G4LWY8_SCHMA Loading...

Ribosome production factor 2 homolog

AlphaFold DB , UniProt , Accession G4LWY8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 345 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	33.7	Very low	58.3	Low	240 Å²	240	149.6 Å²	149.6	100%	1.182	77%	0.768	S	S	*	*				0	114.7	0	-64.7	-173.4	-160.1	0	0	107.3	V3	M1-V3 PolarHBondContact O-N 3.01Å
2	A	39.4	Very low	61.2	Low	96 Å²	96	144.3 Å²	144.3	79%	0.793	75%	0.747	S	S	*	*			trans	-66.4	127.4	178.9	0	0	0	0	0	108.8	I4	A2-I4 PolarHBondContact O-N 3.19Å
3	V	42.4	Very low	63.5	Low	121 Å²	121	142.4 Å²	142.4	73%	0.733	73%	0.733	S	S	*	*			trans	-66.5	92	-175.5	177.3	0	0	0	0	108.8	M1 S5	M1-V3 PolarHBondContact O-N 3.01Å; V3-S5 WeakPolarHBondContact CG1-OG 3.23Å; V3-S5 PolarHBondContact O-N 3.36Å
4	I	51.6	Low	65.5	Low	146 Å²	146	144.4 Å²	144.4	75%	0.749	73%	0.733	S	S	*	*			trans	-82.8	59.5	160.8	-52.5	172.2	0	0	0	106.6	A2 I7	A2-I4 PolarHBondContact O-N 3.19Å; I4-I7 HydrophobicContact CG2-CD1 4.15Å
5	S	42.3	Very low	67.3	Low	82 Å²	82	136.5 Å²	136.5	57%	0.573	70%	0.702	S	S	*	*			trans	-103.2	121.9	170.8	68.6	0	0	0	0	108.6	V3	V3-S5 WeakPolarHBondContact CG1-OG 3.23Å; V3-S5 PolarHBondContact O-N 3.36Å
6	D	50.6	Low	68.8	Low	147 Å²	147	134.5 Å²	134.5	79%	0.786	69%	0.686	S	S	*	*			trans	88	28.9	172.4	-65.2	-9.3	0	0	0	120	R8	D6-R8 PolarHBondContact O-N 2.97Å
7	I	61.6	Low	70.2	Confident	135 Å²	135	135.8 Å²	135.8	69%	0.692	68%	0.681	S	S	*	*			trans	-74.4	88.2	151.9	-54.1	178	0	0	0	107.8	I4 K9	I4-I7 HydrophobicContact CG2-CD1 4.15Å; I7-K9 PolarHBondContact O-N 3.34Å
8	R	70.4	Confident	71.4	Confident	223 Å²	223	130.9 Å²	130.9	84%	0.842	66%	0.659	S	S	*	*			trans	-54.7	110.6	171.5	-78.7	-175	177.2	-173.8	-0.6	108.8	D6	D6-R8 PolarHBondContact O-N 2.97Å
9	K	79.6	Confident	72.4	Confident	190 Å²	190	128.6 Å²	128.6	83%	0.826	65%	0.648	S	S	*	*			trans	-54	133.4	175.6	-69.1	-177.8	-179.1	177.4	0	109	I7 K11	I7-K9 PolarHBondContact O-N 3.34Å; K9-K11 PolarHBondContact O-N 3.09Å
10	P	82.1	Confident	73.4	Confident	53 Å²	53	127.4 Å²	127.4	34%	0.344	64%	0.64	S	S	.	*			trans	-62	126.5	-179.6	24.1	-32.7	0	0	0	109.9	T12 K16 L19	P10-T12 VanDerWaalsContact C-N 3.31Å; P10-K16 HydrophobicContact CB-CB 3.93Å; P10-K16 HydrophobicContact CG-CB 3.55Å; P10-K16 HydrophobicContact CG-CG 3.95Å; P10-L19 HydrophobicContact CB-CD1 3.97Å; P10-L19 HydrophobicContact CG-CD1 4.12Å
11	K	87.9	Confident	74.3	Confident	213 Å²	213	127.4 Å²	127.4	93%	0.926	63%	0.633	S	S	*	*	S	Bend	trans	-72.2	-25.8	176.5	-64.5	-173.8	177.5	-173.4	0	112.9	K9	K9-K11 PolarHBondContact O-N 3.09Å
12	T	92.7	Very high	77	Confident	85 Å²	85	120.7 Å²	120.7	52%	0.521	59%	0.594	S	S	.	*	S	Bend	trans	-122.3	149.1	-175.3	65.8	0	0	0	0	111.3	P10 K14 G15 K16	P10-T12 VanDerWaalsContact C-N 3.31Å; T12-K14 VanDerWaalsContact C-N 3.27Å; T12-K14 PolarHBondContact O-N 2.97Å; T12-G15 WeakPolarHBondContact O-CA 3.28Å; T12-G15 PolarHBondContact O-N 2.93Å; T12-G15 PolarHBondContact OG1-N 2.81Å; T12-G15 VanDerWaalsContact OG1-N 3.15Å; T12-K16 PolarHBondContact O-N 3.44Å
13	H	91.4	Very high	79.5	Confident	120 Å²	120	118.3 Å²	118.3	56%	0.556	58%	0.575	S	S	*	*	H	α-helix	trans	-59.6	-37.2	176.5	179.7	-131.1	0	0	0	112.7	K16 R17	H13-K16 PolarHBondContact O-N 2.9Å; H13-R17 PolarHBondContact CE1-NE 2.73Å; H13-R17 PolarHBondContact CE1-NH2 2.78Å; H13-R17 PolarHBondContact NE2-NE 3.36Å; H13-R17 WeakPolarHBondContact O-CG 3.46Å; H13-R17 PolarHBondContact O-N 2.74Å
14	K	92	Very high	81.9	Confident	171 Å²	171	119 Å²	119	74%	0.743	58%	0.581	S	S	*	*	H	α-helix	trans	-61.4	-44.1	172.5	-174	176.8	-179.4	177.7	0	111.5	T12 K16 R17 V18	T12-K14 VanDerWaalsContact C-N 3.27Å; T12-K14 PolarHBondContact O-N 2.97Å; K14-K16 VanDerWaalsContact C-N 3.34Å; K14-R17 PolarHBondContact O-N 3.19Å; K14-V18 WeakPolarHBondContact O-CG2 3.45Å; K14-V18 PolarHBondContact O-N 2.9Å; K14-V18 VanDerWaalsContact O-N 3.1Å
15	G	91.4	Very high	83.8	Confident	25 Å²	25	115.9 Å²	115.9	26%	0.258	56%	0.563	S	S	.	*	H	α-helix	trans	-61.3	-42.2	175.7	0	0	0	0	0	112.2	T12 V18 L19	T12-G15 WeakPolarHBondContact O-CA 3.28Å; T12-G15 PolarHBondContact O-N 2.93Å; T12-G15 PolarHBondContact OG1-N 2.81Å; T12-G15 VanDerWaalsContact OG1-N 3.15Å; G15-V18 PolarHBondContact O-N 2.83Å; G15-L19 WeakPolarHBondContact O-CG 3.39Å; G15-L19 PolarHBondContact O-N 3.05Å
16	K	92.1	Very high	86.2	Confident	105 Å²	105	116.6 Å²	116.6	46%	0.457	56%	0.559	S	S	.	*	H	α-helix	trans	-58.3	-51	175.4	-175.7	176.1	169.9	179.5	0	111.8	P10 T12 H13 K14 V18 L19 E20	P10-K16 HydrophobicContact CB-CB 3.93Å; P10-K16 HydrophobicContact CG-CB 3.55Å; P10-K16 HydrophobicContact CG-CG 3.95Å; T12-K16 PolarHBondContact O-N 3.44Å; H13-K16 PolarHBondContact O-N 2.9Å; K14-K16 VanDerWaalsContact C-N 3.34Å; K16-V18 VanDerWaalsContact C-N 3.29Å; K16-V18 PolarHBondContact O-N 2.72Å; K16-L19 PolarHBondContact O-N 2.83Å; K16-L19 VanDerWaalsContact O-N 3.16Å; K16-E20 WeakPolarHBondContact CE-OE1 3.49Å; K16-E20 HydrophobicContact CG-CG 4.45Å; K16-E20 IonicContact NZ-OE1 2.59Å; K16-E20 WeakPolarHBondContact O-CG 3.37Å; K16-E20 PolarHBondContact O-N 3.05Å
17	R	92.9	Very high	88.1	Confident	156 Å²	156	115.1 Å²	115.1	59%	0.589	56%	0.555	S	S	*	*	H	α-helix	trans	-58.1	-38.1	177.2	-71.6	178.4	176	-169.9	-6.9	113.1	H13 K14 R21	H13-R17 PolarHBondContact CE1-NE 2.73Å; H13-R17 PolarHBondContact CE1-NH2 2.78Å; H13-R17 PolarHBondContact NE2-NE 3.36Å; H13-R17 WeakPolarHBondContact O-CG 3.46Å; H13-R17 PolarHBondContact O-N 2.74Å; K14-R17 PolarHBondContact O-N 3.19Å; R17-R21 WeakPolarHBondContact O-CB 3.44Å; R17-R21 PolarHBondContact O-N 3.34Å
18	V	91.5	Very high	89.5	Confident	49 Å²	49	115.2 Å²	115.2	30%	0.297	55%	0.553	S	S	.	*	H	α-helix	trans	-67.9	-42.8	177.4	172.1	0	0	0	0	111.3	K14 G15 K16 R21 R22	K14-V18 WeakPolarHBondContact O-CG2 3.45Å; K14-V18 PolarHBondContact O-N 2.9Å; K14-V18 VanDerWaalsContact O-N 3.1Å; G15-V18 PolarHBondContact O-N 2.83Å; K16-V18 VanDerWaalsContact C-N 3.29Å; K16-V18 PolarHBondContact O-N 2.72Å; V18-R21 PolarHBondContact O-N 2.88Å; V18-R22 WeakPolarHBondContact O-CG 3.05Å; V18-R22 PolarHBondContact O-N 2.65Å
