	46%	0.464	28%	0.281	S	S	.	.	H	α-helix	trans	-75	-44.2	-179.7	-172.3	179.6	72.4	-148.3	8.2	110.4	E337 D338 A339 R344 V345	E337-R341 IonicContact OE2-CZ 3.76Å; E337-R341 IonicContact OE2-NH1 3.8Å; E337-R341 IonicContact OE2-NH2 2.85Å; E337-R341 PolarHBondContact OE2-NH2 3.19Å; D338-R341 HydrophobicContact CB-CB 3.75Å; D338-R341 PolarHBondContact O-N 3.09Å; D338-R341 IonicContact OD2-CZ 2.73Å; D338-R341 IonicContact OD2-NH1 2.62Å; D338-R341 PolarHBondContact OD2-NH1 3.05Å; A339-R341 PolarHBondContact O-N 3.11Å; R341-R344 WeakPolarHBondContact O-CB 3.15Å; R341-R344 PolarHBondContact O-N 3.49Å; R341-V345 PolarHBondContact O-N 3.3Å; R341-V345 VanDerWaalsContact O-N 3.15Å
342	A	95.2	Very high	94.4	Very high	27 Å²	27	53.9 Å²	53.9	22%	0.223	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-46.9	177.3	0	0	0	0	0	111.6	V336 D338 R344 V345 L346 W385	V336-A342 HydrophobicContact CG1-CB 3.75Å; D338-A342 PolarHBondContact O-N 2.77Å; A342-R344 VanDerWaalsContact C-N 3.29Å; A342-R344 PolarHBondContact O-N 3.46Å; A342-V345 PolarHBondContact O-N 3.47Å; A342-L346 WeakPolarHBondContact O-CB 3.44Å; A342-L346 PolarHBondContact O-N 3.14Å; A342-W385 HydrophobicContact CB-CE3 4.38Å; A342-W385 HydrophobicContact CB-CH2 3.86Å; A342-W385 HydrophobicContact CB-CZ2 4.47Å; A342-W385 HydrophobicContact CB-CZ3 3.81Å
343	T	94.8	Very high	94.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-33.9	177.7	-54.1	0	0	0	0	112.3	F301 A339 G347 T382	F301-T343 HydrophobicContact CE1-CG2 3.95Å; F301-T343 HydrophobicContact CZ-CG2 3.89Å; A339-T343 WeakPolarHBondContact O-CB 3.36Å; A339-T343 PolarHBondContact O-N 2.89Å; A339-T343 PolarHBondContact O-OG1 3.13Å; T343-G347 PolarHBondContact O-N 2.84Å; T343-T382 HydrophobicContact CG2-CG2 4.09Å
344	R	95.8	Very high	94.6	Very high	103 Å²	103	57.2 Å²	57.2	39%	0.389	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-48.9	173.7	-93.4	-170.9	-69.9	-97.5	5.4	112.7	F301 N340 R341 A342 G347 Q348	F301-R344 HydrophobicContact CB-CG 4.29Å; F301-R344 HydrophobicContact CD1-CG 3.81Å; F301-R344 HydrophobicContact CD2-CB 4.46Å; F301-R344 HydrophobicContact CD2-CG 3.27Å; F301-R344 HydrophobicContact CE1-CG 3.93Å; F301-R344 HydrophobicContact CE2-CB 4.17Å; F301-R344 HydrophobicContact CE2-CG 3.38Å; F301-R344 HydrophobicContact CG-CG 3.52Å; F301-R344 HydrophobicContact CZ-CB 4.36Å; F301-R344 HydrophobicContact CZ-CG 3.73Å; N340-R344 PolarHBondContact O-N 3.42Å; R341-R344 WeakPolarHBondContact O-CB 3.15Å; R341-R344 PolarHBondContact O-N 3.49Å; A342-R344 VanDerWaalsContact C-N 3.29Å; A342-R344 PolarHBondContact O-N 3.46Å; R344-G347 PolarHBondContact O-N 3.29Å; R344-Q348 PolarHBondContact O-N 3.03Å
345	V	96.3	Very high	94.6	Very high	82 Å²	82	53.8 Å²	53.8	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-66	-42.7	178.9	176.1	0	0	0	0	110.4	R341 A342 G347 Q348 T349	R341-V345 PolarHBondContact O-N 3.3Å; R341-V345 VanDerWaalsContact O-N 3.15Å; A342-V345 PolarHBondContact O-N 3.47Å; V345-G347 VanDerWaalsContact C-N 3.34Å; V345-G347 PolarHBondContact O-N 3.44Å; V345-Q348 WeakPolarHBondContact O-CB 3.33Å; V345-Q348 PolarHBondContact O-N 2.9Å; V345-Q348 VanDerWaalsContact O-N 3.15Å; V345-T349 PolarHBondContact O-N 2.83Å; V345-T349 PolarHBondContact O-OG1 3.36Å
346	L	96.5	Very high	94.7	Very high	29 Å²	29	51.1 Å²	51.1	15%	0.152	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-47.2	174.9	-175.7	68.5	0	0	0	110.7	A342 Q348 T349 T350 L378 V381 T382 W385	A342-L346 WeakPolarHBondContact O-CB 3.44Å; A342-L346 PolarHBondContact O-N 3.14Å; L346-Q348 VanDerWaalsContact C-N 3.27Å; L346-Q348 PolarHBondContact O-N 3.35Å; L346-T349 WeakPolarHBondContact CA-OG1 3.49Å; L346-T349 PolarHBondContact O-N 3.41Å; L346-T349 VanDerWaalsContact O-N 3.09Å; L346-T349 PolarHBondContact O-OG1 2.93Å; L346-T350 HydrophobicContact CD1-CG2 4.21Å; L346-T350 HydrophobicContact CG-CG2 4.24Å; L346-T350 WeakPolarHBondContact O-CG2 3.44Å; L346-T350 PolarHBondContact O-N 3.29Å; L346-T350 PolarHBondContact O-OG1 3.01Å; L346-T350 VanDerWaalsContact O-OG1 3.14Å; L346-L378 HydrophobicContact CB-CD2 4.3Å; L346-L378 HydrophobicContact CD2-CD2 3.74Å; L346-L378 HydrophobicContact CG-CD2 3.62Å; L346-V381 HydrophobicContact CD1-CG1 4.12Å; L346-V381 HydrophobicContact CD2-CB 3.82Å; L346-V381 HydrophobicContact CD2-CG1 3.66Å; L346-T382 HydrophobicContact CD2-CG2 3.78Å; L346-W385 HydrophobicContact CB-CH2 4.27Å; L346-W385 HydrophobicContact CD2-CH2 3.89Å; L346-W385 HydrophobicContact CD2-CZ3 3.98Å
347	G	96.6	Very high	94.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54.3	-39.4	173.9	0	0	0	0	0	113.8	T343 R344 V345 T350 L351	T343-G347 PolarHBondContact O-N 2.84Å; R344-G347 PolarHBondContact O-N 3.29Å; V345-G347 VanDerWaalsContact C-N 3.34Å; V345-G347 PolarHBondContact O-N 3.44Å; G347-T350 PolarHBondContact O-OG1 2.87Å; G347-L351 WeakPolarHBondContact O-CB 3.41Å; G347-L351 PolarHBondContact O-N 3.43Å
348	Q	96.4	Very high	94.9	Very high	68 Å²	68	47.4 Å²	47.4	32%	0.318	26%	0.257	S	S	.	.	H	α-helix	trans	-65.1	-47.8	174.4	171.3	170.1	17.3	0	0	111.8	V303 P304 Q306 R344 V345 L346 L351 L352	V303-Q348 HydrophobicContact CG1-CB 4.24Å; P304-Q348 HydrophobicContact CG-CB 4.42Å; Q306-Q348 VanDerWaalsContact CD-NE2 3.35Å; Q306-Q348 HydrophobicContact CG-CG 4.33Å; R344-Q348 PolarHBondContact O-N 3.03Å; V345-Q348 WeakPolarHBondContact O-CB 3.33Å; V345-Q348 PolarHBondContact O-N 2.9Å; V345-Q348 VanDerWaalsContact O-N 3.15Å; L346-Q348 VanDerWaalsContact C-N 3.27Å; L346-Q348 PolarHBondContact O-N 3.35Å; Q348-L351 PolarHBondContact O-N 3.18Å; Q348-L352 PolarHBondContact O-N 3.05Å; Q348-L352 VanDerWaalsContact O-N 3.11Å
349	T	95.7	Very high	95.1	Very high	61 Å²	61	46.1 Å²	46.1	37%	0.374	25%	0.25	S	S	.	.	H	α-helix	trans	-69.4	-37.2	-178.6	58.9	0	0	0	0	112.9	V345 L346 L352 N353	V345-T349 PolarHBondContact O-N 2.83Å; V345-T349 PolarHBondContact O-OG1 3.36Å; L346-T349 WeakPolarHBondContact CA-OG1 3.49Å; L346-T349 PolarHBondContact O-N 3.41Å; L346-T349 VanDerWaalsContact O-N 3.09Å; L346-T349 PolarHBondContact O-OG1 2.93Å; T349-L352 PolarHBondContact O-N 2.77Å; T349-N353 PolarHBondContact O-N 3.3Å; T349-N353 PolarHBondContact O-ND2 3.44Å
350	T	96.4	Very high	95.3	Very high	14 Å²	14	46.4 Å²	46.4	9%	0.086	25%	0.25	C	S	.	.	H	α-helix	trans	-70.5	-38.6	176.7	56.5	0	0	0	0	111.3	L346 G347 L352 N353 V354 L378	L346-T350 HydrophobicContact CD1-CG2 4.21Å; L346-T350 HydrophobicContact CG-CG2 4.24Å; L346-T350 WeakPolarHBondContact O-CG2 3.44Å; L346-T350 PolarHBondContact O-N 3.29Å; L346-T350 PolarHBondContact O-OG1 3.01Å; L346-T350 VanDerWaalsContact O-OG1 3.14Å; G347-T350 PolarHBondContact O-OG1 2.87Å; T350-L352 VanDerWaalsContact C-N 3.34Å; T350-L352 PolarHBondContact O-N 3.04Å; T350-N353 PolarHBondContact O-N 3.3Å; T350-V354 WeakPolarHBondContact O-CB 3.3Å; T350-V354 WeakPolarHBondContact O-CG2 3.22Å; T350-V354 PolarHBondContact O-N 3.42Å; T350-L378 HydrophobicContact CG2-CD2 3.64Å; T350-L378 HydrophobicContact CG2-CG 4.14Å; T350-L378 VanDerWaalsContact OG1-CD2 3.3Å; T350-L378 WeakPolarHBondContact OG1-CD2 3.47Å
351	L	96.5	Very high	95.4	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-48.4	172.6	-179.2	63.9	0	0	0	110.9	V303 Q306 V318 A320 G347 Q348 N353 V354 L355 M374	V303-L351 HydrophobicContact CG1-CD2 3.94Å; Q306-L351 HydrophobicContact CG-CD2 3.96Å; Q306-L351 HydrophobicContact CG-CG 4.49Å; V318-L351 HydrophobicContact CG1-CD1 4.23Å; A320-L351 HydrophobicContact CB-CD1 4.34Å; A320-L351 HydrophobicContact CB-CD2 4.29Å; G347-L351 WeakPolarHBondContact O-CB 3.41Å; G347-L351 PolarHBondContact O-N 3.43Å; Q348-L351 PolarHBondContact O-N 3.18Å; L351-N353 PolarHBondContact O-N 3.49Å; L351-V354 PolarHBondContact O-N 2.88Å; L351-L355 HydrophobicContact CD1-CD1 3.63Å; L351-L355 HydrophobicContact CD1-CD2 4.45Å; L351-L355 HydrophobicContact CD1-CG 3.89Å; L351-L355 HydrophobicContact CG-CD1 3.73Å; L351-L355 HydrophobicContact CG-CG 4.33Å; L351-L355 VanDerWaalsContact O-CB 3.29Å; L351-L355 WeakPolarHBondContact O-CB 3.12Å; L351-L355 WeakPolarHBondContact O-CG 3.5Å; L351-L355 PolarHBondContact O-N 2.89Å; L351-M374 HydrophobicContact CB-CE 3.65Å; L351-M374 HydrophobicContact CD1-CE 3.6Å; L351-M374 HydrophobicContact CD1-SD 3.62Å; L351-M374 HydrophobicContact CG-CE 4.21Å
352	L	94.9	Very high	95.4	Very high	80 Å²	80	48.3 Å²	48.3	42%	0.419	26%	0.262	S	S	.	.	H	α-helix	trans	-57	-48.7	176.2	173.3	64.9	0	0	0	112.1	V308 Q348 T349 T350 G356	V308-L352 HydrophobicContact CB-CD1 4.02Å; V308-L352 HydrophobicContact CG1-CD1 3.22Å; V308-L352 HydrophobicContact CG1-CG 4.5Å; Q348-L352 PolarHBondContact O-N 3.05Å; Q348-L352 VanDerWaalsContact O-N 3.11Å; T349-L352 PolarHBondContact O-N 2.77Å; T350-L352 VanDerWaalsContact C-N 3.34Å; T350-L352 PolarHBondContact O-N 3.04Å; L352-G356 PolarHBondContact O-N 3.22Å; L352-G356 VanDerWaalsContact O-N 3.16Å
353	N	94.7	Very high	95.3	Very high	107 Å²	107	47 Å²	47	57%	0.572	25%	0.251	S	S	*	.	H	α-helix	trans	-65.2	-44.1	-177.3	-70.3	-16.8	0	0	0	112.1	T349 T350 L351	T349-N353 PolarHBondContact O-N 3.3Å; T349-N353 PolarHBondContact O-ND2 3.44Å; T350-N353 PolarHBondContact O-N 3.3Å; L351-N353 PolarHBondContact O-N 3.49Å
354	V	95.4	Very high	95.2	Very high	8 Å²	8	50 Å²	50	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-47.9	-179.8	172.4	0	0	0	0	110.5	T350 L351 G356 T357 V358 I370 L373 M374	T350-V354 WeakPolarHBondContact O-CB 3.3Å; T350-V354 WeakPolarHBondContact O-CG2 3.22Å; T350-V354 PolarHBondContact O-N 3.42Å; L351-V354 PolarHBondContact O-N 2.88Å; V354-G356 PolarHBondContact O-N 2.8Å; V354-T357 PolarHBondContact O-N 2.94Å; V354-T357 PolarHBondContact O-OG1 2.93Å; V354-V358 PolarHBondContact O-N 2.96Å; V354-I370 HydrophobicContact CG1-CG2 3.76Å; V354-L373 HydrophobicContact CB-CD2 4.2Å; V354-L373 HydrophobicContact CG1-CD2 3.74Å; V354-L373 HydrophobicContact CG2-CD2 3.38Å; V354-M374 HydrophobicContact CB-CG 3.92Å; V354-M374 HydrophobicContact CG1-CG 3.9Å; V354-M374 HydrophobicContact CG2-CG 3.79Å
355	L	93.6	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-30.9	-180	-70.6	176.3	0	0	0	113.3	V308 V318 L351 T357 V358 L363	V308-L355 HydrophobicContact CG2-CB 3.68Å; V308-L355 HydrophobicContact CG2-CD1 3.75Å; V308-L355 HydrophobicContact CG2-CG 4.37Å; V318-L355 HydrophobicContact CB-CD1 3.59Å; V318-L355 HydrophobicContact CG1-CD1 3.94Å; V318-L355 HydrophobicContact CG1-CD2 4.36Å; V318-L355 HydrophobicContact CG2-CD1 3.75Å; V318-L355 HydrophobicContact CG2-CD2 4.2Å; L351-L355 HydrophobicContact CD1-CD1 3.63Å; L351-L355 HydrophobicContact CD1-CD2 4.45Å; L351-L355 HydrophobicContact CD1-CG 3.89Å; L351-L355 HydrophobicContact CG-CD1 3.73Å; L351-L355 HydrophobicContact CG-CG 4.33Å; L351-L355 VanDerWaalsContact O-CB 3.29Å; L351-L355 WeakPolarHBondContact O-CB 3.12Å; L351-L355 WeakPolarHBondContact O-CG 3.5Å; L351-L355 PolarHBondContact O-N 2.89Å; L355-T357 PolarHBondContact O-N 2.94Å; L355-V358 HydrophobicContact CD2-CG2 4.36Å; L355-V358 WeakPolarHBondContact O-CG2 3.34Å; L355-L363 HydrophobicContact CD2-CD1 3.59Å; L355-L363 HydrophobicContact CD2-CD2 4.13Å
356	G	94.6	Very high	95	Very high	36 Å²	36	47.9 Å²	47.9	37%	0.371	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-16.6	174.1	0	0	0	0	0	114.5	L352 V354	L352-G356 PolarHBondContact O-N 3.22Å; L352-G356 VanDerWaalsContact O-N 3.16Å; V354-G356 PolarHBondContact O-N 2.8Å
357	T	94.3	Very high	94.9	Very high	88 Å²	88	50.8 Å²	50.8	54%	0.54	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-15.8	-179.1	64.5	0	0	0	0	114.2	K311 V354 L355	K311-T357 WeakPolarHBondContact CD-O 3.37Å; V354-T357 PolarHBondContact O-N 2.94Å; V354-T357 PolarHBondContact O-OG1 2.93Å; L355-T357 PolarHBondContact O-N 2.94Å
358	V	95.2	Very high	94.8	Very high	10 Å²	10	58.9 Å²	58.9	6%	0.061	32%	0.315	C	S	.	.	S	Bend	trans	-101.4	153	-177	-73.2	0	0	0	0	112.4	T310 K311 V354 L355 I370	T310-V358 WeakPolarHBondContact CB-O 3.38Å; K311-V358 WeakPolarHBondContact CB-O 3.48Å; K311-V358 PolarHBondContact N-O 2.9Å; V354-V358 PolarHBondContact O-N 2.96Å; L355-V358 HydrophobicContact CD2-CG2 4.36Å; L355-V358 WeakPolarHBondContact O-CG2 3.34Å; V358-I370 HydrophobicContact CB-CD1 4.3Å; V358-I370 HydrophobicContact CG1-CD1 4.16Å; V358-I370 HydrophobicContact CG1-CG1 4.09Å; V358-I370 HydrophobicContact CG2-CD1 4.18Å
359	N	96.4	Very high	94.8	Very high	48 Å²	48	60.8 Å²	60.8	26%	0.257	33%	0.327	S	S	.	.			trans	-82	160.4	176.8	-76.8	11.7	0	0	0	111.2	K311 D312 E362 L363	K311-N359 WeakPolarHBondContact CB-OD1 3.49Å; K311-N359 VanDerWaalsContact CD-OD1 3.28Å; K311-N359 WeakPolarHBondContact CD-OD1 3.34Å; K311-N359 WeakPolarHBondContact CG-OD1 3.35Å; D312-N359 PolarHBondContact OD1-ND2 2.7Å; D312-N359 PolarHBondContact OD1-OD1 3.5Å; D312-N359 WeakPolarHBondContact OD2-CA 3.41Å; D312-N359 WeakPolarHBondContact OD2-CB 3.41Å; D312-N359 VanDerWaalsContact OD2-CG 3.31Å; N359-E362 HydrophobicContact CB-CB 4.32Å; N359-E362 PolarHBondContact O-N 3.38Å; N359-L363 WeakPolarHBondContact O-CB 3.36Å; N359-L363 PolarHBondContact O-N 3.16Å
360	L	95	Very high	94.8	Very high	19 Å²	19	58 Å²	58	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-43.6	178	174.7	66.6	0	0	0	111.5	D312 V314 V316 E362 L363 L364 L399	D312-L360 PolarHBondContact OD2-N 2.99Å; V314-L360 HydrophobicContact CB-CD2 4.47Å; V314-L360 HydrophobicContact CG1-CD2 4.15Å; V314-L360 HydrophobicContact CG2-CD2 4.26Å; V316-L360 HydrophobicContact CG1-CD1 3.78Å; L360-E362 VanDerWaalsContact C-N 3.32Å; L360-E362 PolarHBondContact O-N 3.1Å; L360-L363 WeakPolarHBondContact O-CB 3.47Å; L360-L363 PolarHBondContact O-N 3.2Å; L360-L364 HydrophobicContact CD1-CD1 4.21Å; L360-L364 HydrophobicContact CD1-CG 4.28Å; L360-L364 HydrophobicContact CG-CD1 4.16Å; L360-L364 WeakPolarHBondContact O-CG 3.37Å; L360-L364 PolarHBondContact O-N 2.97Å; L360-L399 HydrophobicContact CD1-CD2 3.8Å; L360-L399 HydrophobicContact CD1-CG 4.46Å; L360-L399 HydrophobicContact CD2-CD2 3.79Å; L360-L399 HydrophobicContact CG-CD2 4.38Å
361	E	94.1	Very high	94.8	Very high	151 Å²	151	57.9 Å²	57.9	71%	0.706	31%	0.311	S	S	*	.	H	α-helix	trans	-61.3	-42.7	-179.5	-176.5	179.5	179.6	0	0	111.6	L364 T365	E361-L364 PolarHBondContact O-N 3.47Å; E361-T365 WeakPolarHBondContact O-CB 3.17Å; E361-T365 PolarHBondContact O-N 2.93Å; E361-T365 PolarHBondContact O-OG1 2.91Å
362	E	94.8	Very high	94.8	Very high	82 Å²	82	60.5 Å²	60.5	38%	0.383	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-42	176.1	-169.7	178.5	-179.2	0	0	111	N359 L360 L364 T365 A366 I370	N359-E362 HydrophobicContact CB-CB 4.32Å; N359-E362 PolarHBondContact O-N 3.38Å; L360-E362 VanDerWaalsContact C-N 3.32Å; L360-E362 PolarHBondContact O-N 3.1Å; E362-L364 VanDerWaalsContact C-N 3.26Å; E362-L364 PolarHBondContact O-N 3.46Å; E362-T365 PolarHBondContact O-N 3.46Å; E362-A366 HydrophobicContact CG-CB 4.05Å; E362-A366 CarbonylContact O-C 3.57Å; E362-A366 WeakPolarHBondContact O-CA 3.29Å; E362-A366 PolarHBondContact O-N 2.81Å; E362-I370 HydrophobicContact CG-CD1 4.47Å
363	L	94.3	Very high	94.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-32.3	175.3	-177.2	63.6	0	0	0	113.3	V316 V318 L355 N359 L360 R367 I370 I394 V397	V316-L363 HydrophobicContact CG2-CD2 4.1Å; V318-L363 HydrophobicContact CG2-CD2 4.01Å; L355-L363 HydrophobicContact CD2-CD1 3.59Å; L355-L363 HydrophobicContact CD2-CD2 4.13Å; N359-L363 WeakPolarHBondContact O-CB 3.36Å; N359-L363 PolarHBondContact O-N 3.16Å; L360-L363 WeakPolarHBondContact O-CB 3.47Å; L360-L363 PolarHBondContact O-N 3.2Å; L363-R367 VanDerWaalsContact O-CG 3.23Å; L363-R367 WeakPolarHBondContact O-CG 3.43Å; L363-I370 HydrophobicContact CB-CD1 4.21Å; L363-I370 HydrophobicContact CD1-CD1 3.84Å; L363-I394 HydrophobicContact CD1-CD1 4.23Å; L363-V397 HydrophobicContact CD1-CG2 4.24Å; L363-V397 HydrophobicContact CD2-CG1 3.69Å; L363-V397 HydrophobicContact CD2-CG2 4.33Å; L363-V397 HydrophobicContact CG-CG1 4.1Å; L363-V397 HydrophobicContact CG-CG2 4.12Å
364	L	92.2	Very high	95	Very high	64 Å²	64	55.3 Å²	55.3	34%	0.335	31%	0.305	S	S	.	.	H	α-helix	trans	-82.3	-34.4	178.6	-66.4	177.6	0	0	0	112.7	L360 E361 E362 V397	L360-L364 HydrophobicContact CD1-CD1 4.21Å; L360-L364 HydrophobicContact CD1-CG 4.28Å; L360-L364 HydrophobicContact CG-CD1 4.16Å; L360-L364 WeakPolarHBondContact O-CG 3.37Å; L360-L364 PolarHBondContact O-N 2.97Å; E361-L364 PolarHBondContact O-N 3.47Å; E362-L364 VanDerWaalsContact C-N 3.26Å; E362-L364 PolarHBondContact O-N 3.46Å; L364-V397 HydrophobicContact CD2-CG1 4.26Å
365	T	93.4	Very high	95.1	Very high	116 Å²	116	57.9 Å²	57.9	71%	0.712	32%	0.316	S	S	*	.	H	α-helix	trans	-99.4	-45.8	-171.8	-48.9	0	0	0	0	113.1	E361 E362	E361-T365 WeakPolarHBondContact O-CB 3.17Å; E361-T365 PolarHBondContact O-N 2.93Å; E361-T365 PolarHBondContact O-OG1 2.91Å; E362-T365 PolarHBondContact O-N 3.46Å
366	A	93.4	Very high	95.3	Very high	24 Å²	24	64.9 Å²	64.9	20%	0.198	35%	0.349	C	S	.	.			trans	-108.1	50.3	-170	0	0	0	0	0	112.4	E362 E368 D369 I370	E362-A366 HydrophobicContact CG-CB 4.05Å; E362-A366 CarbonylContact O-C 3.57Å; E362-A366 WeakPolarHBondContact O-CA 3.29Å; E362-A366 PolarHBondContact O-N 2.81Å; A366-E368 PolarHBondContact O-N 2.91Å; A366-D369 HydrophobicContact CB-CB 4.44Å; A366-D369 PolarHBondContact O-N 3.23Å; A366-I370 PolarHBondContact O-N 2.9Å
367	R	94.8	Very high	95.4	Very high	90 Å²	90	65.6 Å²	65.6	34%	0.34	35%	0.347	S	S	.	.	H	α-helix	trans	-61	-32.7	-178.4	-67.5	-176.1	-173.4	-161.7	2.1	113.4	L363 A371 I394	L363-R367 VanDerWaalsContact O-CG 3.23Å; L363-R367 WeakPolarHBondContact O-CG 3.43Å; R367-A371 VanDerWaalsContact O-CB 3.27Å; R367-A371 WeakPolarHBondContact O-CB 3.17Å; R367-A371 PolarHBondContact O-N 2.72Å; R367-I394 HydrophobicContact CB-CD1 4.13Å; R367-I394 HydrophobicContact CG-CD1 4.35Å
368	E	95.3	Very high	95.5	Very high	170 Å²	170	61.4 Å²	61.4	79%	0.794	32%	0.322	S	S	*	.	H	α-helix	trans	-67.4	-39.8	-179	-65.4	-179.5	-176.6	0	0	111.8	A366 A371 A372	A366-E368 PolarHBondContact O-N 2.91Å; E368-A371 PolarHBondContact O-N 3.34Å; E368-A372 WeakPolarHBondContact O-CB 3.28Å; E368-A372 PolarHBondContact O-N 3.31Å
369	D	96.1	Very high	95.6	Very high	107 Å²	107	62.1 Å²	62.1	57%	0.572	33%	0.325	S	S	*	.	H	α-helix	trans	-67.1	-43	179.5	-64.2	-30.1	0	0	0	111.2	A366 A371 A372 L373	A366-D369 HydrophobicContact CB-CB 4.44Å; A366-D369 PolarHBondContact O-N 3.23Å; D369-A371 VanDerWaalsContact C-N 3.34Å; D369-A371 PolarHBondContact O-N 3.02Å; D369-A372 PolarHBondContact O-N 3.44Å; D369-L373 WeakPolarHBondContact O-CB 3.2Å; D369-L373 PolarHBondContact O-N 2.57Å
370	I	96.1	Very high	95.6	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-43.3	175.8	-58.9	174.8	0	0	0	110.4	V354 V358 E362 L363 A366 L373 M374 I394	V354-I370 HydrophobicContact CG1-CG2 3.76Å; V358-I370 HydrophobicContact CB-CD1 4.3Å; V358-I370 HydrophobicContact CG1-CD1 4.16Å; V358-I370 HydrophobicContact CG1-CG1 4.09Å; V358-I370 HydrophobicContact CG2-CD1 4.18Å; E362-I370 HydrophobicContact CG-CD1 4.47Å; L363-I370 HydrophobicContact CB-CD1 4.21Å; L363-I370 HydrophobicContact CD1-CD1 3.84Å; A366-I370 PolarHBondContact O-N 2.9Å; I370-L373 PolarHBondContact O-N 3.43Å; I370-M374 HydrophobicContact CG2-SD 4.5Å; I370-M374 WeakPolarHBondContact O-CB 3.43Å; I370-M374 WeakPolarHBondContact O-CG 3.5Å; I370-M374 PolarHBondContact O-N 3.12Å; I370-I394 HydrophobicContact CB-CD1 4.06Å; I370-I394 HydrophobicContact CG2-CD1 3.96Å
371	A	96.5	Very high	95.6	Very high	11 Å²	11	65.9 Å²	65.9	9%	0.091	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-40.8	177.2	0	0	0	0	0	112.3	R367 E368 D369 M374 Q375 V392	R367-A371 VanDerWaalsContact O-CB 3.27Å; R367-A371 WeakPolarHBondContact O-CB 3.17Å; R367-A371 PolarHBondContact O-N 2.72Å; E368-A371 PolarHBondContact O-N 3.34Å; D369-A371 VanDerWaalsContact C-N 3.34Å; D369-A371 PolarHBondContact O-N 3.02Å; A371-M374 PolarHBondContact O-N 3.41Å; A371-Q375 WeakPolarHBondContact O-CB 3.31Å; A371-Q375 PolarHBondContact O-N 3.29Å; A371-V392 WeakPolarHBondContact CB-O 3.47Å
372	A	96.6	Very high	95.7	Very high	55 Å²	55	58.7 Å²	58.7	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-65.3	-43.7	176.2	0	0	0	0	0	112	E368 D369 Q375 E376	E368-A372 WeakPolarHBondContact O-CB 3.28Å; E368-A372 PolarHBondContact O-N 3.31Å; D369-A372 PolarHBondContact O-N 3.44Å; A372-Q375 WeakPolarHBondContact O-CB 3.23Å; A372-Q375 PolarHBondContact O-N 2.76Å; A372-E376 PolarHBondContact O-N 2.82Å
373	L	96.2	Very high	95.7	Very high	79 Å²	79	59.2 Å²	59.2	41%	0.414	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-45	175.9	-175.4	149.6	0	0	0	111.3	V354 D369 I370 Q375 E376 C377	V354-L373 HydrophobicContact CB-CD2 4.2Å; V354-L373 HydrophobicContact CG1-CD2 3.74Å; V354-L373 HydrophobicContact CG2-CD2 3.38Å; D369-L373 WeakPolarHBondContact O-CB 3.2Å; D369-L373 PolarHBondContact O-N 2.57Å; I370-L373 PolarHBondContact O-N 3.43Å; L373-Q375 VanDerWaalsContact C-N 3.32Å; L373-Q375 PolarHBondContact O-N 2.9Å; L373-E376 PolarHBondContact O-N 2.98Å; L373-C377 PolarHBondContact O-N 3.37Å; L373-C377 PolarHBondContact O-SG 3.09Å; L373-C377 VanDerWaalsContact O-SG 3.34Å
374	M	97	Very high	95.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60.9	-41.2	174.5	-77.2	-174.4	65.6	0	0	112.5	L351 V354 I370 A371 C377 L378 V392	L351-M374 HydrophobicContact CB-CE 3.65Å; L351-M374 HydrophobicContact CD1-CE 3.6Å; L351-M374 HydrophobicContact CD1-SD 3.62Å; L351-M374 HydrophobicContact CG-CE 4.21Å; V354-M374 HydrophobicContact CB-CG 3.92Å; V354-M374 HydrophobicContact CG1-CG 3.9Å; V354-M374 HydrophobicContact CG2-CG 3.79Å; I370-M374 HydrophobicContact CG2-SD 4.5Å; I370-M374 WeakPolarHBondContact O-CB 3.43Å; I370-M374 WeakPolarHBondContact O-CG 3.5Å; I370-M374 PolarHBondContact O-N 3.12Å; A371-M374 PolarHBondContact O-N 3.41Å; M374-C377 PolarHBondContact O-N 3.35Å; M374-L378 WeakPolarHBondContact O-CB 3.27Å; M374-L378 WeakPolarHBondContact O-CG 3.39Å; M374-L378 PolarHBondContact O-N 2.74Å; M374-V392 HydrophobicContact CB-CG1 4.32Å; M374-V392 HydrophobicContact CE-CG1 4.1Å; M374-V392 HydrophobicContact SD-CG1 4.4Å
375	Q	97.7	Very high	95.8	Very high	61 Å²	61	61.3 Å²	61.3	29%	0.285	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-46.4	177	177.3	-176.8	-27	0	0	110.9	A371 A372 L373 L378 D379 V389 E390 V392	A371-Q375 WeakPolarHBondContact O-CB 3.31Å; A371-Q375 PolarHBondContact O-N 3.29Å; A372-Q375 WeakPolarHBondContact O-CB 3.23Å; A372-Q375 PolarHBondContact O-N 2.76Å; L373-Q375 VanDerWaalsContact C-N 3.32Å; L373-Q375 PolarHBondContact O-N 2.9Å; Q375-L378 PolarHBondContact O-N 2.95Å; Q375-D379 WeakPolarHBondContact O-CB 3.45Å; Q375-D379 PolarHBondContact O-N 3.31Å; Q375-V389 HydrophobicContact CG-CG1 4.21Å; Q375-E390 PolarHBondContact NE2-O 3.24Å; Q375-E390 VanDerWaalsContact NE2-O 3.1Å; Q375-V392 HydrophobicContact CB-CG2 4.01Å
376	E	97.4	Very high	95.9	Very high	147 Å²	147	56 Å²	56	69%	0.687	31%	0.307	S	S	*	.	H	α-helix	trans	-61.8	-47.1	178.1	-175.8	175.7	-174.4	0	0	111.6	A372 L373 L378 D379 S380	A372-E376 PolarHBondContact O-N 2.82Å; L373-E376 PolarHBondContact O-N 2.98Å; E376-L378 PolarHBondContact O-N 2.89Å; E376-D379 PolarHBondContact O-N 2.93Å; E376-S380 WeakPolarHBondContact O-CB 3.28Å; E376-S380 PolarHBondContact O-N 2.92Å
377	C	95.9	Very high	96	Very high	51 Å²	51	55 Å²	55	35%	0.345	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-46.2	177	-67.7	0	0	0	0	111.9	L373 M374 S380	L373-C377 PolarHBondContact O-N 3.37Å; L373-C377 PolarHBondContact O-SG 3.09Å; L373-C377 VanDerWaalsContact O-SG 3.34Å; M374-C377 PolarHBondContact O-N 3.35Å; C377-S380 PolarHBondContact O-OG 3.14Å
378	L	96.6	Very high	96.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-47.4	179.4	-77.5	173.1	0	0	0	112.1	V322 L346 T350 M374 Q375 E376 S380 V381 T382 V389 V392	V322-L378 HydrophobicContact CG2-CD1 4.24Å; L346-L378 HydrophobicContact CB-CD2 4.3Å; L346-L378 HydrophobicContact CD2-CD2 3.74Å; L346-L378 HydrophobicContact CG-CD2 3.62Å; T350-L378 HydrophobicContact CG2-CD2 3.64Å; T350-L378 HydrophobicContact CG2-CG 4.14Å; T350-L378 VanDerWaalsContact OG1-CD2 3.3Å; T350-L378 WeakPolarHBondContact OG1-CD2 3.47Å; M374-L378 WeakPolarHBondContact O-CB 3.27Å; M374-L378 WeakPolarHBondContact O-CG 3.39Å; M374-L378 PolarHBondContact O-N 2.74Å; Q375-L378 PolarHBondContact O-N 2.95Å; E376-L378 PolarHBondContact O-N 2.89Å; L378-S380 VanDerWaalsContact C-N 3.29Å; L378-S380 PolarHBondContact O-N 3.41Å; L378-V381 PolarHBondContact O-N 3.31Å; L378-T382 WeakPolarHBondContact O-CG2 3.37Å; L378-T382 PolarHBondContact O-N 3.5Å; L378-T382 PolarHBondContact O-OG1 3.31Å; L378-T382 VanDerWaalsContact O-OG1 3.05Å; L378-V389 HydrophobicContact CB-CG2 4.07Å; L378-V392 HydrophobicContact CD1-CG2 3.99Å
379	D	96.9	Very high	96.3	Very high	25 Å²	25	45.5 Å²	45.5	13%	0.134	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-39.1	-177.4	-169.6	63.1	0	0	0	112	Q375 E376 V381 T382 E383 K388 V389	Q375-D379 WeakPolarHBondContact O-CB 3.45Å; Q375-D379 PolarHBondContact O-N 3.31Å; E376-D379 PolarHBondContact O-N 2.93Å; D379-V381 VanDerWaalsContact C-N 3.27Å; D379-V381 PolarHBondContact O-N 3.06Å; D379-T382 WeakPolarHBondContact CA-OG1 3.47Å; D379-T382 PolarHBondContact O-N 3.34Å; D379-T382 PolarHBondContact O-OG1 3.39Å; D379-E383 WeakPolarHBondContact O-CB 3.41Å; D379-E383 PolarHBondContact O-N 3.42Å; D379-K388 VanDerWaalsContact OD1-CD 3.23Å; D379-K388 WeakPolarHBondContact OD1-CD 3.48Å; D379-K388 VanDerWaalsContact OD1-CE 3.26Å; D379-K388 WeakPolarHBondContact OD1-CE 3.43Å; D379-K388 IonicContact OD1-NZ 3.47Å; D379-K388 PolarHBondContact OD1-NZ 3.3Å; D379-K388 IonicContact OD2-NZ 3.47Å; D379-K388 PolarHBondContact OD2-NZ 3.04Å; D379-V389 HydrophobicContact CB-CB 4.38Å; D379-V389 PolarHBondContact OD1-N 3.31Å