19	L	90.3	Very high	90.6	Very high	86 Å²	86	108.4 Å²	108.4	45%	0.45	53%	0.533	S	S	.	.	H	α-helix	trans	-65.5	-43.4	176.9	-68.9	175.4	0	0	0	111.7	P10 G15 K16 R21 R22 A23	P10-L19 HydrophobicContact CB-CD1 3.97Å; P10-L19 HydrophobicContact CG-CD1 4.12Å; G15-L19 WeakPolarHBondContact O-CG 3.39Å; G15-L19 PolarHBondContact O-N 3.05Å; K16-L19 PolarHBondContact O-N 2.83Å; K16-L19 VanDerWaalsContact O-N 3.16Å; L19-R21 VanDerWaalsContact C-N 3.29Å; L19-R21 PolarHBondContact O-N 3.22Å; L19-R22 PolarHBondContact O-N 2.8Å; L19-R22 VanDerWaalsContact O-N 3.17Å; L19-A23 PolarHBondContact O-N 2.92Å
20	E	91.5	Very high	91.3	Very high	105 Å²	105	101.6 Å²	101.6	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-61.6	-37.1	175.4	-73	170.8	170.2	0	0	112	K16 R22	K16-E20 WeakPolarHBondContact CE-OE1 3.49Å; K16-E20 HydrophobicContact CG-CG 4.45Å; K16-E20 IonicContact NZ-OE1 2.59Å; K16-E20 WeakPolarHBondContact O-CG 3.37Å; K16-E20 PolarHBondContact O-N 3.05Å; E20-R22 VanDerWaalsContact C-N 3.31Å; E20-R22 PolarHBondContact O-N 3.08Å
21	R	92.2	Very high	91.9	Very high	128 Å²	128	101.5 Å²	101.5	48%	0.483	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-33.9	176.6	-172.3	179.2	68.4	178.6	2.9	112.8	R17 V18 L19 K25 N29	R17-R21 WeakPolarHBondContact O-CB 3.44Å; R17-R21 PolarHBondContact O-N 3.34Å; V18-R21 PolarHBondContact O-N 2.88Å; L19-R21 VanDerWaalsContact C-N 3.29Å; L19-R21 PolarHBondContact O-N 3.22Å; R21-K25 WeakPolarHBondContact O-CE 3.25Å; R21-K25 PolarHBondContact O-NZ 2.88Å; R21-N29 PolarHBondContact O-ND2 3.1Å
22	R	91.8	Very high	92.3	Very high	98 Å²	98	92.5 Å²	92.5	37%	0.37	46%	0.464	S	S	.	.	H	α-helix	trans	-84.6	-21.3	-179.4	-72.7	-177.5	175.7	-161.2	-4.5	113.8	V18 L19 E20 I83 K84 D86	V18-R22 WeakPolarHBondContact O-CG 3.05Å; V18-R22 PolarHBondContact O-N 2.65Å; L19-R22 PolarHBondContact O-N 2.8Å; L19-R22 VanDerWaalsContact O-N 3.17Å; E20-R22 VanDerWaalsContact C-N 3.31Å; E20-R22 PolarHBondContact O-N 3.08Å; R22-I83 PolarHBondContact NH1-O 2.92Å; R22-K84 PolarHBondContact NH1-O 3.47Å; R22-K84 PolarHBondContact NH2-O 2.9Å; R22-D86 HydrophobicContact CG-CB 4.24Å; R22-D86 WeakPolarHBondContact CG-OD2 3.4Å; R22-D86 IonicContact NE-OD2 3.54Å
23	A	91.5	Very high	92.5	Very high	47 Å²	47	88.5 Å²	88.5	39%	0.388	44%	0.439	S	S	.	.	S	Bend	trans	-59.5	150.6	178.7	0	0	0	0	0	110.7	L19 K25	L19-A23 PolarHBondContact O-N 2.92Å; A23-K25 WeakPolarHBondContact O-CG 3.5Å
24	P	92.7	Very high	92.8	Very high	134 Å²	134	82.8 Å²	82.8	87%	0.87	41%	0.413	S	S	*	.			trans	-54.3	140.3	174	-24.4	33.7	0	0	0	111.7
25	K	92.3	Very high	93.1	Very high	82 Å²	82	74.6 Å²	74.6	36%	0.357	38%	0.377	S	S	.	.			trans	-129.7	154.9	-177.6	-57.1	-176.9	-172.2	178.4	0	110.4	R21 A23 V27 N29	R21-K25 WeakPolarHBondContact O-CE 3.25Å; R21-K25 PolarHBondContact O-NZ 2.88Å; A23-K25 WeakPolarHBondContact O-CG 3.5Å; K25-V27 VanDerWaalsContact CB-O 3.22Å; K25-V27 WeakPolarHBondContact CB-O 3.1Å; K25-N29 PolarHBondContact NZ-ND2 2.97Å; K25-N29 PolarHBondContact NZ-OD1 2.84Å
26	L	91.2	Very high	93.4	Very high	96 Å²	96	73.4 Å²	73.4	50%	0.503	37%	0.365	S	S	.	.	S	Bend	trans	-65.3	-46.3	172.4	-174.8	67	0	0	0	111.4	P260 E262 V263	L26-P260 HydrophobicContact CD1-CB 3.59Å; L26-P260 HydrophobicContact CD1-CG 3.95Å; L26-E262 HydrophobicContact CD1-CB 4Å; L26-E262 HydrophobicContact CD2-CB 4.15Å; L26-V263 HydrophobicContact CD1-CG2 3.67Å; L26-V263 HydrophobicContact CD2-CG2 4.48Å; L26-V263 HydrophobicContact CG-CG2 4.01Å
27	V	90.5	Very high	93.6	Very high	116 Å²	116	70 Å²	70	70%	0.703	35%	0.35	S	S	*	.	S	Bend	trans	-102.7	110.8	169.5	-179	0	0	0	0	107.1	K25	K25-V27 VanDerWaalsContact CB-O 3.22Å; K25-V27 WeakPolarHBondContact CB-O 3.1Å
28	E	92.3	Very high	93.8	Very high	138 Å²	138	62.5 Å²	62.5	65%	0.645	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-66.8	156.2	-178.4	-60.7	-170.1	143.7	0	0	111.9
29	N	93.1	Very high	93.9	Very high	79 Å²	79	61.1 Å²	61.1	42%	0.422	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-76.2	165.8	168.1	-50.6	-45	0	0	0	110	R21 K25	R21-N29 PolarHBondContact O-ND2 3.1Å; K25-N29 PolarHBondContact NZ-ND2 2.97Å; K25-N29 PolarHBondContact NZ-OD1 2.84Å
30	D	94	Very high	94.1	Very high	47 Å²	47	64 Å²	64	25%	0.251	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-60.6	140.4	171.3	-64.2	-45.5	0	0	0	112.3	C32 L59 P170 T171	D30-C32 PolarHBondContact O-N 3.03Å; D30-C32 VanDerWaalsContact O-N 3.16Å; D30-L59 HydrophobicContact CB-CD1 3.66Å; D30-L59 HydrophobicContact CB-CD2 3.68Å; D30-L59 HydrophobicContact CB-CG 4.32Å; D30-P170 VanDerWaalsContact OD1-CA 3.3Å; D30-P170 WeakPolarHBondContact OD1-CA 3.32Å; D30-P170 WeakPolarHBondContact OD2-CA 3.38Å; D30-P170 VanDerWaalsContact OD2-CB 3.28Å; D30-P170 WeakPolarHBondContact OD2-CB 3.34Å; D30-T171 PolarHBondContact OD1-N 3.38Å; D30-T171 PolarHBondContact OD1-OG1 3.44Å
31	K	95	Very high	94.3	Very high	52 Å²	52	60 Å²	60	23%	0.226	31%	0.311	C	S	.	.			trans	-73	108.3	-175.6	-65.2	-172.6	-179.1	-178.1	0	111.7	S88 M89 D165	K31-S88 WeakPolarHBondContact CB-OG 3.39Å; K31-S88 WeakPolarHBondContact CG-OG 3.47Å; K31-M89 HydrophobicContact CB-CG 4.42Å; K31-M89 HydrophobicContact CB-SD 4.22Å; K31-M89 HydrophobicContact CD-SD 4.42Å; K31-D165 HydrophobicContact CD-CB 4.27Å; K31-D165 VanDerWaalsContact NZ-CG 3.28Å; K31-D165 IonicContact NZ-OD1 2.79Å; K31-D165 PolarHBondContact NZ-OD1 3.17Å; K31-D165 IonicContact NZ-OD2 3.93Å; K31-D165 PolarHBondContact NZ-OD2 2.94Å
32	C	96	Very high	94.5	Very high	23 Å²	23	54.8 Å²	54.8	16%	0.155	29%	0.294	C	S	.	.			trans	-74	144.4	172	-68.3	0	0	0	0	111.9	D30 L59 Y61 C87 S88 M89	D30-C32 PolarHBondContact O-N 3.03Å; D30-C32 VanDerWaalsContact O-N 3.16Å; C32-L59 WeakPolarHBondContact CA-O 3.32Å; C32-Y61 HydrophobicContact CB-CE2 4.43Å; C32-C87 HydrophobicContact CB-CB 4.43Å; C32-S88 PolarHBondContact O-N 3.41Å; C32-M89 PolarHBondContact O-N 2.84Å
33	T	97.4	Very high	94.7	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.2	177.5	-64	0	0	0	0	112.2	K56 L59 V60 Y61 M89 V91 L166	T33-K56 WeakPolarHBondContact OG1-CD 3.33Å; T33-K56 WeakPolarHBondContact OG1-CE 3.41Å; T33-K56 PolarHBondContact OG1-NZ 2.89Å; T33-L59 PolarHBondContact N-O 2.95Å; T33-V60 CarbonylContact O-C 3.57Å; T33-V60 WeakPolarHBondContact O-CA 3.09Å; T33-Y61 PolarHBondContact O-N 3.11Å; T33-M89 CarbonylContact C-O 3.53Å; T33-M89 WeakPolarHBondContact CA-O 3.39Å; T33-M89 HydrophobicContact CG2-CB 4.35Å; T33-M89 WeakPolarHBondContact OG1-CB 3.43Å; T33-V91 HydrophobicContact CG2-CG2 3.69Å; T33-L166 HydrophobicContact CG2-CD1 4.04Å
34	L	97.8	Very high	95	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	118	173.2	-174.4	64.4	0	0	0	110.9	I36 Y61 L63 M81 F85 C87 M89 F90 V91	L34-I36 HydrophobicContact CD2-CD1 3.91Å; L34-I36 HydrophobicContact CD2-CG1 4.09Å; L34-I36 HydrophobicContact CG-CD1 4.25Å; L34-I36 HydrophobicContact CG-CG1 3.92Å; L34-Y61 CarbonylContact C-O 3.58Å; L34-Y61 WeakPolarHBondContact CA-O 3.36Å; L34-L63 HydrophobicContact CD1-CD2 4.1Å; L34-L63 HydrophobicContact CD1-CG 4.09Å; L34-M81 HydrophobicContact CD2-CB 3.65Å; L34-F85 HydrophobicContact CD1-CB 4.31Å; L34-F85 HydrophobicContact CD1-CD2 4.03Å; L34-F85 HydrophobicContact CD1-CG 4.15Å; L34-F85 HydrophobicContact CD2-CD2 4.39Å; L34-C87 HydrophobicContact CB-CB 3.86Å; L34-M89 PolarHBondContact N-O 2.88Å; L34-F90 HydrophobicContact CB-CB 4.49Å; L34-F90 CarbonylContact O-C 3.57Å; L34-F90 WeakPolarHBondContact O-CA 3.23Å; L34-V91 PolarHBondContact O-N 2.76Å
35	V	98	Very high	95.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.9	175.9	176.4	0	0	0	0	110	L49 V60 Y61 R62 L63 V91	V35-L49 HydrophobicContact CG1-CB 4.15Å; V35-L49 HydrophobicContact CG1-CD1 4.09Å; V35-L49 HydrophobicContact CG1-CD2 3.87Å; V35-L49 HydrophobicContact CG1-CG 4.25Å; V35-V60 HydrophobicContact CG2-CG2 3.71Å; V35-Y61 PolarHBondContact N-O 3.46Å; V35-R62 HydrophobicContact CB-CB 4.29Å; V35-R62 HydrophobicContact CB-CG 4.25Å; V35-R62 HydrophobicContact CG1-CG 4.18Å; V35-R62 WeakPolarHBondContact O-CA 3.37Å; V35-L63 PolarHBondContact O-N 3Å; V35-V91 WeakPolarHBondContact CA-O 3.31Å; V35-V91 HydrophobicContact CG2-CB 4.44Å
36	I	97.5	Very high	95.4	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.9	-175.2	-51.9	177.5	0	0	0	109.6	L34 L63 N67 I69 I78 V91 V92 G93	L34-I36 HydrophobicContact CD2-CD1 3.91Å; L34-I36 HydrophobicContact CD2-CG1 4.09Å; L34-I36 HydrophobicContact CG-CD1 4.25Å; L34-I36 HydrophobicContact CG-CG1 3.92Å; I36-L63 HydrophobicContact CB-CD1 4.49Å; I36-L63 HydrophobicContact CD1-CD1 4.35Å; I36-L63 HydrophobicContact CG1-CD1 3.91Å; I36-L63 HydrophobicContact CG1-CG 4.34Å; I36-L63 HydrophobicContact CG2-CD1 4.14Å; I36-N67 HydrophobicContact CG2-CB 4.42Å; I36-I69 HydrophobicContact CB-CD1 4.45Å; I36-I69 HydrophobicContact CG2-CD1 3.6Å; I36-I78 HydrophobicContact CD1-CG1 4.16Å; I36-I78 HydrophobicContact CD1-CG2 4.25Å; I36-V91 PolarHBondContact N-O 3.43Å; I36-V92 HydrophobicContact CB-CG2 4.26Å; I36-V92 HydrophobicContact CD1-CG2 4.48Å; I36-V92 WeakPolarHBondContact O-CA 3.33Å; I36-G93 PolarHBondContact O-N 3.11Å
37	K	97.1	Very high	95.7	Very high	32 Å²	32	47.4 Å²	47.4	14%	0.139	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123.7	168.2	-64.4	-169.3	178.2	-161	0	109.2	T41 N46 L49 K66 N67	K37-T41 HydrophobicContact CB-CG2 4.36Å; K37-N46 WeakPolarHBondContact CE-OD1 3.27Å; K37-N46 PolarHBondContact NZ-OD1 2.85Å; K37-L49 HydrophobicContact CG-CD1 4.11Å; K37-K66 HydrophobicContact CB-CG 4.34Å; K37-N67 PolarHBondContact O-N 3.19Å
38	G	95.4	Very high	96	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.			trans	-67.6	-176.8	170.6	0	0	0	0	0	112.5	H40 N67 G93	G38-H40 PolarHBondContact O-N 3.01Å; G38-N67 CarbonylContact C-O 3.11Å; G38-N67 VanDerWaalsContact CA-O 3.22Å; G38-N67 WeakPolarHBondContact CA-O 3.41Å; G38-G93 WeakPolarHBondContact CA-O 3.41Å; G38-G93 PolarHBondContact N-O 3.05Å
39	G	93.6	Very high	96.2	Very high	19 Å²	19	35.7 Å²	35.7	20%	0.196	19%	0.185	C	C	.	.	S	Bend	trans	-62.1	-41.6	-178.1	0	0	0	0	0	112.9	N67	G39-N67 PolarHBondContact N-O 2.94Å
40	H	95.6	Very high	96.3	Very high	146 Å²	146	35.3 Å²	35.3	68%	0.676	18%	0.183	S	C	*	.	S	Bend	trans	-122.8	130.5	176.6	-62.4	-78.1	0	0	0	110	G38 M94 H95	G38-H40 PolarHBondContact O-N 3.01Å; H40-M94 CarbonylContact O-C 3.34Å; H40-M94 VanDerWaalsContact O-CA 3.28Å; H40-M94 WeakPolarHBondContact O-CA 3.16Å; H40-H95 WeakPolarHBondContact CB-O 3.13Å; H40-H95 PolarHBondContact O-N 2.93Å
41	T	96.2	Very high	96.3	Very high	23 Å²	23	34 Å²	34	14%	0.141	18%	0.177	C	C	.	.			trans	-137	136	175.8	58.5	0	0	0	0	109.6	K37 V45 N46 G93	K37-T41 HydrophobicContact CB-CG2 4.36Å; T41-V45 HydrophobicContact CG2-CG1 4.24Å; T41-N46 PolarHBondContact OG1-ND2 3.18Å; T41-N46 PolarHBondContact OG1-OD1 2.87Å; T41-G93 VanDerWaalsContact CG2-O 3.27Å; T41-G93 WeakPolarHBondContact CG2-O 3.49Å
42	S	96.2	Very high	96.3	Very high	17 Å²	17	31.9 Å²	31.9	12%	0.119	17%	0.167	C	C	.	.			trans	-78.1	162.2	169.8	50.6	0	0	0	0	111.4	I44 V45 N46 H95 H101	S42-I44 PolarHBondContact O-N 3.44Å; S42-V45 WeakPolarHBondContact O-CB 3.34Å; S42-V45 PolarHBondContact O-N 3.47Å; S42-V45 VanDerWaalsContact O-N 3.17Å; S42-V45 VanDerWaalsContact OG-CG2 3.25Å; S42-V45 WeakPolarHBondContact OG-CG2 3.17Å; S42-N46 PolarHBondContact O-N 2.86Å; S42-N46 PolarHBondContact O-ND2 2.74Å; S42-N46 VanDerWaalsContact O-ND2 3.11Å; S42-H95 WeakPolarHBondContact CB-ND1 3.44Å; S42-H95 PolarHBondContact OG-ND1 3.1Å; S42-H101 WeakPolarHBondContact CB-ND1 3.39Å; S42-H101 PolarHBondContact OG-ND1 2.79Å
43	E	96	Very high	96.2	Very high	159 Å²	159	31.4 Å²	31.4	74%	0.743	16%	0.164	S	C	*	.	H	α-helix	trans	-54.7	-50.7	174.3	-173.7	165.7	-167.9	0	0	112.9	V45 N46 T47	E43-V45 PolarHBondContact O-N 2.81Å; E43-V45 VanDerWaalsContact O-N 3.14Å; E43-N46 CarbonylContact O-C 3.6Å; E43-N46 WeakPolarHBondContact O-CA 3.49Å; E43-N46 WeakPolarHBondContact O-CB 3.45Å; E43-N46 PolarHBondContact O-N 3.1Å; E43-T47 PolarHBondContact O-N 3Å; E43-T47 PolarHBondContact O-OG1 2.79Å
44	I	96.7	Very high	96	Very high	68 Å²	68	32.8 Å²	32.8	35%	0.349	18%	0.176	S	C	.	.	H	α-helix	trans	-50.5	-43.5	176.3	-64.3	172.1	0	0	0	112.1	S42 T47 F48 I121 Y124	S42-I44 PolarHBondContact O-N 3.44Å; I44-T47 PolarHBondContact O-N 2.82Å; I44-F48 WeakPolarHBondContact O-CB 3.49Å; I44-F48 PolarHBondContact O-N 2.89Å; I44-I121 HydrophobicContact CG2-CD1 4.42Å; I44-I121 HydrophobicContact CG2-CG2 4.05Å; I44-Y124 HydrophobicContact CG2-CD1 4.09Å; I44-Y124 HydrophobicContact CG2-CG 4.26Å