380	S	96.4	Very high	96.3	Very high	83 Å²	83	43.3 Å²	43.3	58%	0.58	24%	0.243	S	C	*	.	H	α-helix	trans	-59.4	-35.4	177.9	74.4	0	0	0	0	113.5	E376 C377 L378	E376-S380 WeakPolarHBondContact O-CB 3.28Å; E376-S380 PolarHBondContact O-N 2.92Å; C377-S380 PolarHBondContact O-OG 3.14Å; L378-S380 VanDerWaalsContact C-N 3.29Å; L378-S380 PolarHBondContact O-N 3.41Å
381	V	95.6	Very high	96.3	Very high	64 Å²	64	49 Å²	49	39%	0.388	26%	0.264	S	S	.	.	H	α-helix	trans	-86.6	-42.4	179.4	178.9	0	0	0	0	110.7	L346 L378 D379 E383 A384 W385	L346-V381 HydrophobicContact CD1-CG1 4.12Å; L346-V381 HydrophobicContact CD2-CB 3.82Å; L346-V381 HydrophobicContact CD2-CG1 3.66Å; L378-V381 PolarHBondContact O-N 3.31Å; D379-V381 VanDerWaalsContact C-N 3.27Å; D379-V381 PolarHBondContact O-N 3.06Å; V381-E383 VanDerWaalsContact C-N 3.28Å; V381-E383 PolarHBondContact O-N 2.97Å; V381-A384 PolarHBondContact O-N 3.36Å; V381-W385 HydrophobicContact CG1-CH2 4.49Å; V381-W385 HydrophobicContact CG1-CZ2 4.33Å
382	T	96	Very high	96.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72	-19.6	-176	58.8	0	0	0	0	113.7	T343 L346 L378 D379 A384 W385 G386 V387 V389	T343-T382 HydrophobicContact CG2-CG2 4.09Å; L346-T382 HydrophobicContact CD2-CG2 3.78Å; L378-T382 WeakPolarHBondContact O-CG2 3.37Å; L378-T382 PolarHBondContact O-N 3.5Å; L378-T382 PolarHBondContact O-OG1 3.31Å; L378-T382 VanDerWaalsContact O-OG1 3.05Å; D379-T382 WeakPolarHBondContact CA-OG1 3.47Å; D379-T382 PolarHBondContact O-N 3.34Å; D379-T382 PolarHBondContact O-OG1 3.39Å; T382-A384 PolarHBondContact O-N 3.02Å; T382-W385 HydrophobicContact CG2-CE3 3.95Å; T382-W385 HydrophobicContact CG2-CZ3 3.96Å; T382-W385 WeakPolarHBondContact O-CA 3.37Å; T382-W385 WeakPolarHBondContact O-CB 3.28Å; T382-W385 PolarHBondContact O-N 2.9Å; T382-G386 PolarHBondContact O-N 2.94Å; T382-V387 CarbonylContact C-O 3.55Å; T382-V387 VanDerWaalsContact C-O 3.29Å; T382-V387 PolarHBondContact O-N 3Å; T382-V387 VanDerWaalsContact O-N 3.13Å; T382-V387 VanDerWaalsContact O-O 3.13Å; T382-V387 PolarHBondContact OG1-O 2.99Å; T382-V389 HydrophobicContact CG2-CG2 4.34Å
383	E	95.4	Very high	96.3	Very high	93 Å²	93	49.8 Å²	49.8	44%	0.435	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-60.1	-33.6	177.1	-176.3	163.1	-143	0	0	112.2	R327 D379 V381 W385 G386	R327-E383 IonicContact NH1-OE1 2.76Å; R327-E383 PolarHBondContact NH1-OE1 3.32Å; D379-E383 WeakPolarHBondContact O-CB 3.41Å; D379-E383 PolarHBondContact O-N 3.42Å; V381-E383 VanDerWaalsContact C-N 3.28Å; V381-E383 PolarHBondContact O-N 2.97Å; E383-W385 PolarHBondContact O-N 3.32Å; E383-G386 PolarHBondContact O-N 3.02Å
384	A	93.6	Very high	96.3	Very high	56 Å²	56	47.1 Å²	47.1	46%	0.463	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-62.3	-28.6	174.3	0	0	0	0	0	112.5	N335 V381 T382 G386	N335-A384 PolarHBondContact ND2-O 3.13Å; V381-A384 PolarHBondContact O-N 3.36Å; T382-A384 PolarHBondContact O-N 3.02Å; A384-G386 VanDerWaalsContact C-N 3.35Å
385	W	95.2	Very high	96.2	Very high	52 Å²	52	52.3 Å²	52.3	20%	0.197	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-88.5	-2.9	177.3	-50.5	-24.5	0	0	0	112.7	R331 A332 V336 A342 L346 V381 T382 E383 V387	R331-W385 CarbonylContact C-O 3.58Å; A332-W385 WeakPolarHBondContact CA-O 3.43Å; A332-W385 PolarHBondContact N-O 2.8Å; V336-W385 HydrophobicContact CG2-CB 3.8Å; V336-W385 HydrophobicContact CG2-CD2 3.64Å; V336-W385 HydrophobicContact CG2-CG 3.25Å; A342-W385 HydrophobicContact CB-CE3 4.38Å; A342-W385 HydrophobicContact CB-CH2 3.86Å; A342-W385 HydrophobicContact CB-CZ2 4.47Å; A342-W385 HydrophobicContact CB-CZ3 3.81Å; L346-W385 HydrophobicContact CB-CH2 4.27Å; L346-W385 HydrophobicContact CD2-CH2 3.89Å; L346-W385 HydrophobicContact CD2-CZ3 3.98Å; V381-W385 HydrophobicContact CG1-CH2 4.49Å; V381-W385 HydrophobicContact CG1-CZ2 4.33Å; T382-W385 HydrophobicContact CG2-CE3 3.95Å; T382-W385 HydrophobicContact CG2-CZ3 3.96Å; T382-W385 WeakPolarHBondContact O-CA 3.37Å; T382-W385 WeakPolarHBondContact O-CB 3.28Å; T382-W385 PolarHBondContact O-N 2.9Å; E383-W385 PolarHBondContact O-N 3.32Å; W385-V387 VanDerWaalsContact C-N 3.28Å; W385-V387 PolarHBondContact O-N 3.04Å
386	G	94.6	Very high	96	Very high	5 Å²	5	52 Å²	52	5%	0.052	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	16	-173.9	0	0	0	0	0	113.9	R327 D328 T382 E383 A384	R327-G386 PolarHBondContact N-O 3.11Å; D328-G386 PolarHBondContact N-O 3.35Å; T382-G386 PolarHBondContact O-N 2.94Å; E383-G386 PolarHBondContact O-N 3.02Å; A384-G386 VanDerWaalsContact C-N 3.35Å
387	V	96.8	Very high	95.8	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.5	175.3	170.2	0	0	0	0	109.6	Y324 A339 T382 W385	Y324-V387 HydrophobicContact CD2-CG1 3.55Å; Y324-V387 HydrophobicContact CE2-CG1 4.43Å; Y324-V387 HydrophobicContact CG-CG1 4.17Å; A339-V387 HydrophobicContact CB-CG2 4.03Å; T382-V387 CarbonylContact C-O 3.55Å; T382-V387 VanDerWaalsContact C-O 3.29Å; T382-V387 PolarHBondContact O-N 3Å; T382-V387 VanDerWaalsContact O-N 3.13Å; T382-V387 VanDerWaalsContact O-O 3.13Å; T382-V387 PolarHBondContact OG1-O 2.99Å; W385-V387 VanDerWaalsContact C-N 3.28Å; W385-V387 PolarHBondContact O-N 3.04Å
388	K	97.4	Very high	95.8	Very high	60 Å²	60	50.9 Å²	50.9	26%	0.261	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.8	175	179.2	74.2	-158.9	169.1	0	109.1	Y324 R325 R327 D379	Y324-K388 CarbonylContact C-O 3.19Å; Y324-K388 VanDerWaalsContact CA-O 3.23Å; Y324-K388 WeakPolarHBondContact CA-O 3.23Å; Y324-K388 WeakPolarHBondContact CB-O 3.49Å; R325-K388 HydrophobicContact CG-CB 4.31Å; R325-K388 PolarHBondContact N-O 3.26Å; R325-K388 PolarHBondContact O-N 3.06Å; R327-K388 HydrophobicContact CB-CB 4.12Å; D379-K388 VanDerWaalsContact OD1-CD 3.23Å; D379-K388 WeakPolarHBondContact OD1-CD 3.48Å; D379-K388 VanDerWaalsContact OD1-CE 3.26Å; D379-K388 WeakPolarHBondContact OD1-CE 3.43Å; D379-K388 IonicContact OD1-NZ 3.47Å; D379-K388 PolarHBondContact OD1-NZ 3.3Å; D379-K388 IonicContact OD2-NZ 3.47Å; D379-K388 PolarHBondContact OD2-NZ 3.04Å
389	V	97.8	Very high	95.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.9	171	-177.3	0	0	0	0	108.3	V322 Q375 L378 D379 T382 V392	V322-V389 HydrophobicContact CG1-CG1 3.88Å; Q375-V389 HydrophobicContact CG-CG1 4.21Å; L378-V389 HydrophobicContact CB-CG2 4.07Å; D379-V389 HydrophobicContact CB-CB 4.38Å; D379-V389 PolarHBondContact OD1-N 3.31Å; T382-V389 HydrophobicContact CG2-CG2 4.34Å; V389-V392 HydrophobicContact CG1-CG2 4.07Å
390	E	96.1	Very high	95.6	Very high	61 Å²	61	53.5 Å²	53.5	29%	0.285	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-43.5	-177.6	-64.9	-164.4	144.3	0	0	112	T298 Y323 R325 Q375	T298-E390 WeakPolarHBondContact CB-OE2 3.3Å; T298-E390 WeakPolarHBondContact CG2-OE2 3.24Å; T298-E390 PolarHBondContact OG1-OE1 2.6Å; T298-E390 PolarHBondContact OG1-OE2 2.86Å; Y323-E390 PolarHBondContact O-N 2.84Å; R325-E390 WeakPolarHBondContact CD-OE1 3.32Å; R325-E390 HydrophobicContact CG-CG 4.24Å; R325-E390 IonicContact CZ-OE1 3.62Å; R325-E390 IonicContact NE-OE1 3Å; R325-E390 PolarHBondContact NE-OE1 3.15Å; R325-E390 VanDerWaalsContact NE-OE1 3.13Å; R325-E390 IonicContact NH1-OE1 2.67Å; Q375-E390 PolarHBondContact NE2-O 3.24Å; Q375-E390 VanDerWaalsContact NE2-O 3.1Å
391	R	95.9	Very high	95.5	Very high	125 Å²	125	54 Å²	54	47%	0.472	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	158.3	174.5	72	-177.1	79.9	161.3	3.4	111.5	Y323 E393	Y323-R391 HydrophobicContact CD2-CG 3.36Å; Y323-R391 HydrophobicContact CE2-CG 4.05Å; Y323-R391 HydrophobicContact CG-CG 3.7Å; Y323-R391 PolarHBondContact N-O 2.8Å; Y323-R391 PolarHBondContact O-N 3.02Å; R391-E393 VanDerWaalsContact CD-OE1 3.23Å; R391-E393 WeakPolarHBondContact CD-OE1 3.4Å; R391-E393 IonicContact NH1-OE1 3.9Å
392	V	97.8	Very high	95.4	Very high	8 Å²	8	58.8 Å²	58.8	5%	0.048	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.2	168.8	-178.8	0	0	0	0	107.7	A320 V321 V322 A371 M374 Q375 L378 V389	A320-V392 HydrophobicContact CB-CG1 4.45Å; V321-V392 WeakPolarHBondContact O-CA 3.39Å; V322-V392 HydrophobicContact CG2-CG1 4.5Å; V322-V392 HydrophobicContact CG2-CG2 4.36Å; A371-V392 WeakPolarHBondContact CB-O 3.47Å; M374-V392 HydrophobicContact CB-CG1 4.32Å; M374-V392 HydrophobicContact CE-CG1 4.1Å; M374-V392 HydrophobicContact SD-CG1 4.4Å; Q375-V392 HydrophobicContact CB-CG2 4.01Å; L378-V392 HydrophobicContact CD1-CG2 3.99Å; V389-V392 HydrophobicContact CG1-CG2 4.07Å
393	E	96.6	Very high	95.3	Very high	74 Å²	74	61.8 Å²	61.8	35%	0.346	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.8	177.8	-69.4	175	-178	0	0	109.6	A320 V321 Y323 R391	A320-E393 CarbonylContact C-O 3.52Å; A320-E393 VanDerWaalsContact CA-O 3.22Å; A320-E393 WeakPolarHBondContact CA-O 3.21Å; A320-E393 WeakPolarHBondContact CB-O 3.47Å; V321-E393 PolarHBondContact N-O 3Å; V321-E393 PolarHBondContact O-N 3.39Å; Y323-E393 HydrophobicContact CE2-CB 4.41Å; Y323-E393 VanDerWaalsContact CE2-CD 3.46Å; Y323-E393 HydrophobicContact CE2-CG 4Å; Y323-E393 VanDerWaalsContact CE2-OE2 3.31Å; Y323-E393 WeakPolarHBondContact CE2-OE2 3.06Å; Y323-E393 PolarHBondContact OH-OE2 3.46Å; R391-E393 VanDerWaalsContact CD-OE1 3.23Å; R391-E393 WeakPolarHBondContact CD-OE1 3.4Å; R391-E393 IonicContact NH1-OE1 3.9Å
394	I	96.3	Very high	95.2	Very high	22 Å²	22	62 Å²	62	11%	0.113	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.5	174	-58.3	176.2	0	0	0	108	V318 L363 R367 I370 V397	V318-I394 HydrophobicContact CG1-CG2 4.08Å; L363-I394 HydrophobicContact CD1-CD1 4.23Å; R367-I394 HydrophobicContact CB-CD1 4.13Å; R367-I394 HydrophobicContact CG-CD1 4.35Å; I370-I394 HydrophobicContact CB-CD1 4.06Å; I370-I394 HydrophobicContact CG2-CD1 3.96Å; I394-V397 HydrophobicContact CG2-CG2 3.79Å
395	K	94.3	Very high	95.3	Very high	109 Å²	109	67.9 Å²	67.9	47%	0.474	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-53.5	-171.2	-178.7	173.5	-175.5	171.6	0	112.1	D302 N319 V321	D302-K395 IonicContact OD1-NZ 3.57Å; D302-K395 PolarHBondContact OD1-NZ 3.46Å; D302-K395 IonicContact OD2-NZ 2.79Å; D302-K395 PolarHBondContact OD2-NZ 2.77Å; N319-K395 PolarHBondContact O-N 2.8Å; N319-K395 WeakPolarHBondContact OD1-CB 3.45Å; V321-K395 HydrophobicContact CG2-CB 4.19Å; V321-K395 HydrophobicContact CG2-CD 3.94Å
396	D	93.2	Very high	95.3	Very high	55 Å²	55	68 Å²	68	29%	0.294	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	148	-178.3	-167.8	14.4	0	0	0	110.3	V318 N319 R398	V318-D396 WeakPolarHBondContact CA-O 3.42Å; N319-D396 PolarHBondContact N-O 2.97Å; N319-D396 VanDerWaalsContact OD1-CA 3.28Å; N319-D396 WeakPolarHBondContact OD1-CA 3.15Å; N319-D396 WeakPolarHBondContact OD1-CB 3.08Å; N319-D396 PolarHBondContact OD1-N 3.31Å; N319-D396 PolarHBondContact OD1-O 3.26Å; N319-D396 VanDerWaalsContact OD1-O 3.09Å; D396-R398 IonicContact OD2-CZ 3.75Å; D396-R398 IonicContact OD2-NE 2.74Å; D396-R398 PolarHBondContact OD2-NE 3.43Å; D396-R398 IonicContact OD2-NH2 3.42Å; D396-R398 PolarHBondContact OD2-NH2 3.05Å
397	V	94.3	Very high	95.3	Very high	12 Å²	12	71.1 Å²	71.1	7%	0.073	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	112.8	176.8	178.1	0	0	0	0	107.1	V318 L363 L364 I394	V318-V397 HydrophobicContact CG1-CG2 4.24Å; V318-V397 HydrophobicContact CG2-CG1 4.2Å; V318-V397 HydrophobicContact CG2-CG2 4.2Å; L363-V397 HydrophobicContact CD1-CG2 4.24Å; L363-V397 HydrophobicContact CD2-CG1 3.69Å; L363-V397 HydrophobicContact CD2-CG2 4.33Å; L363-V397 HydrophobicContact CG-CG1 4.1Å; L363-V397 HydrophobicContact CG-CG2 4.12Å; L364-V397 HydrophobicContact CD2-CG1 4.26Å; I394-V397 HydrophobicContact CG2-CG2 3.79Å
398	R	94.8	Very high	95.2	Very high	163 Å²	163	73.9 Å²	73.9	62%	0.615	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.4	-178.3	-62	-177.5	178.8	-169.1	-2.8	110.8	V317 D396	V317-R398 HydrophobicContact CB-CB 4.28Å; V317-R398 PolarHBondContact N-O 3.32Å; V317-R398 PolarHBondContact O-N 3.2Å; D396-R398 IonicContact OD2-CZ 3.75Å; D396-R398 IonicContact OD2-NE 2.74Å; D396-R398 PolarHBondContact OD2-NE 3.43Å; D396-R398 IonicContact OD2-NH2 3.42Å; D396-R398 PolarHBondContact OD2-NH2 3.05Å
399	L	94.7	Very high	95.2	Very high	28 Å²	28	74.1 Å²	74.1	15%	0.147	37%	0.369	C	S	.	.			trans	-102.9	153.6	172.8	-56.5	95.9	0	0	0	109.5	L360 I401 L403 M407	L360-L399 HydrophobicContact CD1-CD2 3.8Å; L360-L399 HydrophobicContact CD1-CG 4.46Å; L360-L399 HydrophobicContact CD2-CD2 3.79Å; L360-L399 HydrophobicContact CG-CD2 4.38Å; L399-I401 PolarHBondContact O-N 2.96Å; L399-L403 HydrophobicContact CD2-CD2 4.24Å; L399-M407 HydrophobicContact CD2-CE 4.47Å
400	P	94.5	Very high	95.1	Very high	52 Å²	52	80 Å²	80	34%	0.338	40%	0.396	S	S	.	.			trans	-58	133.1	170.5	22	-31.3	0	0	0	110.2	T315 Q402 L403 Q404	T315-P400 WeakPolarHBondContact O-CD 3.31Å; P400-Q402 PolarHBondContact O-N 3.16Å; P400-L403 HydrophobicContact CG-CB 3.88Å; P400-L403 HydrophobicContact CG-CD2 4.37Å; P400-L403 PolarHBondContact O-N 2.81Å; P400-Q404 PolarHBondContact O-N 3.32Å