45	V	97	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.3	-42	177.7	165.9	0	0	0	0	110.9	T41 S42 E43 F48 L49 H101 I103 I121	T41-V45 HydrophobicContact CG2-CG1 4.24Å; S42-V45 WeakPolarHBondContact O-CB 3.34Å; S42-V45 PolarHBondContact O-N 3.47Å; S42-V45 VanDerWaalsContact O-N 3.17Å; S42-V45 VanDerWaalsContact OG-CG2 3.25Å; S42-V45 WeakPolarHBondContact OG-CG2 3.17Å; E43-V45 PolarHBondContact O-N 2.81Å; E43-V45 VanDerWaalsContact O-N 3.14Å; V45-F48 PolarHBondContact O-N 2.77Å; V45-L49 HydrophobicContact CG1-CD1 4.28Å; V45-L49 HydrophobicContact CG1-CG 4.37Å; V45-L49 WeakPolarHBondContact O-CB 3.25Å; V45-L49 VanDerWaalsContact O-CG 3.24Å; V45-L49 WeakPolarHBondContact O-CG 3.48Å; V45-L49 PolarHBondContact O-N 2.82Å; V45-H101 VanDerWaalsContact CG2-CA 3.5Å; V45-H101 HydrophobicContact CG2-CB 4.01Å; V45-I103 HydrophobicContact CG1-CD1 3.83Å; V45-I103 HydrophobicContact CG2-CD1 4.38Å; V45-I121 HydrophobicContact CG2-CD1 4.24Å
46	N	96.4	Very high	95.4	Very high	35 Å²	35	35 Å²	35	19%	0.187	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-42.4	177.5	-70.1	-54.4	0	0	0	111.6	K37 T41 S42 E43 L49 N50	K37-N46 WeakPolarHBondContact CE-OD1 3.27Å; K37-N46 PolarHBondContact NZ-OD1 2.85Å; T41-N46 PolarHBondContact OG1-ND2 3.18Å; T41-N46 PolarHBondContact OG1-OD1 2.87Å; S42-N46 PolarHBondContact O-N 2.86Å; S42-N46 PolarHBondContact O-ND2 2.74Å; S42-N46 VanDerWaalsContact O-ND2 3.11Å; E43-N46 CarbonylContact O-C 3.6Å; E43-N46 WeakPolarHBondContact O-CA 3.49Å; E43-N46 WeakPolarHBondContact O-CB 3.45Å; E43-N46 PolarHBondContact O-N 3.1Å; N46-L49 PolarHBondContact O-N 2.85Å; N46-N50 PolarHBondContact O-N 2.79Å; N46-N50 PolarHBondContact O-ND2 2.81Å
47	T	97	Very high	95.1	Very high	40 Å²	40	41.8 Å²	41.8	25%	0.245	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-46.9	176.6	-49.7	0	0	0	0	110.8	E43 I44 L49 N50 D51 Y124 P126	E43-T47 PolarHBondContact O-N 3Å; E43-T47 PolarHBondContact O-OG1 2.79Å; I44-T47 PolarHBondContact O-N 2.82Å; T47-L49 VanDerWaalsContact C-N 3.35Å; T47-L49 PolarHBondContact O-N 3.14Å; T47-N50 WeakPolarHBondContact O-CB 3.22Å; T47-N50 PolarHBondContact O-N 3.18Å; T47-N50 VanDerWaalsContact O-N 3.11Å; T47-D51 PolarHBondContact O-N 2.91Å; T47-Y124 HydrophobicContact CG2-CE1 4.06Å; T47-P126 HydrophobicContact CG2-CB 3.61Å; T47-P126 HydrophobicContact CG2-CG 4.39Å
48	F	97.2	Very high	94.8	Very high	8 Å²	8	45.7 Å²	45.7	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-56.5	-45.5	174.1	-178.7	-91	0	0	0	112.7	I44 V45 N50 D51 L52 I103 F105 I121 Y124 A238 F240	I44-F48 WeakPolarHBondContact O-CB 3.49Å; I44-F48 PolarHBondContact O-N 2.89Å; V45-F48 PolarHBondContact O-N 2.77Å; F48-N50 VanDerWaalsContact C-N 3.31Å; F48-N50 PolarHBondContact O-N 2.98Å; F48-D51 PolarHBondContact O-N 3.29Å; F48-L52 HydrophobicContact CE1-CD2 4.45Å; F48-L52 WeakPolarHBondContact O-CB 3.39Å; F48-L52 PolarHBondContact O-N 2.81Å; F48-I103 HydrophobicContact CD1-CD1 3.75Å; F48-I103 HydrophobicContact CD1-CG1 3.87Å; F48-I103 HydrophobicContact CE1-CD1 4.23Å; F48-I103 HydrophobicContact CE1-CG1 4.02Å; F48-I103 HydrophobicContact CE1-CG2 4.16Å; F48-F105 HydrophobicContact CE1-CE1 4.42Å; F48-F105 HydrophobicContact CE1-CZ 4.16Å; F48-F105 HydrophobicContact CZ-CZ 4.16Å; F48-I121 HydrophobicContact CB-CD1 3.69Å; F48-I121 HydrophobicContact CD1-CD1 4.04Å; F48-I121 HydrophobicContact CD2-CD1 4.02Å; F48-I121 HydrophobicContact CG-CD1 3.63Å; F48-Y124 WeakPolarHBondContact CA-OH 3.28Å; F48-Y124 HydrophobicContact CB-CE1 4.19Å; F48-Y124 HydrophobicContact CB-CE2 4.41Å; F48-Y124 HydrophobicContact CD2-CD2 4Å; F48-Y124 AromaticContact CD2-CE2 3.49Å; F48-Y124 HydrophobicContact CD2-CE2 3.49Å; F48-Y124 VanDerWaalsContact CD2-CE2 3.49Å; F48-Y124 AromaticContact CD2-CZ 3.88Å; F48-Y124 HydrophobicContact CE2-CE2 4.26Å; F48-Y124 HydrophobicContact CG-CE2 4.44Å; F48-A238 HydrophobicContact CE2-CB 4.49Å; F48-F240 HydrophobicContact CE2-CE1 4.01Å; F48-F240 AromaticContact CE2-CZ 3.7Å; F48-F240 HydrophobicContact CE2-CZ 3.7Å; F48-F240 HydrophobicContact CZ-CE1 4.04Å; F48-F240 AromaticContact CZ-CZ 3.81Å; F48-F240 HydrophobicContact CZ-CZ 3.81Å
49	L	96.8	Very high	94.8	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.3	-35.3	177.7	-71.9	-175.7	0	0	0	112.5	V35 K37 V45 N46 T47 C53 V91 I103	V35-L49 HydrophobicContact CG1-CB 4.15Å; V35-L49 HydrophobicContact CG1-CD1 4.09Å; V35-L49 HydrophobicContact CG1-CD2 3.87Å; V35-L49 HydrophobicContact CG1-CG 4.25Å; K37-L49 HydrophobicContact CG-CD1 4.11Å; V45-L49 HydrophobicContact CG1-CD1 4.28Å; V45-L49 HydrophobicContact CG1-CG 4.37Å; V45-L49 WeakPolarHBondContact O-CB 3.25Å; V45-L49 VanDerWaalsContact O-CG 3.24Å; V45-L49 WeakPolarHBondContact O-CG 3.48Å; V45-L49 PolarHBondContact O-N 2.82Å; N46-L49 PolarHBondContact O-N 2.85Å; T47-L49 VanDerWaalsContact C-N 3.35Å; T47-L49 PolarHBondContact O-N 3.14Å; L49-C53 PolarHBondContact O-N 2.9Å; L49-C53 PolarHBondContact O-SG 3.47Å; L49-V91 HydrophobicContact CD2-CG1 3.69Å; L49-I103 HydrophobicContact CD2-CD1 3.97Å; L49-I103 HydrophobicContact CG-CD1 4.35Å
50	N	95.3	Very high	94.9	Very high	71 Å²	71	47.1 Å²	47.1	38%	0.38	25%	0.248	S	C	.	.	H	α-helix	trans	-68.4	-44.6	176.3	-69.8	-23.3	0	0	0	111.1	N46 T47 F48 C53 A54	N46-N50 PolarHBondContact O-N 2.79Å; N46-N50 PolarHBondContact O-ND2 2.81Å; T47-N50 WeakPolarHBondContact O-CB 3.22Å; T47-N50 PolarHBondContact O-N 3.18Å; T47-N50 VanDerWaalsContact O-N 3.11Å; F48-N50 VanDerWaalsContact C-N 3.31Å; F48-N50 PolarHBondContact O-N 2.98Å; N50-C53 WeakPolarHBondContact O-CB 3.36Å; N50-C53 PolarHBondContact O-N 3.22Å; N50-A54 PolarHBondContact O-N 3.48Å