401	I	94.3	Very high	95.1	Very high	92 Å²	92	79 Å²	79	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-55.9	-31.2	-173.7	-173	59.1	0	0	0	113.3	L399 R405	L399-I401 PolarHBondContact O-N 2.96Å; I401-R405 HydrophobicContact CD1-CG 4.42Å; I401-R405 VanDerWaalsContact O-CG 3.28Å; I401-R405 WeakPolarHBondContact O-CG 3.32Å; I401-R405 PolarHBondContact O-N 3.08Å; I401-R405 VanDerWaalsContact O-N 3.11Å
402	Q	94.5	Very high	95.1	Very high	166 Å²	166	78.6 Å²	78.6	78%	0.776	40%	0.402	S	S	*	.	H	α-helix	trans	-65.7	-47.2	177.1	-67.4	179.2	-12.7	0	0	111.3	P400 R405 A406	P400-Q402 PolarHBondContact O-N 3.16Å; Q402-R405 PolarHBondContact O-N 3.47Å; Q402-A406 PolarHBondContact O-N 2.95Å; Q402-A406 VanDerWaalsContact O-N 3.08Å
403	L	93.4	Very high	95.1	Very high	63 Å²	63	81.3 Å²	81.3	33%	0.33	42%	0.421	S	S	.	.	H	α-helix	trans	-66.5	-43	176.9	-177.3	67.2	0	0	0	111.1	V314 L399 P400 R405 A406 M407	V314-L403 HydrophobicContact CG1-CD2 3.42Å; V314-L403 VanDerWaalsContact CG1-CD2 3.42Å; V314-L403 HydrophobicContact CG2-CD2 4.46Å; L399-L403 HydrophobicContact CD2-CD2 4.24Å; P400-L403 HydrophobicContact CG-CB 3.88Å; P400-L403 HydrophobicContact CG-CD2 4.37Å; P400-L403 PolarHBondContact O-N 2.81Å; L403-R405 VanDerWaalsContact C-N 3.28Å; L403-R405 PolarHBondContact O-N 3.33Å; L403-A406 PolarHBondContact O-N 2.97Å; L403-A406 VanDerWaalsContact O-N 3.16Å; L403-M407 VanDerWaalsContact O-CB 3.32Å; L403-M407 WeakPolarHBondContact O-CB 3.37Å; L403-M407 PolarHBondContact O-N 2.83Å
404	Q	94	Very high	95	Very high	97 Å²	97	81.5 Å²	81.5	45%	0.453	43%	0.427	S	S	.	.	H	α-helix	trans	-58.4	-41.8	179.3	-171.8	-177.8	20	0	0	111.8	P400 A408	P400-Q404 PolarHBondContact O-N 3.32Å; Q404-A408 VanDerWaalsContact O-CB 3.31Å; Q404-A408 WeakPolarHBondContact O-CB 3.39Å; Q404-A408 PolarHBondContact O-N 2.97Å
405	R	95.8	Very high	95.1	Very high	179 Å²	179	88.6 Å²	88.6	68%	0.675	45%	0.453	S	S	*	.	H	α-helix	trans	-67.7	-42.2	176	-72.2	174.9	-177.8	-179.3	1.5	112.3	I401 Q402 L403 A408 A409	I401-R405 HydrophobicContact CD1-CG 4.42Å; I401-R405 VanDerWaalsContact O-CG 3.28Å; I401-R405 WeakPolarHBondContact O-CG 3.32Å; I401-R405 PolarHBondContact O-N 3.08Å; I401-R405 VanDerWaalsContact O-N 3.11Å; Q402-R405 PolarHBondContact O-N 3.47Å; L403-R405 VanDerWaalsContact C-N 3.28Å; L403-R405 PolarHBondContact O-N 3.33Å; R405-A408 PolarHBondContact O-N 3Å; R405-A409 WeakPolarHBondContact O-CB 3.45Å; R405-A409 PolarHBondContact O-N 3.44Å
406	A	94.8	Very high	95.3	Very high	55 Å²	55	88.2 Å²	88.2	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-62	-47.7	176.5	0	0	0	0	0	111.4	Q402 L403 A408 A409 E410	Q402-A406 PolarHBondContact O-N 2.95Å; Q402-A406 VanDerWaalsContact O-N 3.08Å; L403-A406 PolarHBondContact O-N 2.97Å; L403-A406 VanDerWaalsContact O-N 3.16Å; A406-A408 VanDerWaalsContact C-N 3.35Å; A406-A408 PolarHBondContact O-N 3.22Å; A406-A409 PolarHBondContact O-N 3.44Å; A406-E410 WeakPolarHBondContact O-CB 3.23Å; A406-E410 PolarHBondContact O-N 2.88Å
407	M	94.2	Very high	95.5	Very high	71 Å²	71	88.1 Å²	88.1	35%	0.35	46%	0.459	S	S	.	.	H	α-helix	trans	-63.3	-38.1	177.7	-171.7	178.2	74.6	0	0	112.1	L399 L403 A411	L399-M407 HydrophobicContact CD2-CE 4.47Å; L403-M407 VanDerWaalsContact O-CB 3.32Å; L403-M407 WeakPolarHBondContact O-CB 3.37Å; L403-M407 PolarHBondContact O-N 2.83Å; M407-A411 VanDerWaalsContact O-CB 3.23Å; M407-A411 WeakPolarHBondContact O-CB 3.46Å; M407-A411 PolarHBondContact O-N 3.48Å
408	A	95.6	Very high	95.6	Very high	59 Å²	59	91 Å²	91	49%	0.488	48%	0.477	S	S	.	.	H	α-helix	trans	-66.2	-41.9	174.6	0	0	0	0	0	112.2	Q404 R405 A406 A411 E412	Q404-A408 VanDerWaalsContact O-CB 3.31Å; Q404-A408 WeakPolarHBondContact O-CB 3.39Å; Q404-A408 PolarHBondContact O-N 2.97Å; R405-A408 PolarHBondContact O-N 3Å; A406-A408 VanDerWaalsContact C-N 3.35Å; A406-A408 PolarHBondContact O-N 3.22Å; A408-A411 PolarHBondContact O-N 2.99Å; A408-E412 WeakPolarHBondContact O-CB 3.47Å; A408-E412 PolarHBondContact O-N 3.48Å
409	A	96.4	Very high	95.7	Very high	65 Å²	65	86 Å²	86	54%	0.537	47%	0.47	S	S	.	.	H	α-helix	trans	-65.7	-41.8	176.5	0	0	0	0	0	112	R405 A406 E412 S413	R405-A409 WeakPolarHBondContact O-CB 3.45Å; R405-A409 PolarHBondContact O-N 3.44Å; A406-A409 PolarHBondContact O-N 3.44Å; A409-E412 PolarHBondContact O-N 3.08Å; A409-S413 PolarHBondContact O-N 2.89Å; A409-S413 VanDerWaalsContact O-N 3.08Å
410	E	95.9	Very high	95.9	Very high	125 Å²	125	90.8 Å²	90.8	58%	0.584	49%	0.49	S	S	*	.	H	α-helix	trans	-61.4	-50.1	173.9	-176.6	179.8	179.8	0	0	111.1	A406 E412 S413 V414	A406-E410 WeakPolarHBondContact O-CB 3.23Å; A406-E410 PolarHBondContact O-N 2.88Å; E410-E412 VanDerWaalsContact C-N 3.3Å; E410-E412 PolarHBondContact O-N 2.7Å; E410-S413 PolarHBondContact O-N 3.48Å; E410-S413 VanDerWaalsContact O-N 3.12Å; E410-S413 PolarHBondContact O-OG 2.94Å; E410-V414 WeakPolarHBondContact O-CG2 3.4Å; E410-V414 PolarHBondContact O-N 3.41Å
411	A	95.2	Very high	96	Very high	40 Å²	40	92.7 Å²	92.7	33%	0.331	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-38.6	179.4	0	0	0	0	0	112.7	M407 A408 V414 R415	M407-A411 VanDerWaalsContact O-CB 3.23Å; M407-A411 WeakPolarHBondContact O-CB 3.46Å; M407-A411 PolarHBondContact O-N 3.48Å; A408-A411 PolarHBondContact O-N 2.99Å; A411-V414 PolarHBondContact O-N 3.12Å; A411-R415 WeakPolarHBondContact O-CB 3.23Å; A411-R415 VanDerWaalsContact O-CG 3.23Å; A411-R415 WeakPolarHBondContact O-CG 3.41Å; A411-R415 PolarHBondContact O-N 3.33Å
412	E	96.3	Very high	96.2	Very high	115 Å²	115	93.5 Å²	93.5	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-43.7	175.2	-172.3	60.9	-165.5	0	0	111.4	A408 A409 E410 V414 R415 E416	A408-E412 WeakPolarHBondContact O-CB 3.47Å; A408-E412 PolarHBondContact O-N 3.48Å; A409-E412 PolarHBondContact O-N 3.08Å; E410-E412 VanDerWaalsContact C-N 3.3Å; E410-E412 PolarHBondContact O-N 2.7Å; E412-V414 VanDerWaalsContact C-N 3.34Å; E412-V414 PolarHBondContact O-N 2.95Å; E412-R415 PolarHBondContact O-N 3.45Å; E412-E416 PolarHBondContact O-N 2.88Å
413	S	97.3	Very high	96.3	Very high	66 Å²	66	88.2 Å²	88.2	46%	0.462	49%	0.49	S	S	.	.	H	α-helix	trans	-63.1	-38.9	177.3	75.2	0	0	0	0	112.6	A409 E410 E416 A417	A409-S413 PolarHBondContact O-N 2.89Å; A409-S413 VanDerWaalsContact O-N 3.08Å; E410-S413 PolarHBondContact O-N 3.48Å; E410-S413 VanDerWaalsContact O-N 3.12Å; E410-S413 PolarHBondContact O-OG 2.94Å; S413-E416 PolarHBondContact O-N 2.81Å; S413-A417 WeakPolarHBondContact O-CB 3.24Å; S413-A417 PolarHBondContact O-N 2.67Å
414	V	96.4	Very high	96.5	Very high	78 Å²	78	87.9 Å²	87.9	47%	0.473	50%	0.496	S	S	.	.	H	α-helix	trans	-69	-40.6	177	172.8	0	0	0	0	110.7	E410 A411 E412 A417 T418	E410-V414 WeakPolarHBondContact O-CG2 3.4Å; E410-V414 PolarHBondContact O-N 3.41Å; A411-V414 PolarHBondContact O-N 3.12Å; E412-V414 VanDerWaalsContact C-N 3.34Å; E412-V414 PolarHBondContact O-N 2.95Å; V414-A417 PolarHBondContact O-N 3.05Å; V414-T418 HydrophobicContact CG1-CG2 4.28Å; V414-T418 WeakPolarHBondContact O-CB 3.37Å; V414-T418 VanDerWaalsContact O-CG2 3.24Å; V414-T418 WeakPolarHBondContact O-CG2 3.34Å; V414-T418 PolarHBondContact O-N 3.43Å; V414-T418 PolarHBondContact O-OG1 2.94Å
415	R	97.3	Very high	96.6	Very high	171 Å²	171	87.4 Å²	87.4	65%	0.645	49%	0.494	S	S	*	.	H	α-helix	trans	-63.2	-41.5	174.8	-76.5	173.2	178.5	176.1	0.4	112.1	A411 E412 T418 A419	A411-R415 WeakPolarHBondContact O-CB 3.23Å; A411-R415 VanDerWaalsContact O-CG 3.23Å; A411-R415 WeakPolarHBondContact O-CG 3.41Å; A411-R415 PolarHBondContact O-N 3.33Å; E412-R415 PolarHBondContact O-N 3.45Å; R415-T418 WeakPolarHBondContact CA-OG1 3.3Å; R415-T418 PolarHBondContact O-OG1 2.9Å; R415-A419 VanDerWaalsContact O-CB 3.3Å; R415-A419 WeakPolarHBondContact O-CB 3.35Å; R415-A419 PolarHBondContact O-N 3.27Å
416	E	97.9	Very high	96.7	Very high	101 Å²	101	80.1 Å²	80.1	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-67.1	-44.5	177	-166.5	-170.1	159.6	0	0	111.5	E412 S413 A419 K420	E412-E416 PolarHBondContact O-N 2.88Å; S413-E416 PolarHBondContact O-N 2.81Å; E416-A419 PolarHBondContact O-N 2.97Å; E416-K420 WeakPolarHBondContact O-CG 3.42Å; E416-K420 PolarHBondContact O-N 2.96Å; E416-K420 VanDerWaalsContact OE1-CE 3.26Å; E416-K420 WeakPolarHBondContact OE1-CE 3.26Å; E416-K420 IonicContact OE1-NZ 3.32Å; E416-K420 PolarHBondContact OE1-NZ 2.96Å
417	A	97.4	Very high	96.8	Very high	53 Å²	53	84 Å²	84	44%	0.438	48%	0.482	S	S	.	.	H	α-helix	trans	-62.5	-45.7	177.5	0	0	0	0	0	111.9	S413 V414 A419 K420 V421	S413-A417 WeakPolarHBondContact O-CB 3.24Å; S413-A417 PolarHBondContact O-N 2.67Å; V414-A417 PolarHBondContact O-N 3.05Å; A417-A419 PolarHBondContact O-N 3.23Å; A417-K420 PolarHBondContact O-N 3.46Å; A417-V421 WeakPolarHBondContact O-CG2 3.25Å; A417-V421 PolarHBondContact O-N 3.3Å
418	T	96.6	Very high	96.9	Very high	71 Å²	71	86.8 Å²	86.8	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-63.5	-39.9	177	51.4	0	0	0	0	111.8	V414 R415 K420 V421 I422	V414-T418 HydrophobicContact CG1-CG2 4.28Å; V414-T418 WeakPolarHBondContact O-CB 3.37Å; V414-T418 VanDerWaalsContact O-CG2 3.24Å; V414-T418 WeakPolarHBondContact O-CG2 3.34Å; V414-T418 PolarHBondContact O-N 3.43Å; V414-T418 PolarHBondContact O-OG1 2.94Å; R415-T418 WeakPolarHBondContact CA-OG1 3.3Å; R415-T418 PolarHBondContact O-OG1 2.9Å; T418-K420 VanDerWaalsContact C-N 3.34Å; T418-K420 PolarHBondContact O-N 3.49Å; T418-V421 PolarHBondContact O-N 2.92Å; T418-I422 WeakPolarHBondContact O-CB 3.48Å; T418-I422 VanDerWaalsContact O-CG1 3.25Å; T418-I422 WeakPolarHBondContact O-CG1 3.41Å; T418-I422 PolarHBondContact O-N 3.48Å
419	A	97.9	Very high	96.9	Very high	58 Å²	58	90.7 Å²	90.7	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-41.6	173.9	0	0	0	0	0	112.4	R415 E416 A417 I422 A423	R415-A419 VanDerWaalsContact O-CB 3.3Å; R415-A419 WeakPolarHBondContact O-CB 3.35Å; R415-A419 PolarHBondContact O-N 3.27Å; E416-A419 PolarHBondContact O-N 2.97Å; A417-A419 PolarHBondContact O-N 3.23Å; A419-I422 PolarHBondContact O-N 3.44Å; A419-A423 WeakPolarHBondContact O-CB 3.45Å; A419-A423 PolarHBondContact O-N 3.38Å
420	K	97.5	Very high	96.9	Very high	130 Å²	130	90 Å²	90	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-65	-41.8	175.7	-72.2	174	-175.1	166.1	0	112.5	E416 A417 T418 A423 A424	E416-K420 WeakPolarHBondContact O-CG 3.42Å; E416-K420 PolarHBondContact O-N 2.96Å; E416-K420 VanDerWaalsContact OE1-CE 3.26Å; E416-K420 WeakPolarHBondContact OE1-CE 3.26Å; E416-K420 IonicContact OE1-NZ 3.32Å; E416-K420 PolarHBondContact OE1-NZ 2.96Å; A417-K420 PolarHBondContact O-N 3.46Å; T418-K420 VanDerWaalsContact C-N 3.34Å; T418-K420 PolarHBondContact O-N 3.49Å; K420-A423 PolarHBondContact O-N 3Å; K420-A424 PolarHBondContact O-N 2.98Å
421	V	97.8	Very high	97	Very high	92 Å²	92	87.6 Å²	87.6	56%	0.558	49%	0.49	S	S	*	.	H	α-helix	trans	-63.6	-45.4	176.3	173	0	0	0	0	110.8	A417 T418 A423 A424 E425	A417-V421 WeakPolarHBondContact O-CG2 3.25Å; A417-V421 PolarHBondContact O-N 3.3Å; T418-V421 PolarHBondContact O-N 2.92Å; V421-A423 VanDerWaalsContact C-N 3.29Å; V421-A423 PolarHBondContact O-N 2.87Å; V421-A424 PolarHBondContact O-N 3.39Å; V421-E425 WeakPolarHBondContact O-CB 3.42Å; V421-E425 PolarHBondContact O-N 3.35Å
422	I	97.4	Very high	97	Very high	109 Å²	109	87.7 Å²	87.7	56%	0.559	49%	0.494	S	S	*	.	H	α-helix	trans	-62.5	-38.2	177.7	-68	165.8	0	0	0	111	T418 A419 G426	T418-I422 WeakPolarHBondContact O-CB 3.48Å; T418-I422 VanDerWaalsContact O-CG1 3.25Å; T418-I422 WeakPolarHBondContact O-CG1 3.41Å; T418-I422 PolarHBondContact O-N 3.48Å; A419-I422 PolarHBondContact O-N 3.44Å; I422-G426 PolarHBondContact O-N 2.76Å
423	A	97.2	Very high	97	Very high	55 Å²	55	85.2 Å²	85.2	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-48.7	175.5	0	0	0	0	0	111.8	A419 K420 V421 E425 G426 E427	A419-A423 WeakPolarHBondContact O-CB 3.45Å; A419-A423 PolarHBondContact O-N 3.38Å; K420-A423 PolarHBondContact O-N 3Å; V421-A423 VanDerWaalsContact C-N 3.29Å; V421-A423 PolarHBondContact O-N 2.87Å; A423-E425 PolarHBondContact O-N 3.19Å; A423-G426 CarbonylContact O-C 3.33Å; A423-G426 WeakPolarHBondContact O-CA 3.47Å; A423-G426 PolarHBondContact O-N 3Å; A423-E427 WeakPolarHBondContact O-CG 3.48Å; A423-E427 PolarHBondContact O-N 3.29Å
424	A	97.1	Very high	96.8	Very high	56 Å²	56	87.3 Å²	87.3	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-41	177.9	0	0	0	0	0	112.3	K420 V421 G426 E427 M428	K420-A424 PolarHBondContact O-N 2.98Å; V421-A424 PolarHBondContact O-N 3.39Å; A424-G426 VanDerWaalsContact C-N 3.33Å; A424-E427 PolarHBondContact O-N 3.41Å; A424-M428 PolarHBondContact O-N 2.8Å
425	E	97	Very high	96.8	Very high	87 Å²	87	91.1 Å²	91.1	41%	0.407	51%	0.509	S	S	.	.	H	α-helix	trans	-66.8	-37.3	174.8	-161.9	-165.3	132.1	0	0	111.5	V421 A423 M428 R429	V421-E425 WeakPolarHBondContact O-CB 3.42Å; V421-E425 PolarHBondContact O-N 3.35Å; A423-E425 PolarHBondContact O-N 3.19Å; E425-M428 PolarHBondContact O-N 3.44Å; E425-R429 VanDerWaalsContact CD-NH2 3.28Å; E425-R429 WeakPolarHBondContact O-CB 3.49Å; E425-R429 WeakPolarHBondContact O-CG 3.26Å; E425-R429 PolarHBondContact O-N 2.72Å; E425-R429 IonicContact OE1-CZ 3Å; E425-R429 VanDerWaalsContact OE1-CZ 3.32Å; E425-R429 IonicContact OE1-NE 3.86Å; E425-R429 PolarHBondContact OE1-NE 2.86Å; E425-R429 IonicContact OE1-NH2 3.98Å; E425-R429 PolarHBondContact OE1-NH2 2.84Å; E425-R429 IonicContact OE2-NH2 2.76Å
426	G	97.9	Very high	96.7	Very high	25 Å²	25	86 Å²	86	26%	0.258	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-45.1	171	0	0	0	0	0	112.4	I422 A423 A424 R429 A430	I422-G426 PolarHBondContact O-N 2.76Å; A423-G426 CarbonylContact O-C 3.33Å; A423-G426 WeakPolarHBondContact O-CA 3.47Å; A423-G426 PolarHBondContact O-N 3Å; A424-G426 VanDerWaalsContact C-N 3.33Å; G426-R429 PolarHBondContact O-N 3.29Å; G426-A430 VanDerWaalsContact O-CB 3.27Å; G426-A430 WeakPolarHBondContact O-CB 3.27Å; G426-A430 PolarHBondContact O-N 2.84Å
427	E	96.5	Very high	96.4	Very high	136 Å²	136	83.3 Å²	83.3	64%	0.636	50%	0.499	S	S	*	.	H	α-helix	trans	-64.3	-40	175.2	-75	-178.4	175.2	0	0	112.2	A423 A424 A430 S431	A423-E427 WeakPolarHBondContact O-CG 3.48Å; A423-E427 PolarHBondContact O-N 3.29Å; A424-E427 PolarHBondContact O-N 3.41Å; E427-A430 PolarHBondContact O-N 2.91Å; E427-S431 VanDerWaalsContact O-CB 3.26Å; E427-S431 WeakPolarHBondContact O-CB 3.45Å; E427-S431 PolarHBondContact O-N 3.35Å; E427-S431 PolarHBondContact O-OG 2.91Å
428	M	97	Very high	96.2	Very high	131 Å²	131	83.4 Å²	83.4	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-62.9	-47.8	174.9	-172.6	-177.4	81.3	0	0	111.3	A424 E425 S431 G432	A424-M428 PolarHBondContact O-N 2.8Å; E425-M428 PolarHBondContact O-N 3.44Å; M428-S431 PolarHBondContact O-N 3.07Å; M428-G432 PolarHBondContact O-N 3.45Å
429	R	95.9	Very high	96.1	Very high	141 Å²	141	83.8 Å²	83.8	53%	0.532	50%	0.502	S	S	.	.	H	α-helix	trans	-62.3	-42.9	176.6	-75.4	-169.6	-106.1	106.8	-5.8	111.6	E425 G426 G432 A433	E425-R429 VanDerWaalsContact CD-NH2 3.28Å; E425-R429 WeakPolarHBondContact O-CB 3.49Å; E425-R429 WeakPolarHBondContact O-CG 3.26Å; E425-R429 PolarHBondContact O-N 2.72Å; E425-R429 IonicContact OE1-CZ 3Å; E425-R429 VanDerWaalsContact OE1-CZ 3.32Å; E425-R429 IonicContact OE1-NE 3.86Å; E425-R429 PolarHBondContact OE1-NE 2.86Å; E425-R429 IonicContact OE1-NH2 3.98Å; E425-R429 PolarHBondContact OE1-NH2 2.84Å; E425-R429 IonicContact OE2-NH2 2.76Å; G426-R429 PolarHBondContact O-N 3.29Å; R429-G432 PolarHBondContact O-N 3.34Å; R429-A433 PolarHBondContact O-N 3.25Å
430	A	96.5	Very high	95.7	Very high	51 Å²	51	86 Å²	86	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-42.8	174.7	0	0	0	0	0	111.5	G426 E427 G432 A433 L434	G426-A430 VanDerWaalsContact O-CB 3.27Å; G426-A430 WeakPolarHBondContact O-CB 3.27Å; G426-A430 PolarHBondContact O-N 2.84Å; E427-A430 PolarHBondContact O-N 2.91Å; A430-G432 VanDerWaalsContact C-N 3.34Å; A430-G432 PolarHBondContact O-N 2.93Å; A430-A433 PolarHBondContact O-N 2.85Å; A430-L434 WeakPolarHBondContact O-CB 3.42Å; A430-L434 VanDerWaalsContact O-CG 3.25Å; A430-L434 WeakPolarHBondContact O-CG 3.45Å; A430-L434 PolarHBondContact O-N 3.27Å
431	S	96.1	Very high	95.5	Very high	73 Å²	73	81.7 Å²	81.7	51%	0.51	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-39.7	177	-61.3	0	0	0	0	112	E427 M428 L434 K435	E427-S431 VanDerWaalsContact O-CB 3.26Å; E427-S431 WeakPolarHBondContact O-CB 3.45Å; E427-S431 PolarHBondContact O-N 3.35Å; E427-S431 PolarHBondContact O-OG 2.91Å; M428-S431 PolarHBondContact O-N 3.07Å; S431-L434 PolarHBondContact O-N 3.46Å; S431-K435 WeakPolarHBondContact O-CB 3.25Å; S431-K435 PolarHBondContact O-N 3.29Å
432	G	96.7	Very high	95.2	Very high	42 Å²	42	85.9 Å²	85.9	43%	0.433	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-47.1	173.1	0	0	0	0	0	112.7	M428 R429 A430 L434 K435 A436	M428-G432 PolarHBondContact O-N 3.45Å; R429-G432 PolarHBondContact O-N 3.34Å; A430-G432 VanDerWaalsContact C-N 3.34Å; A430-G432 PolarHBondContact O-N 2.93Å; G432-L434 PolarHBondContact O-N 3.26Å; G432-K435 WeakPolarHBondContact O-CB 3.5Å; G432-K435 PolarHBondContact O-N 2.82Å; G432-A436 PolarHBondContact O-N 3.42Å
433	A	95.6	Very high	94.9	Very high	63 Å²	63	86.5 Å²	86.5	52%	0.521	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-40.1	175.8	0	0	0	0	0	112.3	R429 A430 A436 A437	R429-A433 PolarHBondContact O-N 3.25Å; A430-A433 PolarHBondContact O-N 2.85Å; A433-A436 PolarHBondContact O-N 3.38Å; A433-A437 WeakPolarHBondContact O-CB 3.27Å; A433-A437 PolarHBondContact O-N 3.38Å
434	L	94.2	Very high	94.7	Very high	111 Å²	111	88.9 Å²	88.9	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-64.4	-39.1	175.2	-72.8	172.2	0	0	0	112	A430 S431 G432 A437 A438	A430-L434 WeakPolarHBondContact O-CB 3.42Å; A430-L434 VanDerWaalsContact O-CG 3.25Å; A430-L434 WeakPolarHBondContact O-CG 3.45Å; A430-L434 PolarHBondContact O-N 3.27Å; S431-L434 PolarHBondContact O-N 3.46Å; G432-L434 PolarHBondContact O-N 3.26Å; L434-A437 PolarHBondContact O-N 3.15Å; L434-A438 VanDerWaalsContact O-CB 3.27Å; L434-A438 WeakPolarHBondContact O-CB 3.44Å; L434-A438 PolarHBondContact O-N 2.87Å
435	K	95.8	Very high	94.2	Very high	157 Å²	157	91.1 Å²	91.1	68%	0.683	51%	0.507	S	S	*	.	H	α-helix	trans	-61.6	-46.6	173.8	-180	-177	176	-177.3	0	111.1	S431 G432 A438 V439	S431-K435 WeakPolarHBondContact O-CB 3.25Å; S431-K435 PolarHBondContact O-N 3.29Å; G432-K435 WeakPolarHBondContact O-CB 3.5Å; G432-K435 PolarHBondContact O-N 2.82Å; K435-A438 PolarHBondContact O-N 3.34Å; K435-V439 WeakPolarHBondContact O-CG2 3.27Å; K435-V439 PolarHBondContact O-N 3.49Å
436	A	94.1	Very high	93.9	Very high	64 Å²	64	93.2 Å²	93.2	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-45.8	176.9	0	0	0	0	0	111.6	G432 A433 A438 V439 E440	G432-A436 PolarHBondContact O-N 3.42Å; A433-A436 PolarHBondContact O-N 3.38Å; A436-A438 VanDerWaalsContact C-N 3.32Å; A436-A438 PolarHBondContact O-N 3.04Å; A436-V439 PolarHBondContact O-N 3Å; A436-E440 PolarHBondContact O-N 3.44Å; A436-E440 VanDerWaalsContact O-N 3.12Å
437	A	92.1	Very high	93.6	Very high	44 Å²	44	93.5 Å²	93.5	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-38.9	174.9	0	0	0	0	0	112.3	A433 L434 E440 I441	A433-A437 WeakPolarHBondContact O-CB 3.27Å; A433-A437 PolarHBondContact O-N 3.38Å; L434-A437 PolarHBondContact O-N 3.15Å; A437-E440 PolarHBondContact O-N 3.5Å; A437-I441 VanDerWaalsContact O-CB 3.31Å; A437-I441 WeakPolarHBondContact O-CB 3.48Å; A437-I441 WeakPolarHBondContact O-CD1 3.45Å; A437-I441 WeakPolarHBondContact O-CG1 3.24Å; A437-I441 PolarHBondContact O-N 2.92Å
438	A	92.7	Very high	93.3	Very high	56 Å²	56	92.1 Å²	92.1	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-36.7	177	0	0	0	0	0	112.4	L434 K435 A436 K442	L434-A438 VanDerWaalsContact O-CB 3.27Å; L434-A438 WeakPolarHBondContact O-CB 3.44Å; L434-A438 PolarHBondContact O-N 2.87Å; K435-A438 PolarHBondContact O-N 3.34Å; A436-A438 VanDerWaalsContact C-N 3.32Å; A436-A438 PolarHBondContact O-N 3.04Å; A438-K442 VanDerWaalsContact O-CB 3.27Å; A438-K442 WeakPolarHBondContact O-CB 3.4Å; A438-K442 PolarHBondContact O-N 3.39Å
439	V	94.2	Very high	92.8	Very high	78 Å²	78	91.3 Å²	91.3	47%	0.473	51%	0.51	S	S	.	.	H	α-helix	trans	-64	-45.3	174.6	171.3	0	0	0	0	110.8	K435 A436 K442 Q443	K435-V439 WeakPolarHBondContact O-CG2 3.27Å; K435-V439 PolarHBondContact O-N 3.49Å; A436-V439 PolarHBondContact O-N 3Å; V439-K442 WeakPolarHBondContact O-CB 3.18Å; V439-K442 PolarHBondContact O-N 3.49Å; V439-Q443 PolarHBondContact O-N 3.43Å
440	E	91.5	Very high	92.7	Very high	105 Å²	105	89.9 Å²	89.9	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-47.2	176.1	-173.6	63.9	-156.2	0	0	111.6	A436 A437 K442 Q443 H444	A436-E440 PolarHBondContact O-N 3.44Å; A436-E440 VanDerWaalsContact O-N 3.12Å; A437-E440 PolarHBondContact O-N 3.5Å; E440-K442 VanDerWaalsContact C-N 3.28Å; E440-K442 PolarHBondContact O-N 3.01Å; E440-Q443 WeakPolarHBondContact O-CB 3.31Å; E440-Q443 PolarHBondContact O-N 2.76Å; E440-Q443 VanDerWaalsContact O-N 3.1Å; E440-H444 PolarHBondContact O-N 3.39Å; E440-H444 IonicContact OE1-CD2 3.89Å; E440-H444 IonicContact OE1-NE2 2.69Å
441	I	91.9	Very high	92.4	Very high	40 Å²	40	93.4 Å²	93.4	21%	0.205	51%	0.514	C	S	.	.	H	α-helix	trans	-63	-34.8	178.2	-72.1	167.4	0	0	0	111.4	A437 Q443 H444 A447 M448	A437-I441 VanDerWaalsContact O-CB 3.31Å; A437-I441 WeakPolarHBondContact O-CB 3.48Å; A437-I441 WeakPolarHBondContact O-CD1 3.45Å; A437-I441 WeakPolarHBondContact O-CG1 3.24Å; A437-I441 PolarHBondContact O-N 2.92Å; I441-Q443 VanDerWaalsContact C-N 3.27Å; I441-Q443 PolarHBondContact O-N 3.24Å; I441-H444 CarbonylContact O-C 3.29Å; I441-H444 PolarHBondContact O-N 2.89Å; I441-H444 VanDerWaalsContact O-N 3.12Å; I441-A447 HydrophobicContact CG1-CB 4.33Å; I441-A447 HydrophobicContact CG2-CB 4.32Å; I441-M448 HydrophobicContact CG2-CB 4.13Å; I441-M448 HydrophobicContact CG2-CG 3.32Å; I441-M448 HydrophobicContact CG2-SD 3.25Å; I441-M448 WeakPolarHBondContact CG2-SD 3.42Å
442	K	91.1	Very high	92	Very high	179 Å²	179	93.8 Å²	93.8	78%	0.778	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-33	175.8	-177.3	-177.9	176.6	-175	0	112	A438 V439 E440 H444	A438-K442 VanDerWaalsContact O-CB 3.27Å; A438-K442 WeakPolarHBondContact O-CB 3.4Å; A438-K442 PolarHBondContact O-N 3.39Å; V439-K442 WeakPolarHBondContact O-CB 3.18Å; V439-K442 PolarHBondContact O-N 3.49Å; E440-K442 VanDerWaalsContact C-N 3.28Å; E440-K442 PolarHBondContact O-N 3.01Å; K442-H444 VanDerWaalsContact C-N 3.26Å; K442-H444 PolarHBondContact O-N 3.06Å
443	Q	92.3	Very high	91.7	Very high	122 Å²	122	96.3 Å²	96.3	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-69	-27.2	175.7	-63.3	175	13.8	0	0	112	V439 E440 I441	V439-Q443 PolarHBondContact O-N 3.43Å; E440-Q443 WeakPolarHBondContact O-CB 3.31Å; E440-Q443 PolarHBondContact O-N 2.76Å; E440-Q443 VanDerWaalsContact O-N 3.1Å; I441-Q443 VanDerWaalsContact C-N 3.27Å; I441-Q443 PolarHBondContact O-N 3.24Å
444	H	92.8	Very high	91.4	Very high	105 Å²	105	99 Å²	99	49%	0.486	51%	0.51	S	S	.	.			trans	-119.5	90.4	-179	-66.2	-57.8	0	0	0	111.9	E440 I441 K442 I446 A447	E440-H444 PolarHBondContact O-N 3.39Å; E440-H444 IonicContact OE1-CD2 3.89Å; E440-H444 IonicContact OE1-NE2 2.69Å; I441-H444 CarbonylContact O-C 3.29Å; I441-H444 PolarHBondContact O-N 2.89Å; I441-H444 VanDerWaalsContact O-N 3.12Å; K442-H444 VanDerWaalsContact C-N 3.26Å; K442-H444 PolarHBondContact O-N 3.06Å; H444-I446 PolarHBondContact O-N 2.88Å; H444-A447 HydrophobicContact CB-CB 4.06Å; H444-A447 WeakPolarHBondContact O-CA 3.38Å; H444-A447 VanDerWaalsContact O-CB 3.24Å; H444-A447 WeakPolarHBondContact O-CB 3.47Å; H444-A447 PolarHBondContact O-N 3.24Å
445	P	86.3	Confident	91.1	Very high	103 Å²	103	96.3 Å²	96.3	67%	0.669	50%	0.498	S	S	*	.	H	α-helix	trans	-59.4	-26.7	-176.1	22.6	-33.7	0	0	0	113.9	A447 M448 Q449	P445-A447 VanDerWaalsContact C-N 3.3Å; P445-A447 PolarHBondContact O-N 3.41Å; P445-M448 WeakPolarHBondContact O-CB 3.45Å; P445-M448 PolarHBondContact O-N 2.98Å; P445-Q449 PolarHBondContact O-N 3.12Å
446	I	91.7	Very high	90.6	Very high	132 Å²	132	90.1 Å²	90.1	68%	0.677	47%	0.473	S	S	*	.	H	α-helix	trans	-64.2	-34.4	173.3	-65	170.3	0	0	0	111.4	H444 M448 Q449 L450	H444-I446 PolarHBondContact O-N 2.88Å; I446-M448 VanDerWaalsContact C-N 3.33Å; I446-M448 PolarHBondContact O-N 3.24Å; I446-Q449 WeakPolarHBondContact O-CB 3.35Å; I446-Q449 PolarHBondContact O-N 3.04Å; I446-L450 HydrophobicContact CG2-CD1 4.39Å; I446-L450 HydrophobicContact CG2-CG 4.47Å; I446-L450 WeakPolarHBondContact O-CG 3.39Å; I446-L450 PolarHBondContact O-N 2.89Å
447	A	90.5	Very high	90.2	Very high	31 Å²	31	92.6 Å²	92.6	26%	0.256	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-36.3	177.3	0	0	0	0	0	111.9	I441 H444 P445 Q449 L450 R451	I441-A447 HydrophobicContact CG1-CB 4.33Å; I441-A447 HydrophobicContact CG2-CB 4.32Å; H444-A447 HydrophobicContact CB-CB 4.06Å; H444-A447 WeakPolarHBondContact O-CA 3.38Å; H444-A447 VanDerWaalsContact O-CB 3.24Å; H444-A447 WeakPolarHBondContact O-CB 3.47Å; H444-A447 PolarHBondContact O-N 3.24Å; P445-A447 VanDerWaalsContact C-N 3.3Å; P445-A447 PolarHBondContact O-N 3.41Å; A447-Q449 VanDerWaalsContact C-N 3.33Å; A447-Q449 PolarHBondContact O-N 2.89Å; A447-L450 PolarHBondContact O-N 3.39Å; A447-R451 WeakPolarHBondContact O-CB 3.25Å; A447-R451 PolarHBondContact O-N 3.48Å
448	M	90.1	Very high	89.8	Confident	107 Å²	107	93.8 Å²	93.8	53%	0.527	48%	0.484	S	S	.	.	H	α-helix	trans	-59	-44.7	171.3	-87.3	-56.2	-64.2	0	0	111.5	I441 P445 I446 R451 Y452	I441-M448 HydrophobicContact CG2-CB 4.13Å; I441-M448 HydrophobicContact CG2-CG 3.32Å; I441-M448 HydrophobicContact CG2-SD 3.25Å; I441-M448 WeakPolarHBondContact CG2-SD 3.42Å; P445-M448 WeakPolarHBondContact O-CB 3.45Å; P445-M448 PolarHBondContact O-N 2.98Å; I446-M448 VanDerWaalsContact C-N 3.33Å; I446-M448 PolarHBondContact O-N 3.24Å; M448-R451 PolarHBondContact O-N 2.88Å; M448-Y452 WeakPolarHBondContact O-CB 3.34Å; M448-Y452 PolarHBondContact O-N 3.37Å