51	D	94.8	Very high	94.9	Very high	21 Å²	21	45 Å²	45	11%	0.112	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-43.1	178.3	-71.2	-9	0	0	0	110.7	T47 F48 C53 A54 L55 Y124 P126 I127	T47-D51 PolarHBondContact O-N 2.91Å; F48-D51 PolarHBondContact O-N 3.29Å; D51-C53 VanDerWaalsContact C-N 3.28Å; D51-C53 PolarHBondContact O-N 3.3Å; D51-A54 WeakPolarHBondContact O-CA 3.3Å; D51-A54 WeakPolarHBondContact O-CB 3.47Å; D51-A54 PolarHBondContact O-N 3.33Å; D51-L55 WeakPolarHBondContact O-CG 3.37Å; D51-L55 PolarHBondContact O-N 2.94Å; D51-Y124 WeakPolarHBondContact CB-OH 3.46Å; D51-Y124 VanDerWaalsContact CG-OH 3.32Å; D51-Y124 PolarHBondContact OD2-OH 3.2Å; D51-P126 VanDerWaalsContact OD2-CA 3.23Å; D51-P126 WeakPolarHBondContact OD2-CA 3.22Å; D51-P126 VanDerWaalsContact OD2-CB 3.3Å; D51-P126 WeakPolarHBondContact OD2-CB 3.39Å; D51-I127 HydrophobicContact CB-CD1 3.58Å; D51-I127 HydrophobicContact CB-CG1 3.91Å; D51-I127 PolarHBondContact OD2-N 2.81Å
52	L	94.7	Very high	94.9	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-58.2	-40.6	172.4	-176.6	68.3	0	0	0	112.1	F48 A54 L55 K56 V91 F105 F167	F48-L52 HydrophobicContact CE1-CD2 4.45Å; F48-L52 WeakPolarHBondContact O-CB 3.39Å; F48-L52 PolarHBondContact O-N 2.81Å; L52-A54 VanDerWaalsContact C-N 3.32Å; L52-L55 PolarHBondContact O-N 2.87Å; L52-K56 WeakPolarHBondContact O-CB 3.34Å; L52-K56 PolarHBondContact O-N 3.31Å; L52-V91 HydrophobicContact CD2-CB 4.11Å; L52-V91 HydrophobicContact CD2-CG1 3.91Å; L52-V91 HydrophobicContact CD2-CG2 3.67Å; L52-F105 HydrophobicContact CD2-CE1 4.3Å; L52-F167 HydrophobicContact CD1-CE1 3.61Å; L52-F167 HydrophobicContact CD1-CZ 3.8Å
53	C	94.2	Very high	94.9	Very high	13 Å²	13	50.4 Å²	50.4	9%	0.088	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-39.6	173.7	-69.4	0	0	0	0	111.4	L49 N50 D51 K56 K57 V60	L49-C53 PolarHBondContact O-N 2.9Å; L49-C53 PolarHBondContact O-SG 3.47Å; N50-C53 WeakPolarHBondContact O-CB 3.36Å; N50-C53 PolarHBondContact O-N 3.22Å; D51-C53 VanDerWaalsContact C-N 3.28Å; D51-C53 PolarHBondContact O-N 3.3Å; C53-K56 PolarHBondContact O-N 3.03Å; C53-K57 WeakPolarHBondContact O-CG 3.06Å; C53-K57 PolarHBondContact O-N 3.46Å; C53-V60 HydrophobicContact CB-CG1 4.45Å; C53-V60 WeakPolarHBondContact O-CG1 3.49Å
54	A	91.9	Very high	94.8	Very high	31 Å²	31	51.1 Å²	51.1	26%	0.256	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-46.3	176.9	0	0	0	0	0	111.5	N50 D51 L52 K56 I127	N50-A54 PolarHBondContact O-N 3.48Å; D51-A54 WeakPolarHBondContact O-CA 3.3Å; D51-A54 WeakPolarHBondContact O-CB 3.47Å; D51-A54 PolarHBondContact O-N 3.33Å; L52-A54 VanDerWaalsContact C-N 3.32Å; A54-K56 VanDerWaalsContact C-N 3.28Å; A54-K56 PolarHBondContact O-N 3.4Å; A54-I127 HydrophobicContact CB-CD1 4.19Å
55	L	91.7	Very high	94.6	Very high	25 Å²	25	56.9 Å²	56.9	13%	0.131	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-36.1	177.6	-65.8	-177.5	0	0	0	113	D51 L52 I127 Y137 F167 F184 P236	D51-L55 WeakPolarHBondContact O-CG 3.37Å; D51-L55 PolarHBondContact O-N 2.94Å; L52-L55 PolarHBondContact O-N 2.87Å; L55-I127 HydrophobicContact CD2-CD1 4.18Å; L55-I127 HydrophobicContact CG-CD1 4.33Å; L55-Y137 HydrophobicContact CD2-CD1 3.28Å; L55-Y137 HydrophobicContact CD2-CE1 4.04Å; L55-Y137 HydrophobicContact CD2-CG 3.97Å; L55-F167 HydrophobicContact CD1-CE1 4.24Å; L55-F184 HydrophobicContact CD1-CE1 4.41Å; L55-F184 HydrophobicContact CD1-CZ 3.95Å; L55-F184 HydrophobicContact CD2-CE1 4.46Å; L55-F184 HydrophobicContact CD2-CZ 4.02Å; L55-F184 HydrophobicContact CG-CZ 4.44Å; L55-P236 HydrophobicContact CD1-CG 3.9Å
56	K	92.2	Very high	94.5	Very high	22 Å²	22	63.2 Å²	63.2	10%	0.096	30%	0.297	C	S	.	.	H	α-helix	trans	-97.7	-1	-171.7	-165.7	156.5	-177.7	150.8	0	114.7	T33 L52 C53 A54 L59 V60 L166	T33-K56 WeakPolarHBondContact OG1-CD 3.33Å; T33-K56 WeakPolarHBondContact OG1-CE 3.41Å; T33-K56 PolarHBondContact OG1-NZ 2.89Å; L52-K56 WeakPolarHBondContact O-CB 3.34Å; L52-K56 PolarHBondContact O-N 3.31Å; C53-K56 PolarHBondContact O-N 3.03Å; A54-K56 VanDerWaalsContact C-N 3.28Å; A54-K56 PolarHBondContact O-N 3.4Å; K56-L59 WeakPolarHBondContact CE-O 2.85Å; K56-L59 HydrophobicContact CG-CB 4.29Å; K56-L59 CarbonylContact O-C 3.57Å; K56-L59 WeakPolarHBondContact O-CA 3.48Å; K56-L59 PolarHBondContact O-N 3.14Å; K56-V60 HydrophobicContact CB-CB 4.04Å; K56-V60 HydrophobicContact CB-CG1 4.3Å; K56-V60 HydrophobicContact CG-CB 4.08Å; K56-L166 HydrophobicContact CD-CD1 4.39Å; K56-L166 PolarHBondContact NZ-O 3.28Å
57	K	90.6	Very high	94.4	Very high	142 Å²	142	62.9 Å²	62.9	62%	0.617	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	134.5	173.4	-86.1	168.3	-175.1	-177.8	0	110.1	C53 V60	C53-K57 WeakPolarHBondContact O-CG 3.06Å; C53-K57 PolarHBondContact O-N 3.46Å; K57-V60 HydrophobicContact CG-CG1 4.27Å
58	P	92.2	Very high	94.3	Very high	114 Å²	114	72.7 Å²	72.7	74%	0.74	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	cis	-93.1	1.8	4.3	37.1	-36.1	0	0	0	115.2	V60	P58-V60 PolarHBondContact O-N 2.92Å
59	L	94	Very high	94.1	Very high	26 Å²	26	73 Å²	73	14%	0.136	33%	0.33	C	S	.	.	S	Bend	trans	-83.3	36.5	-172.2	-59	173.3	0	0	0	113.5	D30 C32 T33 K56	D30-L59 HydrophobicContact CB-CD1 3.66Å; D30-L59 HydrophobicContact CB-CD2 3.68Å; D30-L59 HydrophobicContact CB-CG 4.32Å; C32-L59 WeakPolarHBondContact CA-O 3.32Å; T33-L59 PolarHBondContact N-O 2.95Å; K56-L59 WeakPolarHBondContact CE-O 2.85Å; K56-L59 HydrophobicContact CG-CB 4.29Å; K56-L59 CarbonylContact O-C 3.57Å; K56-L59 WeakPolarHBondContact O-CA 3.48Å; K56-L59 PolarHBondContact O-N 3.14Å
60	V	95.7	Very high	94	Very high	22 Å²	22	77.3 Å²	77.3	13%	0.133	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	135.8	-175.4	65.1	0	0	0	0	111.6	T33 V35 C53 K56 K57 P58	T33-V60 CarbonylContact O-C 3.57Å; T33-V60 WeakPolarHBondContact O-CA 3.09Å; V35-V60 HydrophobicContact CG2-CG2 3.71Å; C53-V60 HydrophobicContact CB-CG1 4.45Å; C53-V60 WeakPolarHBondContact O-CG1 3.49Å; K56-V60 HydrophobicContact CB-CB 4.04Å; K56-V60 HydrophobicContact CB-CG1 4.3Å; K56-V60 HydrophobicContact CG-CB 4.08Å; K57-V60 HydrophobicContact CG-CG1 4.27Å; P58-V60 PolarHBondContact O-N 2.92Å
61	Y	96.7	Very high	94	Very high	103 Å²	103	74 Å²	74	40%	0.404	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.2	170.4	-67.1	-78.2	0	0	0	109.2	C32 T33 L34 V35 F85	C32-Y61 HydrophobicContact CB-CE2 4.43Å; T33-Y61 PolarHBondContact O-N 3.11Å; L34-Y61 CarbonylContact C-O 3.58Å; L34-Y61 WeakPolarHBondContact CA-O 3.36Å; V35-Y61 PolarHBondContact N-O 3.46Å; Y61-F85 HydrophobicContact CG-CD1 4.44Å
62	R	96.4	Very high	94	Very high	133 Å²	133	75.7 Å²	75.7	50%	0.502	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.3	178.8	-177.3	169.5	64.2	107.4	-6.1	110.3	V35	V35-R62 HydrophobicContact CB-CB 4.29Å; V35-R62 HydrophobicContact CB-CG 4.25Å; V35-R62 HydrophobicContact CG1-CG 4.18Å; V35-R62 WeakPolarHBondContact O-CA 3.37Å
63	L	96.2	Very high	94	Very high	19 Å²	19	82.5 Å²	82.5	10%	0.099	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.4	170.4	-63.9	-172.8	0	0	0	109.8	L34 V35 I36 F77 M81 F85	L34-L63 HydrophobicContact CD1-CD2 4.1Å; L34-L63 HydrophobicContact CD1-CG 4.09Å; V35-L63 PolarHBondContact O-N 3Å; I36-L63 HydrophobicContact CB-CD1 4.49Å; I36-L63 HydrophobicContact CD1-CD1 4.35Å; I36-L63 HydrophobicContact CG1-CD1 3.91Å; I36-L63 HydrophobicContact CG1-CG 4.34Å; I36-L63 HydrophobicContact CG2-CD1 4.14Å; L63-F77 HydrophobicContact CD1-CE1 4.23Å; L63-F77 HydrophobicContact CD1-CZ 4.4Å; L63-M81 HydrophobicContact CD1-CG 4.33Å; L63-F85 HydrophobicContact CD2-CD2 4.15Å; L63-F85 HydrophobicContact CD2-CE2 3.4Å; L63-F85 VanDerWaalsContact CD2-CE2 3.4Å; L63-F85 HydrophobicContact CD2-CZ 3.77Å
64	K	93.1	Very high	94.1	Very high	175 Å²	175	86 Å²	86	76%	0.761	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	-39.6	-178.7	-177.1	179.3	179.1	-178	0	112.2
65	W	93.6	Very high	94.2	Very high	189 Å²	189	86.3 Å²	86.3	72%	0.716	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	154.8	-169.7	-54.9	81.7	0	0	0	111.8	N67	W65-N67 PolarHBondContact O-ND2 2.87Å
66	K	94.5	Very high	94.3	Very high	132 Å²	132	87.4 Å²	87.4	57%	0.574	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	139.8	169.8	-67.6	-179.4	177.2	178.5	0	109.4	K37	K37-K66 HydrophobicContact CB-CG 4.34Å
67	N	94.6	Very high	94.5	Very high	29 Å²	29	89.1 Å²	89.1	16%	0.155	41%	0.405	C	S	.	.			trans	-123.1	128.6	-178.5	-52.5	-81.4	0	0	0	108.7	I36 K37 G38 G39 W65 I69 F77	I36-N67 HydrophobicContact CG2-CB 4.42Å; K37-N67 PolarHBondContact O-N 3.19Å; G38-N67 CarbonylContact C-O 3.11Å; G38-N67 VanDerWaalsContact CA-O 3.22Å; G38-N67 WeakPolarHBondContact CA-O 3.41Å; G39-N67 PolarHBondContact N-O 2.94Å; W65-N67 PolarHBondContact O-ND2 2.87Å; N67-I69 VanDerWaalsContact C-N 3.3Å; N67-I69 HydrophobicContact CB-CG2 4Å; N67-I69 PolarHBondContact O-N 2.88Å; N67-F77 HydrophobicContact CB-CE1 3.87Å; N67-F77 HydrophobicContact CB-CZ 3.99Å; N67-F77 WeakPolarHBondContact OD1-CZ 3.27Å
68	R	93.8	Very high	94.8	Very high	246 Å²	246	82.4 Å²	82.4	93%	0.928	38%	0.376	S	S	*	.			trans	-76.7	86.8	174.1	-66.9	-176.6	178.9	-176.8	0	108.2
69	I	94.1	Very high	95	Very high	14 Å²	14	79.2 Å²	79.2	7%	0.072	35%	0.352	C	S	.	.			trans	-124.9	145.8	-178.5	57.6	171.7	0	0	0	110.5	I36 N67 F77 I78 V92 M94	I36-I69 HydrophobicContact CB-CD1 4.45Å; I36-I69 HydrophobicContact CG2-CD1 3.6Å; N67-I69 VanDerWaalsContact C-N 3.3Å; N67-I69 HydrophobicContact CB-CG2 4Å; N67-I69 PolarHBondContact O-N 2.88Å; I69-F77 HydrophobicContact CG2-CB 4.11Å; I69-F77 HydrophobicContact CG2-CD1 3.56Å; I69-F77 HydrophobicContact CG2-CE1 4.18Å; I69-F77 HydrophobicContact CG2-CG 3.91Å; I69-I78 HydrophobicContact CD1-CD1 4.13Å; I69-I78 HydrophobicContact CD1-CG1 4.1Å; I69-V92 HydrophobicContact CD1-CG1 3.66Å; I69-V92 HydrophobicContact CD1-CG2 3.97Å; I69-V92 HydrophobicContact CG1-CG1 4.23Å; I69-M94 WeakPolarHBondContact O-CE 3.21Å
70	L	94.7	Very high	95.1	Very high	90 Å²	90	85 Å²	85	47%	0.471	38%	0.376	S	S	.	.			trans	-127.1	89.2	175.6	-68.8	166.9	0	0	0	107.1	F72 E73 D74 M94	L70-F72 PolarHBondContact O-N 2.62Å; L70-E73 HydrophobicContact CB-CB 4.03Å; L70-E73 HydrophobicContact CB-CG 4.27Å; L70-E73 VanDerWaalsContact CD1-OE2 3.23Å; L70-E73 WeakPolarHBondContact CD1-OE2 3.46Å; L70-E73 PolarHBondContact O-N 3.45Å; L70-D74 PolarHBondContact O-N 2.77Å; L70-M94 HydrophobicContact CD2-CE 4.04Å
71	P	94.8	Very high	95.1	Very high	2 Å²	2	86 Å²	86	1%	0.013	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.9	-166.9	-26.2	35.1	0	0	0	115.2	E73 L75 I78 V92 M94 I104 M116	P71-E73 VanDerWaalsContact C-N 3.35Å; P71-L75 HydrophobicContact CB-CD2 4.37Å; P71-L75 WeakPolarHBondContact O-CD2 3.45Å; P71-L75 VanDerWaalsContact O-CG 3.25Å; P71-L75 WeakPolarHBondContact O-CG 3.26Å; P71-I78 HydrophobicContact CB-CD1 3.83Å; P71-I78 HydrophobicContact CG-CD1 3.87Å; P71-V92 HydrophobicContact CG-CB 4.28Å; P71-V92 HydrophobicContact CG-CG1 4.18Å; P71-V92 HydrophobicContact CG-CG2 4.08Å; P71-M94 HydrophobicContact CG-SD 4.29Å; P71-I104 HydrophobicContact CB-CD1 4.12Å; P71-I104 HydrophobicContact CG-CD1 3.71Å; P71-M116 HydrophobicContact CB-SD 3.76Å; P71-M116 WeakPolarHBondContact O-CE 3.34Å
72	F	95.1	Very high	95.1	Very high	57 Å²	57	81.1 Å²	81.1	25%	0.25	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-5.2	176.8	-76.2	-90.7	0	0	0	113.7	L70 I104 M116 E118 R244	L70-F72 PolarHBondContact O-N 2.62Å; F72-I104 HydrophobicContact CD2-CD1 4.24Å; F72-I104 HydrophobicContact CE2-CD1 4Å; F72-I104 HydrophobicContact CE2-CG1 4.26Å; F72-I104 HydrophobicContact CE2-CG2 4.37Å; F72-M116 HydrophobicContact CD1-CE 3.63Å; F72-M116 HydrophobicContact CD2-CE 3.94Å; F72-M116 HydrophobicContact CE1-CE 3.62Å; F72-M116 HydrophobicContact CE2-CE 3.93Å; F72-M116 HydrophobicContact CE2-SD 4.27Å; F72-M116 HydrophobicContact CG-CE 3.8Å; F72-M116 HydrophobicContact CZ-CE 3.77Å; F72-M116 HydrophobicContact CZ-CG 4.27Å; F72-M116 HydrophobicContact CZ-SD 4.41Å; F72-E118 HydrophobicContact CE2-CB 3.78Å; F72-E118 HydrophobicContact CE2-CG 4.31Å; F72-E118 HydrophobicContact CZ-CB 3.82Å; F72-R244 HydrophobicContact CD1-CB 4.1Å; F72-R244 VanDerWaalsContact CD2-CZ 3.45Å; F72-R244 HydrophobicContact CE1-CB 3.43Å; F72-R244 VanDerWaalsContact CE1-CB 3.43Å; F72-R244 HydrophobicContact CE1-CG 4.49Å; F72-R244 HydrophobicContact CE2-CB 4.14Å; F72-R244 HydrophobicContact CZ-CB 3.45Å; F72-R244 VanDerWaalsContact CZ-CB 3.45Å
73	E	94.7	Very high	95	Very high	149 Å²	149	79.6 Å²	79.6	70%	0.696	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-48.6	179.8	-66	173.3	-151.8	0	0	110.6	L70 P71	L70-E73 HydrophobicContact CB-CB 4.03Å; L70-E73 HydrophobicContact CB-CG 4.27Å; L70-E73 VanDerWaalsContact CD1-OE2 3.23Å; L70-E73 WeakPolarHBondContact CD1-OE2 3.46Å; L70-E73 PolarHBondContact O-N 3.45Å; P71-E73 VanDerWaalsContact C-N 3.35Å