449	Q	87.9	Confident	89.4	Confident	114 Å²	114	94.3 Å²	94.3	53%	0.533	48%	0.478	S	S	.	.	H	α-helix	trans	-64.9	-42.8	179.5	-164.3	70	11.1	0	0	111.5	P445 I446 A447 Y452 L453	P445-Q449 PolarHBondContact O-N 3.12Å; I446-Q449 WeakPolarHBondContact O-CB 3.35Å; I446-Q449 PolarHBondContact O-N 3.04Å; A447-Q449 VanDerWaalsContact C-N 3.33Å; A447-Q449 PolarHBondContact O-N 2.89Å; Q449-Y452 WeakPolarHBondContact O-CB 3.24Å; Q449-Y452 PolarHBondContact O-N 3.22Å; Q449-L453 WeakPolarHBondContact O-CG 3.49Å; Q449-L453 PolarHBondContact O-N 3.32Å
450	L	92.7	Very high	88.6	Confident	111 Å²	111	94.2 Å²	94.2	58%	0.581	48%	0.48	S	S	*	.	H	α-helix	trans	-62.2	-42.5	174.4	-68	176.4	0	0	0	111.5	I446 A447 Y452 L453 Q454	I446-L450 HydrophobicContact CG2-CD1 4.39Å; I446-L450 HydrophobicContact CG2-CG 4.47Å; I446-L450 WeakPolarHBondContact O-CG 3.39Å; I446-L450 PolarHBondContact O-N 2.89Å; A447-L450 PolarHBondContact O-N 3.39Å; L450-Y452 VanDerWaalsContact C-N 3.33Å; L450-Y452 PolarHBondContact O-N 3.45Å; L450-L453 PolarHBondContact O-N 3.39Å; L450-Q454 WeakPolarHBondContact O-CB 3.4Å; L450-Q454 PolarHBondContact O-N 2.91Å
451	R	89.6	Confident	88	Confident	125 Å²	125	94 Å²	94	47%	0.472	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-40.2	175.5	-179.2	60.4	176.7	-179.4	0.1	111.8	A447 M448 Q454 T455	A447-R451 WeakPolarHBondContact O-CB 3.25Å; A447-R451 PolarHBondContact O-N 3.48Å; M448-R451 PolarHBondContact O-N 2.88Å; R451-Q454 PolarHBondContact O-N 2.95Å; R451-T455 WeakPolarHBondContact O-CB 3.48Å; R451-T455 PolarHBondContact O-N 3.11Å; R451-T455 PolarHBondContact O-OG1 3.29Å
452	Y	87.8	Confident	87.4	Confident	80 Å²	80	93.9 Å²	93.9	31%	0.314	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-50.8	175	-178.1	-103	0	0	0	111.3	M448 Q449 L450 Q454 T455 V456 F469	M448-Y452 WeakPolarHBondContact O-CB 3.34Å; M448-Y452 PolarHBondContact O-N 3.37Å; Q449-Y452 WeakPolarHBondContact O-CB 3.24Å; Q449-Y452 PolarHBondContact O-N 3.22Å; L450-Y452 VanDerWaalsContact C-N 3.33Å; L450-Y452 PolarHBondContact O-N 3.45Å; Y452-Q454 VanDerWaalsContact C-N 3.33Å; Y452-Q454 PolarHBondContact O-N 2.92Å; Y452-T455 WeakPolarHBondContact O-CB 3.28Å; Y452-T455 PolarHBondContact O-N 2.74Å; Y452-T455 VanDerWaalsContact O-N 3.11Å; Y452-V456 HydrophobicContact CD1-CG2 4.28Å; Y452-V456 HydrophobicContact CE1-CG2 4.02Å; Y452-V456 WeakPolarHBondContact O-CG2 3.35Å; Y452-V456 PolarHBondContact O-N 3.48Å; Y452-F469 HydrophobicContact CE1-CD1 4.37Å; Y452-F469 WeakPolarHBondContact OH-CD1 3.49Å
453	L	90.6	Very high	86.8	Confident	96 Å²	96	95.6 Å²	95.6	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-38.2	177.4	-67.6	178.9	0	0	0	112.6	Q449 L450 T455 V456 N457	Q449-L453 WeakPolarHBondContact O-CG 3.49Å; Q449-L453 PolarHBondContact O-N 3.32Å; L450-L453 PolarHBondContact O-N 3.39Å; L453-T455 VanDerWaalsContact C-N 3.33Å; L453-V456 PolarHBondContact O-N 3.49Å; L453-N457 WeakPolarHBondContact O-CB 3.43Å; L453-N457 PolarHBondContact O-N 2.87Å
454	Q	89.4	Confident	85.9	Confident	119 Å²	119	96.1 Å²	96.1	56%	0.556	51%	0.509	S	S	*	.	H	α-helix	trans	-63.1	-41.5	173.9	-172.5	-175.3	-0.4	0	0	111.3	L450 R451 Y452 N457 S458	L450-Q454 WeakPolarHBondContact O-CB 3.4Å; L450-Q454 PolarHBondContact O-N 2.91Å; R451-Q454 PolarHBondContact O-N 2.95Å; Y452-Q454 VanDerWaalsContact C-N 3.33Å; Y452-Q454 PolarHBondContact O-N 2.92Å; Q454-N457 PolarHBondContact O-N 3.3Å; Q454-S458 PolarHBondContact O-N 3.38Å; Q454-S458 PolarHBondContact O-OG 3.38Å
455	T	87.7	Confident	84.9	Confident	54 Å²	54	96.8 Å²	96.8	33%	0.331	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-42.6	177.1	-54.6	0	0	0	0	110.7	R451 Y452 L453 N457 S458 I459	R451-T455 WeakPolarHBondContact O-CB 3.48Å; R451-T455 PolarHBondContact O-N 3.11Å; R451-T455 PolarHBondContact O-OG1 3.29Å; Y452-T455 WeakPolarHBondContact O-CB 3.28Å; Y452-T455 PolarHBondContact O-N 2.74Å; Y452-T455 VanDerWaalsContact O-N 3.11Å; L453-T455 VanDerWaalsContact C-N 3.33Å; T455-N457 VanDerWaalsContact C-N 3.34Å; T455-N457 PolarHBondContact O-N 3.4Å; T455-S458 WeakPolarHBondContact CA-OG 3.47Å; T455-S458 PolarHBondContact O-N 2.86Å; T455-S458 PolarHBondContact O-OG 3.48Å; T455-I459 HydrophobicContact CG2-CD1 3.9Å; T455-I459 HydrophobicContact CG2-CG1 4.48Å; T455-I459 VanDerWaalsContact O-CG1 3.24Å; T455-I459 WeakPolarHBondContact O-CG1 3.4Å; T455-I459 PolarHBondContact O-N 3.33Å
456	V	85.6	Confident	84.6	Confident	27 Å²	27	97 Å²	97	16%	0.164	53%	0.525	C	S	.	.	H	α-helix	trans	-59.3	-44.9	173.7	171.1	0	0	0	0	111	Y452 L453 S458 I459 S460 F469	Y452-V456 HydrophobicContact CD1-CG2 4.28Å; Y452-V456 HydrophobicContact CE1-CG2 4.02Å; Y452-V456 WeakPolarHBondContact O-CG2 3.35Å; Y452-V456 PolarHBondContact O-N 3.48Å; L453-V456 PolarHBondContact O-N 3.49Å; V456-S458 PolarHBondContact O-N 2.86Å; V456-I459 PolarHBondContact O-N 3.34Å; V456-S460 WeakPolarHBondContact O-CB 3.33Å; V456-S460 PolarHBondContact O-N 3.1Å; V456-F469 HydrophobicContact CG1-CE1 3.9Å; V456-F469 HydrophobicContact CG1-CZ 3.78Å; V456-F469 HydrophobicContact CG2-CE1 3.75Å; V456-F469 HydrophobicContact CG2-CZ 4.38Å
457	N	84.8	Confident	84	Confident	117 Å²	117	93.2 Å²	93.2	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-63.2	-40.7	176.7	-171.3	44.3	0	0	0	112.2	L453 Q454 T455 I459 S460 S461	L453-N457 WeakPolarHBondContact O-CB 3.43Å; L453-N457 PolarHBondContact O-N 2.87Å; Q454-N457 PolarHBondContact O-N 3.3Å; T455-N457 VanDerWaalsContact C-N 3.34Å; T455-N457 PolarHBondContact O-N 3.4Å; N457-I459 VanDerWaalsContact C-N 3.33Å; N457-I459 PolarHBondContact O-N 3.12Å; N457-S460 PolarHBondContact O-N 3.33Å; N457-S461 PolarHBondContact O-N 3.43Å
458	S	84.5	Confident	83.6	Confident	69 Å²	69	99 Å²	99	48%	0.483	53%	0.531	S	S	.	.	H	α-helix	trans	-69.1	-28.7	175.8	64.6	0	0	0	0	113.7	Q454 T455 V456 S461	Q454-S458 PolarHBondContact O-N 3.38Å; Q454-S458 PolarHBondContact O-OG 3.38Å; T455-S458 WeakPolarHBondContact CA-OG 3.47Å; T455-S458 PolarHBondContact O-N 2.86Å; T455-S458 PolarHBondContact O-OG 3.48Å; V456-S458 PolarHBondContact O-N 2.86Å; S458-S461 PolarHBondContact O-OG 3.34Å
459	I	83.5	Confident	83	Confident	66 Å²	66	98.1 Å²	98.1	34%	0.338	52%	0.524	S	S	.	.	H	α-helix	trans	-74.2	-42	174.3	-68.5	164	0	0	0	109.7	T455 V456 N457 S461 G462 I467	T455-I459 HydrophobicContact CG2-CD1 3.9Å; T455-I459 HydrophobicContact CG2-CG1 4.48Å; T455-I459 VanDerWaalsContact O-CG1 3.24Å; T455-I459 WeakPolarHBondContact O-CG1 3.4Å; T455-I459 PolarHBondContact O-N 3.33Å; V456-I459 PolarHBondContact O-N 3.34Å; N457-I459 VanDerWaalsContact C-N 3.33Å; N457-I459 PolarHBondContact O-N 3.12Å; I459-S461 VanDerWaalsContact C-N 3.29Å; I459-S461 PolarHBondContact O-N 3.39Å; I459-G462 WeakPolarHBondContact O-CA 3.46Å; I459-G462 PolarHBondContact O-N 3.35Å; I459-I467 HydrophobicContact CG2-CD1 4.34Å; I459-I467 HydrophobicContact CG2-CG1 4.03Å
460	S	78.1	Confident	82.5	Confident	76 Å²	76	97.4 Å²	97.4	53%	0.531	53%	0.53	S	S	.	.	H	α-helix	trans	-63.7	-31.5	178.3	-174.6	0	0	0	0	113	V456 N457 G462	V456-S460 WeakPolarHBondContact O-CB 3.33Å; V456-S460 PolarHBondContact O-N 3.1Å; N457-S460 PolarHBondContact O-N 3.33Å; S460-G462 PolarHBondContact O-N 3.01Å
461	S	78.6	Confident	81.6	Confident	102 Å²	102	96.9 Å²	96.9	71%	0.713	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-13.9	172.7	69.1	0	0	0	0	114	N457 S458 I459	N457-S461 PolarHBondContact O-N 3.43Å; S458-S461 PolarHBondContact O-OG 3.34Å; I459-S461 VanDerWaalsContact C-N 3.29Å; I459-S461 PolarHBondContact O-N 3.39Å
462	G	80.5	Confident	80.5	Confident	36 Å²	36	94.9 Å²	94.9	37%	0.371	53%	0.534	S	S	.	.	S	Bend	trans	-74.4	179.8	173.7	0	0	0	0	0	113.3	I459 S460 Q464	I459-G462 WeakPolarHBondContact O-CA 3.46Å; I459-G462 PolarHBondContact O-N 3.35Å; S460-G462 PolarHBondContact O-N 3.01Å; G462-Q464 VanDerWaalsContact C-N 3.28Å; G462-Q464 PolarHBondContact O-N 3.47Å
463	K	78.5	Confident	79.7	Confident	215 Å²	215	97.8 Å²	97.8	94%	0.935	55%	0.554	S	S	*	*	S	Bend	trans	-84.4	3.6	176.1	-69.7	179.3	179.9	176.9	0	113.3
464	Q	73	Confident	78.4	Confident	133 Å²	133	99 Å²	99	62%	0.621	56%	0.561	S	S	*	*			trans	-76.9	126.6	179.4	-80.3	90.2	-12	0	0	111.2	G462	G462-Q464 VanDerWaalsContact C-N 3.28Å; G462-Q464 PolarHBondContact O-N 3.47Å
465	S	71.2	Confident	76.9	Confident	120 Å²	120	96.2 Å²	96.2	84%	0.839	55%	0.549	S	S	*	.			trans	-90.2	-5.8	-179.7	59	0	0	0	0	114.6
466	T	81.5	Confident	75.6	Confident	107 Å²	107	97.1 Å²	97.1	66%	0.656	56%	0.555	S	S	*	*			trans	-132.4	113.7	-174	-54.3	0	0	0	0	109.6
467	I	78.2	Confident	74.4	Confident	53 Å²	53	99.1 Å²	99.1	27%	0.272	57%	0.57	S	S	.	*			trans	-104.6	117.8	175.9	-54.3	177.8	0	0	0	107.4	I459 F469	I459-I467 HydrophobicContact CG2-CD1 4.34Å; I459-I467 HydrophobicContact CG2-CG1 4.03Å; I467-F469 HydrophobicContact CB-CD2 4.39Å; I467-F469 HydrophobicContact CB-CE2 3.8Å; I467-F469 HydrophobicContact CB-CZ 4.31Å; I467-F469 HydrophobicContact CG2-CD2 3.98Å; I467-F469 HydrophobicContact CG2-CE1 4.25Å; I467-F469 HydrophobicContact CG2-CE2 3.46Å; I467-F469 VanDerWaalsContact CG2-CE2 3.46Å; I467-F469 HydrophobicContact CG2-CZ 3.61Å
468	I	81.2	Confident	73	Confident	151 Å²	151	98.9 Å²	98.9	77%	0.774	57%	0.568	S	S	*	*			trans	-89.9	112	177.5	-57.9	175.1	0	0	0	107.7	P470	I468-P470 VanDerWaalsContact O-CD 3.28Å; I468-P470 WeakPolarHBondContact O-CD 3.49Å
469	F	77.3	Confident	71.9	Confident	89 Å²	89	100.3 Å²	100.3	39%	0.39	57%	0.566	S	S	.	*			trans	-92.1	110.2	175.9	-71.4	-87.5	0	0	0	110.1	Y452 V456 I467 V471	Y452-F469 HydrophobicContact CE1-CD1 4.37Å; Y452-F469 WeakPolarHBondContact OH-CD1 3.49Å; V456-F469 HydrophobicContact CG1-CE1 3.9Å; V456-F469 HydrophobicContact CG1-CZ 3.78Å; V456-F469 HydrophobicContact CG2-CE1 3.75Å; V456-F469 HydrophobicContact CG2-CZ 4.38Å; I467-F469 HydrophobicContact CB-CD2 4.39Å; I467-F469 HydrophobicContact CB-CE2 3.8Å; I467-F469 HydrophobicContact CB-CZ 4.31Å; I467-F469 HydrophobicContact CG2-CD2 3.98Å; I467-F469 HydrophobicContact CG2-CE1 4.25Å; I467-F469 HydrophobicContact CG2-CE2 3.46Å; I467-F469 VanDerWaalsContact CG2-CE2 3.46Å; I467-F469 HydrophobicContact CG2-CZ 3.61Å; F469-V471 WeakPolarHBondContact O-CG2 3.49Å; F469-V471 PolarHBondContact O-N 3.16Å; F469-V471 VanDerWaalsContact O-N 3.16Å
470	P	78.3	Confident	70.7	Confident	100 Å²	100	105.3 Å²	105.3	65%	0.649	58%	0.581	S	S	*	*			trans	-69.8	111	167.9	28.4	-33	0	0	0	108.4	I468	I468-P470 VanDerWaalsContact O-CD 3.28Å; I468-P470 WeakPolarHBondContact O-CD 3.49Å
471	V	72.7	Confident	69.7	Low	100 Å²	100	104.2 Å²	104.2	61%	0.606	58%	0.576	S	S	*	*			trans	-103.1	123	172.6	-127.4	0	0	0	0	107.6	F469 L473 L475	F469-V471 WeakPolarHBondContact O-CG2 3.49Å; F469-V471 PolarHBondContact O-N 3.16Å; F469-V471 VanDerWaalsContact O-N 3.16Å; V471-L473 PolarHBondContact O-N 3.01Å; V471-L475 HydrophobicContact CB-CD1 4.21Å; V471-L475 HydrophobicContact CG1-CD1 3.26Å; V471-L475 HydrophobicContact CG1-CG 4.46Å
472	P	68.4	Low	68.7	Low	82 Å²	82	104.3 Å²	104.3	53%	0.532	57%	0.565	S	S	.	*			trans	-60	134.8	179.8	22.6	-31.4	0	0	0	109.6	D474 L475	P472-D474 PolarHBondContact O-N 2.95Å; P472-L475 WeakPolarHBondContact O-CB 3.39Å; P472-L475 PolarHBondContact O-N 3.45Å
473	L	69.9	Low	67.4	Low	142 Å²	142	107.4 Å²	107.4	74%	0.743	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-15.4	175.6	-69	166.6	0	0	0	111.9	V471 L475 T476	V471-L473 PolarHBondContact O-N 3.01Å; L473-L475 PolarHBondContact O-N 2.84Å; L473-T476 WeakPolarHBondContact O-CA 3.34Å; L473-T476 WeakPolarHBondContact O-CB 3.18Å; L473-T476 VanDerWaalsContact O-CG2 3.29Å; L473-T476 WeakPolarHBondContact O-CG2 3.2Å; L473-T476 PolarHBondContact O-N 3.14Å; L473-T476 PolarHBondContact O-OG1 3.17Å
474	D	63.1	Low	66.3	Low	120 Å²	120	100.8 Å²	100.8	64%	0.642	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20	171.6	-65.4	-20.1	0	0	0	112.6	P472 T476 S477 L478	P472-D474 PolarHBondContact O-N 2.95Å; D474-T476 PolarHBondContact O-N 3Å; D474-S477 WeakPolarHBondContact O-CA 3.38Å; D474-S477 VanDerWaalsContact O-CB 3.29Å; D474-S477 WeakPolarHBondContact O-CB 3.09Å; D474-S477 PolarHBondContact O-N 3.43Å; D474-S477 PolarHBondContact O-OG 3.46Å; D474-L478 PolarHBondContact O-N 3.32Å
475	L	57.7	Low	65.2	Low	61 Å²	61	100.2 Å²	100.2	32%	0.319	55%	0.549	S	S	.	.	H	α-helix	trans	-59.7	-29.8	166.1	-73.6	-175.5	0	0	0	111.6	V471 P472 L473 S477 L478 F479	V471-L475 HydrophobicContact CB-CD1 4.21Å; V471-L475 HydrophobicContact CG1-CD1 3.26Å; V471-L475 HydrophobicContact CG1-CG 4.46Å; P472-L475 WeakPolarHBondContact O-CB 3.39Å; P472-L475 PolarHBondContact O-N 3.45Å; L473-L475 PolarHBondContact O-N 2.84Å; L475-S477 PolarHBondContact O-N 3.05Å; L475-L478 HydrophobicContact CD2-CD1 3.94Å; L475-L478 CarbonylContact O-C 3.57Å; L475-L478 WeakPolarHBondContact O-CA 3.4Å; L475-L478 WeakPolarHBondContact O-CB 3.5Å; L475-L478 PolarHBondContact O-N 3.48Å; L475-F479 HydrophobicContact CB-CD2 4.19Å; L475-F479 HydrophobicContact CB-CE2 4.08Å; L475-F479 WeakPolarHBondContact O-CD2 3.29Å; L475-F479 PolarHBondContact O-N 2.92Å
476	T	60.3	Low	64.2	Low	74 Å²	74	100.8 Å²	100.8	45%	0.454	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-27.2	171.2	73.1	0	0	0	0	111.4	L473 D474 R480	L473-T476 WeakPolarHBondContact O-CA 3.34Å; L473-T476 WeakPolarHBondContact O-CB 3.18Å; L473-T476 VanDerWaalsContact O-CG2 3.29Å; L473-T476 WeakPolarHBondContact O-CG2 3.2Å; L473-T476 PolarHBondContact O-N 3.14Å; L473-T476 PolarHBondContact O-OG1 3.17Å; D474-T476 PolarHBondContact O-N 3Å; T476-R480 WeakPolarHBondContact O-CA 3.48Å; T476-R480 WeakPolarHBondContact O-CB 3.3Å; T476-R480 PolarHBondContact O-N 3.47Å
477	S	60.6	Low	62.6	Low	69 Å²	69	101.7 Å²	101.7	48%	0.483	54%	0.541	S	S	.	.	H	α-helix	trans	-74.2	-32.5	171.2	80.7	0	0	0	0	112.1	D474 L475 A481	D474-S477 WeakPolarHBondContact O-CA 3.38Å; D474-S477 VanDerWaalsContact O-CB 3.29Å; D474-S477 WeakPolarHBondContact O-CB 3.09Å; D474-S477 PolarHBondContact O-N 3.43Å; D474-S477 PolarHBondContact O-OG 3.46Å; L475-S477 PolarHBondContact O-N 3.05Å; S477-A481 WeakPolarHBondContact O-CA 3.43Å; S477-A481 WeakPolarHBondContact O-CB 3.17Å; S477-A481 PolarHBondContact O-N 3.33Å
478	L	55.8	Low	61.1	Low	111 Å²	111	103 Å²	103	58%	0.581	55%	0.554	S	S	*	*	H	α-helix	trans	-67.6	-47.7	170.5	-102.7	149.3	0	0	0	111.3	D474 L475 R480 Q482	D474-L478 PolarHBondContact O-N 3.32Å; L475-L478 HydrophobicContact CD2-CD1 3.94Å; L475-L478 CarbonylContact O-C 3.57Å; L475-L478 WeakPolarHBondContact O-CA 3.4Å; L475-L478 WeakPolarHBondContact O-CB 3.5Å; L475-L478 PolarHBondContact O-N 3.48Å; L478-R480 VanDerWaalsContact C-N 3.35Å; L478-Q482 WeakPolarHBondContact O-CB 3.29Å; L478-Q482 PolarHBondContact O-N 3.21Å
479	F	61.1	Low	59.3	Low	100 Å²	100	98.2 Å²	98.2	44%	0.439	54%	0.542	S	S	.	.	H	α-helix	trans	-63.8	-40.2	174.4	-71.8	-65	0	0	0	111.2	L475 Q482 L483	L475-F479 HydrophobicContact CB-CD2 4.19Å; L475-F479 HydrophobicContact CB-CE2 4.08Å; L475-F479 WeakPolarHBondContact O-CD2 3.29Å; L475-F479 PolarHBondContact O-N 2.92Å; F479-Q482 PolarHBondContact O-N 2.82Å; F479-L483 WeakPolarHBondContact O-CB 3.15Å; F479-L483 WeakPolarHBondContact O-CD1 3.49Å; F479-L483 WeakPolarHBondContact O-CG 3.41Å; F479-L483 PolarHBondContact O-N 3.47Å
480	R	58.2	Low	57.4	Low	171 Å²	171	100.8 Å²	100.8	65%	0.645	56%	0.56	S	S	*	*	H	α-helix	trans	-74.3	-39.9	178.8	-171.1	-179.9	-96.7	162.6	-9.1	111.4	T476 L478 Q482 L483 D484	T476-R480 WeakPolarHBondContact O-CA 3.48Å; T476-R480 WeakPolarHBondContact O-CB 3.3Å; T476-R480 PolarHBondContact O-N 3.47Å; L478-R480 VanDerWaalsContact C-N 3.35Å; R480-Q482 VanDerWaalsContact C-N 3.27Å; R480-Q482 PolarHBondContact O-N 2.78Å; R480-L483 CarbonylContact O-C 3.54Å; R480-L483 PolarHBondContact O-N 3.35Å; R480-D484 WeakPolarHBondContact O-CA 3.43Å; R480-D484 WeakPolarHBondContact O-CB 3.39Å; R480-D484 PolarHBondContact O-N 3.36Å
481	A	58	Low	55.2	Low	53 Å²	53	102.3 Å²	102.3	44%	0.438	56%	0.562	S	S	.	*	H	α-helix	trans	-66.4	-30.7	173.8	0	0	0	0	0	111.6	S477 N485	S477-A481 WeakPolarHBondContact O-CA 3.43Å; S477-A481 WeakPolarHBondContact O-CB 3.17Å; S477-A481 PolarHBondContact O-N 3.33Å; A481-N485 VanDerWaalsContact O-CB 3.29Å; A481-N485 WeakPolarHBondContact O-CB 3.17Å; A481-N485 PolarHBondContact O-N 3.1Å; A481-N485 PolarHBondContact O-ND2 3.42Å
482	Q	56.8	Low	53.3	Low	103 Å²	103	106.4 Å²	106.4	48%	0.481	57%	0.572	S	S	.	*	H	α-helix	trans	-82.1	-36.5	173.4	-168.6	158.1	-21.1	0	0	112.9	L478 F479 R480 D484 N485 I486	L478-Q482 WeakPolarHBondContact O-CB 3.29Å; L478-Q482 PolarHBondContact O-N 3.21Å; F479-Q482 PolarHBondContact O-N 2.82Å; R480-Q482 VanDerWaalsContact C-N 3.27Å; R480-Q482 PolarHBondContact O-N 2.78Å; Q482-D484 VanDerWaalsContact C-N 3.26Å; Q482-D484 PolarHBondContact O-N 2.87Å; Q482-N485 CarbonylContact O-C 3.55Å; Q482-N485 PolarHBondContact O-N 2.65Å; Q482-I486 HydrophobicContact CG-CD1 4.24Å; Q482-I486 WeakPolarHBondContact O-CB 3.47Å; Q482-I486 VanDerWaalsContact O-CG1 3.27Å; Q482-I486 WeakPolarHBondContact O-CG1 3.38Å; Q482-I486 PolarHBondContact O-N 3.26Å
483	L	54.3	Low	51.4	Low	101 Å²	101	110.4 Å²	110.4	53%	0.529	58%	0.584	S	S	.	*	H	α-helix	trans	-60.1	-41.6	167.4	-93.4	146.9	0	0	0	110.1	F479 R480 I486 L487	F479-L483 WeakPolarHBondContact O-CB 3.15Å; F479-L483 WeakPolarHBondContact O-CD1 3.49Å; F479-L483 WeakPolarHBondContact O-CG 3.41Å; F479-L483 PolarHBondContact O-N 3.47Å; R480-L483 CarbonylContact O-C 3.54Å; R480-L483 PolarHBondContact O-N 3.35Å; L483-I486 PolarHBondContact O-N 3.21Å; L483-L487 HydrophobicContact CD2-CD1 4.29Å; L483-L487 WeakPolarHBondContact O-CB 3.3Å; L483-L487 WeakPolarHBondContact O-CD1 3.45Å; L483-L487 WeakPolarHBondContact O-CG 3.39Å; L483-L487 PolarHBondContact O-N 2.75Å
484	D	54.4	Low	49.3	Very low	77 Å²	77	110 Å²	110	41%	0.412	58%	0.582	S	S	.	*	H	α-helix	trans	-71.6	-32.8	175.1	-69.5	-14.7	0	0	0	110.5	R480 Q482 C488	R480-D484 WeakPolarHBondContact O-CA 3.43Å; R480-D484 WeakPolarHBondContact O-CB 3.39Å; R480-D484 PolarHBondContact O-N 3.36Å; Q482-D484 VanDerWaalsContact C-N 3.26Å; Q482-D484 PolarHBondContact O-N 2.87Å; D484-C488 WeakPolarHBondContact O-CA 3.05Å; D484-C488 WeakPolarHBondContact O-CB 3.34Å; D484-C488 PolarHBondContact O-N 2.95Å
485	N	51.1	Low	47.9	Very low	121 Å²	121	110.4 Å²	110.4	65%	0.647	59%	0.589	S	S	*	*	H	α-helix	trans	-74.6	-24.6	170.9	-85.5	-23.5	0	0	0	113.1	A481 Q482 G489	A481-N485 VanDerWaalsContact O-CB 3.29Å; A481-N485 WeakPolarHBondContact O-CB 3.17Å; A481-N485 PolarHBondContact O-N 3.1Å; A481-N485 PolarHBondContact O-ND2 3.42Å; Q482-N485 CarbonylContact O-C 3.55Å; Q482-N485 PolarHBondContact O-N 2.65Å; N485-G489 WeakPolarHBondContact O-CA 2.89Å; N485-G489 PolarHBondContact O-N 2.79Å
486	I	49.6	Very low	46.4	Very low	132 Å²	132	114.4 Å²	114.4	68%	0.677	61%	0.611	S	S	*	*	H	α-helix	trans	-80.5	-37.1	172.3	-69.3	168.7	0	0	0	110.3	Q482 L483	Q482-I486 HydrophobicContact CG-CD1 4.24Å; Q482-I486 WeakPolarHBondContact O-CB 3.47Å; Q482-I486 VanDerWaalsContact O-CG1 3.27Å; Q482-I486 WeakPolarHBondContact O-CG1 3.38Å; Q482-I486 PolarHBondContact O-N 3.26Å; L483-I486 PolarHBondContact O-N 3.21Å
487	L	48	Very low	44.8	Very low	125 Å²	125	120.7 Å²	120.7	65%	0.654	63%	0.632	S	S	*	*	H	α-helix	trans	-81.6	-40.7	179	-78.1	157.6	0	0	0	112.5	L483	L483-L487 HydrophobicContact CD2-CD1 4.29Å; L483-L487 WeakPolarHBondContact O-CB 3.3Å; L483-L487 WeakPolarHBondContact O-CD1 3.45Å; L483-L487 WeakPolarHBondContact O-CG 3.39Å; L483-L487 PolarHBondContact O-N 2.75Å
488	C	47	Very low	43.2	Very low	80 Å²	80	126.4 Å²	126.4	54%	0.541	65%	0.648	S	S	.	*	S	Bend	trans	-98.7	7.7	176.8	-56.6	0	0	0	0	113.3	D484 N490 L491	D484-C488 WeakPolarHBondContact O-CA 3.05Å; D484-C488 WeakPolarHBondContact O-CB 3.34Å; D484-C488 PolarHBondContact O-N 2.95Å; C488-N490 CarbonylContact O-C 3.53Å; C488-N490 PolarHBondContact O-N 2.59Å; C488-L491 PolarHBondContact O-N 3.04Å
489	G	41.8	Very low	41.9	Very low	51 Å²	51	124.2 Å²	124.2	53%	0.526	65%	0.646	S	S	.	*	S	Bend	trans	-58.1	-10.3	169.3	0	0	0	0	0	113.9	N485	N485-G489 WeakPolarHBondContact O-CA 2.89Å; N485-G489 PolarHBondContact O-N 2.79Å
490	N	37.2	Very low	40.4	Very low	143 Å²	143	126.1 Å²	126.1	77%	0.765	66%	0.661	S	S	*	*	S	Bend	trans	-128.5	84.8	163.1	-63.9	-43.2	0	0	0	108.6	C488	C488-N490 CarbonylContact O-C 3.53Å; C488-N490 PolarHBondContact O-N 2.59Å
491	L	33.6	Very low	39	Very low	132 Å²	132	125 Å²	125	69%	0.691	67%	0.668	S	S	*	*	S	Bend	trans	161.7	116.6	140	-83.5	155.5	0	0	0	110.5	C488	C488-L491 PolarHBondContact O-N 3.04Å
492	F	31.4	Very low	37.6	Very low	186 Å²	186	130.4 Å²	130.4	82%	0.816	68%	0.684	S	S	*	*			trans	84	81.8	162.2	-55.5	-68.8	0	0	0	118.9
493	E	29.1	Very low	36.1	Very low	166 Å²	166	132.2 Å²	132.2	78%	0.776	70%	0.696	S	S	*	*				-32.2	136	127.7	-95.1	179.9	156.9	0	0	114.4
494	N	27.1	Very low	34.9	Very low	134 Å²	134	135.5 Å²	135.5	72%	0.717	71%	0.709	S	S	*	*			trans	75.5	115.8	147.4	-52.7	-30.7	0	0	0	118.2
495	V	32.3	Very low	33.6	Very low	129 Å²	129	140.1 Å²	140.1	78%	0.782	73%	0.726	S	S	*	*				154.2	111	114.4	170.5	0	0	0	0	111.6
496	N	25.7	Very low	32.5	Very low	145 Å²	145	142.4 Å²	142.4	78%	0.775	74%	0.737	S	S	*	*			trans	56.6	92.5	144.7	-63.3	-15.3	0	0	0	121.2	K498	N496-K498 PolarHBondContact O-N 3.24Å
497	F	27.6	Very low	31.4	Very low	206 Å²	206	143.2 Å²	143.2	90%	0.904	74%	0.737	S	S	*	*			trans	-21.1	110.6	134.1	-138.8	-101.5	0	0	0	113.8
498	K	26.9	Very low	30.7	Very low	188 Å²	188	144.4 Å²	144.4	82%	0.817	75%	0.745	S	S	*	*			trans	-113.2	104.5	161	-164.8	157.7	-175	175.6	0	107.7	N496 D500	N496-K498 PolarHBondContact O-N 3.24Å; K498-D500 PolarHBondContact O-N 2.62Å
499	A	28.9	Very low	29.8	Very low	65 Å²	65	145.4 Å²	145.4	54%	0.537	75%	0.745	S	S	.	*			trans	-69.4	105.9	177.1	0	0	0	0	0	109.6	N501	A499-N501 VanDerWaalsContact C-N 3.32Å; A499-N501 PolarHBondContact O-N 2.84Å
500	D	29.6	Very low	29.5	Very low	140 Å²	140	150 Å²	150	75%	0.749	76%	0.757	S	S	*	*			trans	-83.6	84.3	165.6	-76.9	-22	0	0	0	108.7	K498 Q502	K498-D500 PolarHBondContact O-N 2.62Å; D500-Q502 PolarHBondContact O-N 3.24Å; D500-Q502 VanDerWaalsContact O-N 3.1Å
501	N	27.7	Very low	29	Very low	149 Å²	149	150 Å²	150	80%	0.797	76%	0.757	S	S	*	*			trans	-68.6	92.1	160.8	-85.3	-19.5	0	0	0	108.6	A499	A499-N501 VanDerWaalsContact C-N 3.32Å; A499-N501 PolarHBondContact O-N 2.84Å
502	Q	28.7	Very low	29.1	Very low	165 Å²	165	150.3 Å²	150.3	77%	0.771	76%	0.759	S	S	*	*			trans	-103.9	88.2	162.5	-74.2	-168.3	-8.6	0	0	109.8	D500 Q504	D500-Q502 PolarHBondContact O-N 3.24Å; D500-Q502 VanDerWaalsContact O-N 3.1Å; Q502-Q504 PolarHBondContact O-N 3.49Å
503	L	27	Very low	29.3	Very low	141 Å²	141	148.4 Å²	148.4	74%	0.738	76%	0.758	S	S	*	*			trans	-57.5	107.7	160.4	-78.5	152.3	0	0	0	109.4	F505	L503-F505 HydrophobicContact CB-CD2 4.5Å; L503-F505 HydrophobicContact CB-CE2 4.11Å; L503-F505 HydrophobicContact CD2-CE2 4.44Å; L503-F505 HydrophobicContact CD2-CZ 4.46Å
504	Q	28.9	Very low	29.2	Very low	170 Å²	170	149.8 Å²	149.8	79%	0.794	76%	0.764	S	S	*	*			trans	-111.2	102.6	159.3	-77.3	-164.9	3.6	0	0	109.7	Q502 L506	Q502-Q504 PolarHBondContact O-N 3.49Å; Q504-L506 PolarHBondContact O-N 2.76Å
505	F	25.9	Very low	29.6	Very low	174 Å²	174	150.4 Å²	150.4	76%	0.763	77%	0.768	S	S	*	*			trans	-59.6	116.7	163.6	-65.5	-91.4	0	0	0	109.7	L503	L503-F505 HydrophobicContact CB-CD2 4.5Å; L503-F505 HydrophobicContact CB-CE2 4.11Å; L503-F505 HydrophobicContact CD2-CE2 4.44Å; L503-F505 HydrophobicContact CD2-CZ 4.46Å
506	L	28.6	Very low	29.4	Very low	170 Å²	170	149.2 Å²	149.2	89%	0.89	77%	0.765	S	S	*	*			trans	-116.7	94.3	155.4	-76.9	-179.6	0	0	0	108.5	Q504	Q504-L506 PolarHBondContact O-N 2.76Å
507	H	27.4	Very low	29.8	Very low	148 Å²	148	149.6 Å²	149.6	69%	0.685	77%	0.767	S	S	*	*			trans	-68	118.4	161.8	-176.2	73.7	0	0	0	107.9	N509	H507-N509 PolarHBondContact CE1-ND2 2.89Å; H507-N509 PolarHBondContact CE1-OD1 3.4Å; H507-N509 PolarHBondContact NE2-ND2 3.31Å
508	N	32.6	Very low	29.7	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	76%	0.764	S	S	*	*			trans	-142.1	105.8	157.5	-138.6	13.3	0	0	0	109
509	N	28.9	Very low	30	Very low	100 Å²	100	149 Å²	149	54%	0.535	76%	0.763	S	S	.	*			trans	-66.3	128.6	167.9	-59.9	-43.9	0	0	0	108	H507	H507-N509 PolarHBondContact CE1-ND2 2.89Å; H507-N509 PolarHBondContact CE1-OD1 3.4Å; H507-N509 PolarHBondContact NE2-ND2 3.31Å
510	N	33.7	Very low	30	Very low	147 Å²	147	154 Å²	154	79%	0.786	78%	0.775	S	S	*	*			trans	-134.2	108.2	143.1	-82.4	-26.5	0	0	0	105.7
511	N	27.9	Very low	30.1	Very low	143 Å²	143	154.7 Å²	154.7	77%	0.765	78%	0.779	S	S	*	*			trans	-64.6	125.6	161.1	-53	-49.5	0	0	0	105.9
512	D	35.2	Very low	30.2	Very low	139 Å²	139	156 Å²	156	74%	0.743	78%	0.78	S	S	*	*			trans	-152.3	124.6	152.7	-78.9	-41.9	0	0	0	107.4
513	D	35	Very low	30.2	Very low	147 Å²	147	156.2 Å²	156.2	79%	0.786	78%	0.781	S	S	*	*			trans	77.3	87.9	155	-49.3	-29.1	0	0	0	119.1	D515	D513-D515 PolarHBondContact O-N 3.42Å
514	E	28.6	Very low	30.3	Very low	194 Å²	194	158.7 Å²	158.7	91%	0.907	79%	0.786	S	S	*	*			trans	-53.9	115.2	145.5	-69.7	-179.7	164.4	0	0	109.8
515	D	33.8	Very low	30.2	Very low	147 Å²	147	157.9 Å²	157.9	79%	0.786	79%	0.787	S	S	*	*			trans	-135.2	118.8	150.9	-99.5	-28.4	0	0	0	109.2	D513 N517	D513-D515 PolarHBondContact O-N 3.42Å; D515-N517 PolarHBondContact O-N 2.89Å
516	S	29.5	Very low	30.4	Very low	104 Å²	104	156.4 Å²	156.4	73%	0.727	79%	0.787	S	S	*	*			trans	-30.5	120.9	172.4	48.7	0	0	0	0	115.2
517	N	32.5	Very low	30.2	Very low	154 Å²	154	155.6 Å²	155.6	82%	0.824	78%	0.783	S	S	*	*			trans	-137.7	89.1	147.6	-81.2	-55.1	0	0	0	108.8	D515 Y519	D515-N517 PolarHBondContact O-N 2.89Å; N517-Y519 PolarHBondContact O-N 3.32Å