74	D	94.8	Very high	94.9	Very high	87 Å²	87	85.2 Å²	85.2	47%	0.465	39%	0.385	S	S	.	.			trans	-138.8	124.4	175.5	179.1	27.2	0	0	0	111.5	L70 S76	L70-D74 PolarHBondContact O-N 2.77Å; D74-S76 WeakPolarHBondContact OD1-CB 3.49Å; D74-S76 PolarHBondContact OD1-N 2.99Å; D74-S76 PolarHBondContact OD1-OG 2.69Å
75	L	94.3	Very high	95	Very high	36 Å²	36	80 Å²	80	19%	0.188	36%	0.362	C	S	.	.			trans	-101.2	-10.3	179.9	-70.1	157.5	0	0	0	112.9	P71 F77 I78 E79 L113 M116	P71-L75 HydrophobicContact CB-CD2 4.37Å; P71-L75 WeakPolarHBondContact O-CD2 3.45Å; P71-L75 VanDerWaalsContact O-CG 3.25Å; P71-L75 WeakPolarHBondContact O-CG 3.26Å; L75-F77 PolarHBondContact O-N 2.74Å; L75-F77 VanDerWaalsContact O-N 3.1Å; L75-I78 HydrophobicContact CD2-CD1 4.3Å; L75-I78 WeakPolarHBondContact O-CA 3.28Å; L75-I78 WeakPolarHBondContact O-CB 3.38Å; L75-I78 PolarHBondContact O-N 2.68Å; L75-E79 HydrophobicContact CB-CG 4.41Å; L75-E79 PolarHBondContact O-N 3.2Å; L75-L113 HydrophobicContact CD1-CB 3.94Å; L75-L113 HydrophobicContact CD1-CD2 3.35Å; L75-L113 HydrophobicContact CD1-CG 4.17Å; L75-L113 HydrophobicContact CD2-CD2 4.17Å; L75-L113 HydrophobicContact CG-CD2 4.4Å; L75-M116 HydrophobicContact CD2-CE 4.39Å; L75-M116 HydrophobicContact CD2-SD 4.15Å
76	S	95.1	Very high	95.1	Very high	49 Å²	49	73.7 Å²	73.7	34%	0.343	34%	0.342	S	S	.	.	H	α-helix	trans	-53.9	-40.2	-170.4	-56.9	0	0	0	0	112.8	D74 K80	D74-S76 WeakPolarHBondContact OD1-CB 3.49Å; D74-S76 PolarHBondContact OD1-N 2.99Å; D74-S76 PolarHBondContact OD1-OG 2.69Å; S76-K80 WeakPolarHBondContact O-CB 3.33Å; S76-K80 WeakPolarHBondContact O-CD 3.5Å; S76-K80 WeakPolarHBondContact O-CG 2.88Å; S76-K80 PolarHBondContact O-N 2.81Å; S76-K80 VanDerWaalsContact O-N 3.08Å
77	F	95.7	Very high	95.2	Very high	57 Å²	57	67.8 Å²	67.8	25%	0.25	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-43.5	177.1	178.6	-90.6	0	0	0	112.3	L63 N67 I69 L75 M81	L63-F77 HydrophobicContact CD1-CE1 4.23Å; L63-F77 HydrophobicContact CD1-CZ 4.4Å; N67-F77 HydrophobicContact CB-CE1 3.87Å; N67-F77 HydrophobicContact CB-CZ 3.99Å; N67-F77 WeakPolarHBondContact OD1-CZ 3.27Å; I69-F77 HydrophobicContact CG2-CB 4.11Å; I69-F77 HydrophobicContact CG2-CD1 3.56Å; I69-F77 HydrophobicContact CG2-CE1 4.18Å; I69-F77 HydrophobicContact CG2-CG 3.91Å; L75-F77 PolarHBondContact O-N 2.74Å; L75-F77 VanDerWaalsContact O-N 3.1Å; F77-M81 HydrophobicContact CD1-CG 4.2Å; F77-M81 HydrophobicContact CD2-CE 4.29Å; F77-M81 HydrophobicContact CE1-CG 3.77Å; F77-M81 HydrophobicContact CE2-CE 3.5Å; F77-M81 VanDerWaalsContact CE2-CE 3.5Å; F77-M81 HydrophobicContact CE2-CG 4.16Å; F77-M81 HydrophobicContact CZ-CE 3.7Å; F77-M81 HydrophobicContact CZ-CG 3.75Å; F77-M81 HydrophobicContact CZ-SD 4.43Å; F77-M81 WeakPolarHBondContact O-CB 3.31Å; F77-M81 VanDerWaalsContact O-CG 3.3Å; F77-M81 WeakPolarHBondContact O-CG 3.42Å; F77-M81 PolarHBondContact O-N 2.78Å
78	I	96.5	Very high	95.2	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-47.2	-178	-60.8	176.7	0	0	0	109.3	I36 I69 P71 L75 K80 M81 C82 F90 V92	I36-I78 HydrophobicContact CD1-CG1 4.16Å; I36-I78 HydrophobicContact CD1-CG2 4.25Å; I69-I78 HydrophobicContact CD1-CD1 4.13Å; I69-I78 HydrophobicContact CD1-CG1 4.1Å; P71-I78 HydrophobicContact CB-CD1 3.83Å; P71-I78 HydrophobicContact CG-CD1 3.87Å; L75-I78 HydrophobicContact CD2-CD1 4.3Å; L75-I78 WeakPolarHBondContact O-CA 3.28Å; L75-I78 WeakPolarHBondContact O-CB 3.38Å; L75-I78 PolarHBondContact O-N 2.68Å; I78-K80 PolarHBondContact O-N 2.9Å; I78-M81 PolarHBondContact O-N 3.09Å; I78-C82 VanDerWaalsContact O-CB 3.31Å; I78-C82 WeakPolarHBondContact O-CB 3.31Å; I78-C82 PolarHBondContact O-N 3.27Å; I78-C82 PolarHBondContact O-SG 2.85Å; I78-F90 HydrophobicContact CD1-CD2 4.39Å; I78-F90 HydrophobicContact CD1-CE2 4.15Å; I78-F90 HydrophobicContact CG2-CB 4.02Å; I78-F90 HydrophobicContact CG2-CD1 3.62Å; I78-F90 HydrophobicContact CG2-CD2 3.83Å; I78-F90 HydrophobicContact CG2-CE1 3.95Å; I78-F90 HydrophobicContact CG2-CE2 4.15Å; I78-F90 HydrophobicContact CG2-CG 3.54Å; I78-F90 HydrophobicContact CG2-CZ 4.19Å; I78-V92 HydrophobicContact CD1-CG2 3.85Å
79	E	96.1	Very high	95.4	Very high	48 Å²	48	56.6 Å²	56.6	22%	0.224	28%	0.279	C	S	.	.	H	α-helix	trans	-58	-49.7	177.5	-68.5	178.2	155	0	0	111.2	L75 M81 C82 I83 L108 E112 L113	L75-E79 HydrophobicContact CB-CG 4.41Å; L75-E79 PolarHBondContact O-N 3.2Å; E79-M81 VanDerWaalsContact C-N 3.33Å; E79-M81 PolarHBondContact O-N 3.23Å; E79-C82 PolarHBondContact O-N 2.98Å; E79-I83 WeakPolarHBondContact O-CB 3.47Å; E79-I83 VanDerWaalsContact O-CG1 3.27Å; E79-I83 WeakPolarHBondContact O-CG1 3.47Å; E79-I83 PolarHBondContact O-N 2.84Å; E79-L108 HydrophobicContact CG-CD1 4.48Å; E79-L108 HydrophobicContact CG-CD2 4.17Å; E79-E112 WeakPolarHBondContact OE1-CA 3.24Å; E79-L113 PolarHBondContact OE1-N 3.03Å; E79-L113 VanDerWaalsContact OE1-N 3.1Å
80	K	96	Very high	95.5	Very high	148 Å²	148	56 Å²	56	64%	0.643	28%	0.276	S	S	*	.	H	α-helix	trans	-57.2	-43.2	176.1	-74.6	171.1	-173.7	175.2	0	112.5	S76 I78 K84	S76-K80 WeakPolarHBondContact O-CB 3.33Å; S76-K80 WeakPolarHBondContact O-CD 3.5Å; S76-K80 WeakPolarHBondContact O-CG 2.88Å; S76-K80 PolarHBondContact O-N 2.81Å; S76-K80 VanDerWaalsContact O-N 3.08Å; I78-K80 PolarHBondContact O-N 2.9Å; K80-K84 VanDerWaalsContact O-CB 3.31Å; K80-K84 WeakPolarHBondContact O-CB 3.44Å; K80-K84 PolarHBondContact O-N 2.86Å
81	M	96.5	Very high	95.7	Very high	41 Å²	41	51.7 Å²	51.7	20%	0.202	25%	0.254	C	S	.	.	H	α-helix	trans	-72	-41.4	180	-70.6	-62.7	165.5	0	0	112	L34 L63 F77 I78 E79 I83 K84 F85	L34-M81 HydrophobicContact CD2-CB 3.65Å; L63-M81 HydrophobicContact CD1-CG 4.33Å; F77-M81 HydrophobicContact CD1-CG 4.2Å; F77-M81 HydrophobicContact CD2-CE 4.29Å; F77-M81 HydrophobicContact CE1-CG 3.77Å; F77-M81 HydrophobicContact CE2-CE 3.5Å; F77-M81 VanDerWaalsContact CE2-CE 3.5Å; F77-M81 HydrophobicContact CE2-CG 4.16Å; F77-M81 HydrophobicContact CZ-CE 3.7Å; F77-M81 HydrophobicContact CZ-CG 3.75Å; F77-M81 HydrophobicContact CZ-SD 4.43Å; F77-M81 WeakPolarHBondContact O-CB 3.31Å; F77-M81 VanDerWaalsContact O-CG 3.3Å; F77-M81 WeakPolarHBondContact O-CG 3.42Å; F77-M81 PolarHBondContact O-N 2.78Å; I78-M81 PolarHBondContact O-N 3.09Å; E79-M81 VanDerWaalsContact C-N 3.33Å; E79-M81 PolarHBondContact O-N 3.23Å; M81-I83 VanDerWaalsContact C-N 3.35Å; M81-I83 PolarHBondContact O-N 2.77Å; M81-K84 WeakPolarHBondContact O-CB 3.27Å; M81-K84 PolarHBondContact O-N 2.88Å; M81-K84 HydrophobicContact SD-CD 4.21Å; M81-F85 VanDerWaalsContact O-CD2 3.27Å; M81-F85 WeakPolarHBondContact O-CD2 3.41Å; M81-F85 PolarHBondContact O-N 3.35Å; M81-F85 HydrophobicContact SD-CE2 4.19Å