518	E	27.1	Very low	30.1	Very low	177 Å²	177	159.5 Å²	159.5	83%	0.827	79%	0.793	S	S	*	*			trans	-69.4	99.9	164.5	-173.2	170.2	-157.3	0	0	107.9
519	Y	31.5	Very low	29.7	Very low	204 Å²	204	161.1 Å²	161.1	80%	0.8	79%	0.793	S	S	*	*			trans	-136.2	102.4	157.6	-94.8	-77.4	0	0	0	107.8	N517 N521	N517-Y519 PolarHBondContact O-N 3.32Å; Y519-N521 PolarHBondContact O-N 2.97Å; Y519-N521 VanDerWaalsContact O-N 3.15Å
520	E	30.3	Very low	29.7	Very low	171 Å²	171	163.3 Å²	163.3	80%	0.799	81%	0.81	S	S	*	*			trans	-46.1	114.6	159.8	-65.2	-176.5	150.2	0	0	108.9
521	N	31.4	Very low	29.4	Very low	153 Å²	153	161.8 Å²	161.8	82%	0.818	81%	0.806	S	S	*	*			trans	-118.5	100.4	154.8	-80.9	-58.8	0	0	0	106.4	Y519 E523	Y519-N521 PolarHBondContact O-N 2.97Å; Y519-N521 VanDerWaalsContact O-N 3.15Å; N521-E523 PolarHBondContact O-N 2.97Å
522	E	30.7	Very low	29.5	Very low	176 Å²	176	162 Å²	162	82%	0.822	81%	0.807	S	S	*	*			trans	-49.3	124	163.4	-71.5	175.6	144	0	0	110.3
523	E	27.6	Very low	29.1	Very low	171 Å²	171	164.5 Å²	164.5	80%	0.799	81%	0.814	S	S	*	*				55	85.1	126	-135.5	174.1	-147.3	0	0	117.2	N521	N521-E523 PolarHBondContact O-N 2.97Å
524	K	29.3	Very low	28.8	Very low	192 Å²	192	166.6 Å²	166.6	84%	0.835	82%	0.819	S	S	*	*			trans	-135.9	82	144.4	-83.6	-168.1	178.4	173	0	110.6	D526	K524-D526 PolarHBondContact O-N 2.9Å
525	D	27	Very low	28.9	Very low	153 Å²	153	164.6 Å²	164.6	82%	0.818	82%	0.815	S	S	*	*			trans	-68.3	77.8	156.9	-81.1	-30.3	0	0	0	109.6
526	D	28.8	Very low	28.6	Very low	144 Å²	144	164.3 Å²	164.3	77%	0.77	81%	0.812	S	S	*	*			trans	-106.7	83.2	158.4	-81.4	-34.9	0	0	0	108.7	K524 Y528	K524-D526 PolarHBondContact O-N 2.9Å; D526-Y528 PolarHBondContact O-N 2.77Å
527	L	24.7	Very low	28.4	Very low	153 Å²	153	167.4 Å²	167.4	80%	0.801	82%	0.819	S	S	*	*			trans	-34.8	115.7	169.1	-174.3	69.3	0	0	0	113.2	K529	L527-K529 PolarHBondContact O-N 2.69Å; L527-K529 VanDerWaalsContact O-N 3.14Å
528	Y	25.9	Very low	28.3	Very low	229 Å²	229	166.9 Å²	166.9	90%	0.898	82%	0.822	S	S	*	*			trans	-40.1	112.2	163.4	-72.8	-98.4	0	0	0	112.2	D526	D526-Y528 PolarHBondContact O-N 2.77Å
529	K	24.8	Very low	28.3	Very low	185 Å²	185	162.6 Å²	162.6	80%	0.804	81%	0.811	S	S	*	*			trans	-145.3	63	167	-147.5	-178.2	-169.2	-178.8	0	111.4	L527	L527-K529 PolarHBondContact O-N 2.69Å; L527-K529 VanDerWaalsContact O-N 3.14Å
530	V	27.9	Very low	28.2	Very low	146 Å²	146	158.2 Å²	158.2	89%	0.885	81%	0.811	S	S	*	*			trans	-134.5	73.1	162.8	-171.8	0	0	0	0	107.8
531	T	27.8	Very low	28	Very low	115 Å²	115	158.2 Å²	158.2	71%	0.706	82%	0.815	S	S	*	*			trans	-99.7	122.8	163.4	50.3	0	0	0	0	107.6
532	N	29.2	Very low	27.7	Very low	149 Å²	149	160 Å²	160	80%	0.797	82%	0.816	S	S	*	*	S	Bend	trans	80.9	66.3	153.8	-50.3	-17.5	0	0	0	118.4
533	E	28.4	Very low	27.5	Very low	191 Å²	191	158.1 Å²	158.1	89%	0.893	81%	0.811	S	S	*	*			trans	-134.3	30.7	153.3	-74.9	-163	169.1	0	0	113.4	N535	E533-N535 PolarHBondContact O-N 3.03Å; E533-N535 VanDerWaalsContact O-N 3.12Å
534	E	28.7	Very low	27.6	Very low	190 Å²	190	156.2 Å²	156.2	89%	0.888	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	10.9	178.3	-82.2	-166	154.3	0	0	115.8
535	N	29.3	Very low	27.8	Very low	152 Å²	152	155 Å²	155	81%	0.813	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	13.3	-170.8	-90.1	-8.1	0	0	0	117.8	E533	E533-N535 PolarHBondContact O-N 3.03Å; E533-N535 VanDerWaalsContact O-N 3.12Å
536	I	27	Very low	28.4	Very low	142 Å²	142	157.1 Å²	157.1	73%	0.728	81%	0.809	S	S	*	*	S	Bend	trans	-121.6	-7.8	-175	-58.2	-177.5	0	0	0	116.3
537	L	26.8	Very low	28.7	Very low	169 Å²	169	153.3 Å²	153.3	89%	0.885	79%	0.788	S	S	*	*			trans	-107.5	27.4	-178.9	-73.8	172.7	0	0	0	116
538	T	28.9	Very low	29.5	Very low	143 Å²	143	148.5 Å²	148.5	88%	0.877	77%	0.767	S	S	*	*	S	Bend	trans	-89.3	2.1	168.9	49.2	0	0	0	0	114.3
539	S	28.2	Very low	30.6	Very low	86 Å²	86	141 Å²	141	60%	0.601	75%	0.745	S	S	*	*	S	Bend	trans	-116.6	127.1	172.4	77.9	0	0	0	0	110.7
540	S	28.7	Very low	31.5	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	74%	0.737	S	S	*	*			trans	99.6	6.7	156.5	77.8	0	0	0	0	122.4	K542	S540-K542 PolarHBondContact O-N 3.29Å
541	L	26.4	Very low	32.3	Very low	172 Å²	172	135.4 Å²	135.4	90%	0.901	72%	0.716	S	S	*	*			trans	-82.9	67.7	157.3	-115.2	144	0	0	0	110.1	L543	L541-L543 PolarHBondContact O-N 3.02Å
542	K	25.7	Very low	33	Very low	191 Å²	191	133.7 Å²	133.7	83%	0.83	70%	0.702	S	S	*	*			trans	-67.5	93.9	171.8	-152.3	168.3	-170	175.4	0	106.4	S540 P544	S540-K542 PolarHBondContact O-N 3.29Å; K542-P544 WeakPolarHBondContact O-CD 3Å; K542-P544 VanDerWaalsContact O-N 3.15Å
543	L	26.4	Very low	33.7	Very low	136 Å²	136	131.8 Å²	131.8	71%	0.712	69%	0.69	S	S	*	*			trans	-51.9	122	168.4	-113.6	85.5	0	0	0	107	L541 Y545	L541-L543 PolarHBondContact O-N 3.02Å; L543-Y545 PolarHBondContact O-N 2.7Å
544	P	28.6	Very low	34.4	Very low	131 Å²	131	128.9 Å²	128.9	85%	0.851	68%	0.676	S	S	*	*	S	Bend	trans	-76.6	21.1	-170	30.8	-34.5	0	0	0	113.3	K542	K542-P544 WeakPolarHBondContact O-CD 3Å; K542-P544 VanDerWaalsContact O-N 3.15Å
545	Y	34.8	Very low	35.1	Very low	167 Å²	167	121.2 Å²	121.2	66%	0.655	64%	0.644	S	S	*	*			trans	-139.7	89.1	-178	-146.3	-102.3	0	0	0	109.6	L543 M547	L543-Y545 PolarHBondContact O-N 2.7Å; Y545-M547 HydrophobicContact CD1-CB 3.81Å; Y545-M547 HydrophobicContact CD1-SD 4.33Å; Y545-M547 HydrophobicContact CE1-CB 3.93Å; Y545-M547 HydrophobicContact CE1-CG 4.19Å; Y545-M547 HydrophobicContact CE1-SD 3.67Å; Y545-M547 PolarHBondContact O-N 2.95Å
546	Q	40.3	Very low	35.6	Very low	197 Å²	197	118.1 Å²	118.1	92%	0.921	63%	0.626	S	S	*	*			trans	-72.7	75.8	162.1	-69.9	-176.5	-65.1	0	0	107.3	S548	Q546-S548 PolarHBondContact O-N 3.12Å
547	M	34.8	Very low	36.3	Very low	63 Å²	63	115.4 Å²	115.4	31%	0.31	62%	0.62	S	S	.	*			trans	-66.2	124	165.6	-165.3	136.4	70.3	0	0	106.7	Y545 E551 L552	Y545-M547 HydrophobicContact CD1-CB 3.81Å; Y545-M547 HydrophobicContact CD1-SD 4.33Å; Y545-M547 HydrophobicContact CE1-CB 3.93Å; Y545-M547 HydrophobicContact CE1-CG 4.19Å; Y545-M547 HydrophobicContact CE1-SD 3.67Å; Y545-M547 PolarHBondContact O-N 2.95Å; M547-E551 HydrophobicContact CG-CB 3.45Å; M547-E551 VanDerWaalsContact CG-CB 3.45Å; M547-E551 HydrophobicContact SD-CB 4.04Å; M547-L552 HydrophobicContact CE-CG 4.03Å
548	S	40.9	Very low	37	Very low	53 Å²	53	115.4 Å²	115.4	37%	0.371	62%	0.615	S	S	.	*			trans	-58.6	145.4	176.9	66	0	0	0	0	108.9	Q546 N550 E551 L552	Q546-S548 PolarHBondContact O-N 3.12Å; S548-N550 PolarHBondContact O-N 3.06Å; S548-E551 PolarHBondContact N-OE2 3.31Å; S548-E551 PolarHBondContact O-N 2.88Å; S548-E551 WeakPolarHBondContact OG-CB 3.42Å; S548-E551 WeakPolarHBondContact OG-CG 3.34Å; S548-E551 PolarHBondContact OG-N 3.23Å; S548-E551 PolarHBondContact OG-OE2 3.1Å; S548-L552 PolarHBondContact O-N 3.36Å
549	T	48	Very low	37.5	Very low	70 Å²	70	114.5 Å²	114.5	43%	0.429	60%	0.604	S	S	.	*	H	α-helix	trans	-55	-30.9	-179.5	49.6	0	0	0	0	112.3	L552 M553	T549-L552 PolarHBondContact O-N 3.18Å; T549-M553 WeakPolarHBondContact O-CB 3.37Å; T549-M553 VanDerWaalsContact O-CG 3.3Å; T549-M553 WeakPolarHBondContact O-CG 3.47Å; T549-M553 PolarHBondContact O-N 3.4Å
550	N	44.1	Very low	37.9	Very low	121 Å²	121	118.4 Å²	118.4	65%	0.647	62%	0.624	S	S	*	*	H	α-helix	trans	-67	-47.1	175.8	-67.3	-6.2	0	0	0	110.8	S548 L552 M553 E554	S548-N550 PolarHBondContact O-N 3.06Å; N550-L552 VanDerWaalsContact C-N 3.3Å; N550-L552 PolarHBondContact O-N 2.74Å; N550-M553 PolarHBondContact O-N 3.5Å; N550-E554 WeakPolarHBondContact O-CB 3.2Å; N550-E554 PolarHBondContact O-N 2.94Å
551	E	44.7	Very low	38.4	Very low	93 Å²	93	118.7 Å²	118.7	44%	0.435	62%	0.616	S	S	.	*	H	α-helix	trans	-66.3	-31.1	173.9	-75.6	166.7	146.5	0	0	112.5	M547 S548 E554 S555	M547-E551 HydrophobicContact CG-CB 3.45Å; M547-E551 VanDerWaalsContact CG-CB 3.45Å; M547-E551 HydrophobicContact SD-CB 4.04Å; S548-E551 PolarHBondContact N-OE2 3.31Å; S548-E551 PolarHBondContact O-N 2.88Å; S548-E551 WeakPolarHBondContact OG-CB 3.42Å; S548-E551 WeakPolarHBondContact OG-CG 3.34Å; S548-E551 PolarHBondContact OG-N 3.23Å; S548-E551 PolarHBondContact OG-OE2 3.1Å; E551-E554 PolarHBondContact O-N 2.68Å; E551-S555 WeakPolarHBondContact O-CA 3.44Å; E551-S555 WeakPolarHBondContact O-CB 3.11Å; E551-S555 PolarHBondContact O-N 3.25Å; E551-S555 PolarHBondContact O-OG 3.3Å
552	L	43.6	Very low	39	Very low	79 Å²	79	115.9 Å²	115.9	41%	0.414	60%	0.601	S	S	.	*	H	α-helix	trans	-68.4	-42.5	175.1	-128.4	170.3	0	0	0	110.9	M547 S548 T549 N550 S555 L556	M547-L552 HydrophobicContact CE-CG 4.03Å; S548-L552 PolarHBondContact O-N 3.36Å; T549-L552 PolarHBondContact O-N 3.18Å; N550-L552 VanDerWaalsContact C-N 3.3Å; N550-L552 PolarHBondContact O-N 2.74Å; L552-S555 WeakPolarHBondContact CA-OG 3.45Å; L552-S555 PolarHBondContact O-OG 2.8Å; L552-S555 VanDerWaalsContact O-OG 3.1Å; L552-L556 HydrophobicContact CD2-CD1 3.93Å; L552-L556 HydrophobicContact CD2-CG 4.34Å; L552-L556 WeakPolarHBondContact O-CB 3.36Å; L552-L556 WeakPolarHBondContact O-CD1 3.27Å; L552-L556 VanDerWaalsContact O-CG 3.3Å; L552-L556 WeakPolarHBondContact O-CG 3.19Å; L552-L556 PolarHBondContact O-N 3.23Å
553	M	42.8	Very low	39.7	Very low	109 Å²	109	111.7 Å²	111.7	54%	0.537	59%	0.588	S	S	.	*	H	α-helix	trans	-68.9	-36.8	173.2	-73.6	-62.6	-65.5	0	0	112.1	T549 N550 S557	T549-M553 WeakPolarHBondContact O-CB 3.37Å; T549-M553 VanDerWaalsContact O-CG 3.3Å; T549-M553 WeakPolarHBondContact O-CG 3.47Å; T549-M553 PolarHBondContact O-N 3.4Å; N550-M553 PolarHBondContact O-N 3.5Å; M553-S557 WeakPolarHBondContact O-CB 3.01Å; M553-S557 PolarHBondContact O-N 2.74Å
554	E	44.4	Very low	40.5	Very low	131 Å²	131	110.3 Å²	110.3	61%	0.612	58%	0.581	S	S	*	*	H	α-helix	trans	-73.8	-39	179.9	-159.6	168.1	-147	0	0	110.8	N550 E551 S557 Q558	N550-E554 WeakPolarHBondContact O-CB 3.2Å; N550-E554 PolarHBondContact O-N 2.94Å; E551-E554 PolarHBondContact O-N 2.68Å; E554-S557 CarbonylContact O-C 3.59Å; E554-S557 PolarHBondContact O-N 3.5Å; E554-Q558 WeakPolarHBondContact O-CB 3.19Å; E554-Q558 PolarHBondContact O-N 2.64Å
555	S	43.4	Very low	41.3	Very low	29 Å²	29	109 Å²	109	20%	0.203	56%	0.564	C	S	.	*	H	α-helix	trans	-69.4	-40.7	171	57.2	0	0	0	0	112.2	E551 L552 S557 Q558 I559	E551-S555 WeakPolarHBondContact O-CA 3.44Å; E551-S555 WeakPolarHBondContact O-CB 3.11Å; E551-S555 PolarHBondContact O-N 3.25Å; E551-S555 PolarHBondContact O-OG 3.3Å; L552-S555 WeakPolarHBondContact CA-OG 3.45Å; L552-S555 PolarHBondContact O-OG 2.8Å; L552-S555 VanDerWaalsContact O-OG 3.1Å; S555-S557 VanDerWaalsContact C-N 3.31Å; S555-S557 PolarHBondContact O-N 3.31Å; S555-Q558 PolarHBondContact O-N 2.95Å; S555-I559 WeakPolarHBondContact O-CB 3.29Å; S555-I559 WeakPolarHBondContact O-CD1 3.32Å; S555-I559 WeakPolarHBondContact O-CG1 3.05Å; S555-I559 PolarHBondContact O-N 3.23Å
556	L	39.4	Very low	41.7	Very low	86 Å²	86	105.1 Å²	105.1	45%	0.45	56%	0.558	S	S	.	*	H	α-helix	trans	-61.3	-41	170.3	-83.4	164.5	0	0	0	111.3	L552 Q558 I559 V560	L552-L556 HydrophobicContact CD2-CD1 3.93Å; L552-L556 HydrophobicContact CD2-CG 4.34Å; L552-L556 WeakPolarHBondContact O-CB 3.36Å; L552-L556 WeakPolarHBondContact O-CD1 3.27Å; L552-L556 VanDerWaalsContact O-CG 3.3Å; L552-L556 WeakPolarHBondContact O-CG 3.19Å; L552-L556 PolarHBondContact O-N 3.23Å; L556-Q558 VanDerWaalsContact C-N 3.31Å; L556-Q558 PolarHBondContact O-N 2.8Å; L556-I559 PolarHBondContact O-N 3.5Å; L556-V560 WeakPolarHBondContact O-CG2 3.42Å; L556-V560 PolarHBondContact O-N 2.95Å
557	S	41.9	Very low	41.8	Very low	86 Å²	86	98.6 Å²	98.6	60%	0.601	53%	0.532	S	S	*	.	H	α-helix	trans	-68.6	-25.1	175.2	177.1	0	0	0	0	113.7	M553 E554 S555	M553-S557 WeakPolarHBondContact O-CB 3.01Å; M553-S557 PolarHBondContact O-N 2.74Å; E554-S557 CarbonylContact O-C 3.59Å; E554-S557 PolarHBondContact O-N 3.5Å; S555-S557 VanDerWaalsContact C-N 3.31Å; S555-S557 PolarHBondContact O-N 3.31Å
558	Q	40.2	Very low	42.3	Very low	168 Å²	168	101.3 Å²	101.3	79%	0.785	55%	0.549	S	S	*	.	H	α-helix	trans	-84.9	-25.3	174.2	-105.8	177.3	-16.1	0	0	112.5	E554 S555 L556	E554-Q558 WeakPolarHBondContact O-CB 3.19Å; E554-Q558 PolarHBondContact O-N 2.64Å; S555-Q558 PolarHBondContact O-N 2.95Å; L556-Q558 VanDerWaalsContact C-N 3.31Å; L556-Q558 PolarHBondContact O-N 2.8Å
559	I	40.6	Very low	42.4	Very low	124 Å²	124	105.3 Å²	105.3	64%	0.636	56%	0.564	S	S	*	*	H	α-helix	trans	-82.6	-34.7	178.4	-71.4	165	0	0	0	111.5	S555 L556	S555-I559 WeakPolarHBondContact O-CB 3.29Å; S555-I559 WeakPolarHBondContact O-CD1 3.32Å; S555-I559 WeakPolarHBondContact O-CG1 3.05Å; S555-I559 PolarHBondContact O-N 3.23Å; L556-I559 PolarHBondContact O-N 3.5Å
560	V	36.2	Very low	41.9	Very low	168 Å²	168	108.5 Å²	108.5	100%	1.018	58%	0.576	S	S	*	*			trans	-72.5	0	167.9	175.4	0	0	0	0	109.7	L556	L556-V560 WeakPolarHBondContact O-CG2 3.42Å; L556-V560 PolarHBondContact O-N 2.95Å

Retrieved 560 of 560 residues in 1383.6 ms (Link to these results)

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