82	C	96.5	Very high	95.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-43.6	175.2	-76.1	0	0	0	0	111.8	I78 E79 F85 D86 C87 L108	I78-C82 VanDerWaalsContact O-CB 3.31Å; I78-C82 WeakPolarHBondContact O-CB 3.31Å; I78-C82 PolarHBondContact O-N 3.27Å; I78-C82 PolarHBondContact O-SG 2.85Å; E79-C82 PolarHBondContact O-N 2.98Å; C82-F85 CarbonylContact O-C 3.53Å; C82-F85 PolarHBondContact O-N 3.14Å; C82-D86 WeakPolarHBondContact O-CA 3.42Å; C82-D86 PolarHBondContact O-N 3.3Å; C82-C87 VanDerWaalsContact CB-O 3.31Å; C82-C87 WeakPolarHBondContact CB-O 3.36Å; C82-C87 PolarHBondContact O-N 2.84Å; C82-L108 HydrophobicContact CB-CD1 3.24Å; C82-L108 HydrophobicContact CB-CG 4.47Å
83	I	94.3	Very high	96	Very high	102 Å²	102	48.9 Å²	48.9	52%	0.523	24%	0.241	S	C	.	.	H	α-helix	trans	-62.7	-43.6	173.7	-66.5	165.1	0	0	0	110.9	R22 E79 M81 F85 D86	R22-I83 PolarHBondContact NH1-O 2.92Å; E79-I83 WeakPolarHBondContact O-CB 3.47Å; E79-I83 VanDerWaalsContact O-CG1 3.27Å; E79-I83 WeakPolarHBondContact O-CG1 3.47Å; E79-I83 PolarHBondContact O-N 2.84Å; M81-I83 VanDerWaalsContact C-N 3.35Å; M81-I83 PolarHBondContact O-N 2.77Å; I83-F85 PolarHBondContact O-N 2.84Å; I83-D86 PolarHBondContact O-N 2.57Å
84	K	94.2	Very high	96.1	Very high	136 Å²	136	43.2 Å²	43.2	59%	0.591	22%	0.215	S	C	*	.	H	α-helix	trans	-60.2	-45.2	178.2	-178.1	178	-180	176.7	0	112.1	R22 K80 M81	R22-K84 PolarHBondContact NH1-O 3.47Å; R22-K84 PolarHBondContact NH2-O 2.9Å; K80-K84 VanDerWaalsContact O-CB 3.31Å; K80-K84 WeakPolarHBondContact O-CB 3.44Å; K80-K84 PolarHBondContact O-N 2.86Å; M81-K84 WeakPolarHBondContact O-CB 3.27Å; M81-K84 PolarHBondContact O-N 2.88Å; M81-K84 HydrophobicContact SD-CD 4.21Å
85	F	94.9	Very high	96.2	Very high	66 Å²	66	42.1 Å²	42.1	29%	0.289	21%	0.207	S	C	.	.	H	α-helix	trans	-89.3	-1.5	-178	-74.4	-79.5	0	0	0	114.3	L34 Y61 L63 M81 C82 I83	L34-F85 HydrophobicContact CD1-CB 4.31Å; L34-F85 HydrophobicContact CD1-CD2 4.03Å; L34-F85 HydrophobicContact CD1-CG 4.15Å; L34-F85 HydrophobicContact CD2-CD2 4.39Å; Y61-F85 HydrophobicContact CG-CD1 4.44Å; L63-F85 HydrophobicContact CD2-CD2 4.15Å; L63-F85 HydrophobicContact CD2-CE2 3.4Å; L63-F85 VanDerWaalsContact CD2-CE2 3.4Å; L63-F85 HydrophobicContact CD2-CZ 3.77Å; M81-F85 VanDerWaalsContact O-CD2 3.27Å; M81-F85 WeakPolarHBondContact O-CD2 3.41Å; M81-F85 PolarHBondContact O-N 3.35Å; M81-F85 HydrophobicContact SD-CE2 4.19Å; C82-F85 CarbonylContact O-C 3.53Å; C82-F85 PolarHBondContact O-N 3.14Å; I83-F85 PolarHBondContact O-N 2.84Å
86	D	95.1	Very high	96.2	Very high	56 Å²	56	42.9 Å²	42.9	30%	0.299	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	49.4	-177.1	-166.4	32.5	0	0	0	112.5	R22 C82 I83	R22-D86 HydrophobicContact CG-CB 4.24Å; R22-D86 WeakPolarHBondContact CG-OD2 3.4Å; R22-D86 IonicContact NE-OD2 3.54Å; C82-D86 WeakPolarHBondContact O-CA 3.42Å; C82-D86 PolarHBondContact O-N 3.3Å; I83-D86 PolarHBondContact O-N 2.57Å
87	C	96.6	Very high	96.3	Very high	8 Å²	8	50.9 Å²	50.9	5%	0.054	24%	0.244	C	C	.	.			trans	-115	125.8	179.9	-65.2	0	0	0	0	110	C32 L34 C82	C32-C87 HydrophobicContact CB-CB 4.43Å; L34-C87 HydrophobicContact CB-CB 3.86Å; C82-C87 VanDerWaalsContact CB-O 3.31Å; C82-C87 WeakPolarHBondContact CB-O 3.36Å; C82-C87 PolarHBondContact O-N 2.84Å
88	S	95.9	Very high	96.2	Very high	38 Å²	38	56.3 Å²	56.3	27%	0.266	27%	0.267	S	S	.	.	S	Bend	trans	-89.3	-8	174.9	53.5	0	0	0	0	112.8	K31 C32 R107 L108	K31-S88 WeakPolarHBondContact CB-OG 3.39Å; K31-S88 WeakPolarHBondContact CG-OG 3.47Å; C32-S88 PolarHBondContact O-N 3.41Å; S88-R107 CarbonylContact O-C 3.59Å; S88-R107 WeakPolarHBondContact O-CA 3.4Å; S88-L108 PolarHBondContact O-N 3.19Å
89	M	97	Very high	96.1	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.1	177.8	-56.1	-174.4	71.8	0	0	110.4	K31 C32 T33 L34 G106 R107 D165 L166	K31-M89 HydrophobicContact CB-CG 4.42Å; K31-M89 HydrophobicContact CB-SD 4.22Å; K31-M89 HydrophobicContact CD-SD 4.42Å; C32-M89 PolarHBondContact O-N 2.84Å; T33-M89 CarbonylContact C-O 3.53Å; T33-M89 WeakPolarHBondContact CA-O 3.39Å; T33-M89 HydrophobicContact CG2-CB 4.35Å; T33-M89 WeakPolarHBondContact OG1-CB 3.43Å; L34-M89 PolarHBondContact N-O 2.88Å; M89-G106 WeakPolarHBondContact CA-O 3.31Å; M89-R107 HydrophobicContact CE-CG 3.91Å; M89-R107 HydrophobicContact CG-CG 4.21Å; M89-D165 HydrophobicContact CE-CB 4.04Å; M89-D165 HydrophobicContact SD-CB 3.97Å; M89-L166 HydrophobicContact CE-CB 3.63Å; M89-L166 HydrophobicContact CE-CD1 3.75Å; M89-L166 HydrophobicContact CE-CG 4.27Å; M89-L166 HydrophobicContact SD-CD1 4.37Å
90	F	97.8	Very high	96.1	Very high	1 Å²	1	59 Å²	59	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.4	174.4	64	-92.8	0	0	0	112	L34 I78 V92 I104 G106 L108 L113 M116	L34-F90 HydrophobicContact CB-CB 4.49Å; L34-F90 CarbonylContact O-C 3.57Å; L34-F90 WeakPolarHBondContact O-CA 3.23Å; I78-F90 HydrophobicContact CD1-CD2 4.39Å; I78-F90 HydrophobicContact CD1-CE2 4.15Å; I78-F90 HydrophobicContact CG2-CB 4.02Å; I78-F90 HydrophobicContact CG2-CD1 3.62Å; I78-F90 HydrophobicContact CG2-CD2 3.83Å; I78-F90 HydrophobicContact CG2-CE1 3.95Å; I78-F90 HydrophobicContact CG2-CE2 4.15Å; I78-F90 HydrophobicContact CG2-CG 3.54Å; I78-F90 HydrophobicContact CG2-CZ 4.19Å; F90-V92 HydrophobicContact CD2-CG2 3.96Å; F90-V92 HydrophobicContact CE2-CG2 4.35Å; F90-I104 HydrophobicContact CE2-CG2 4.44Å; F90-G106 PolarHBondContact N-O 3.04Å; F90-G106 PolarHBondContact O-N 3.26Å; F90-L108 HydrophobicContact CD1-CD2 4.22Å; F90-L108 HydrophobicContact CD1-CG 4.25Å; F90-L108 HydrophobicContact CE1-CD2 3.82Å; F90-L108 HydrophobicContact CE1-CG 4.32Å; F90-L113 HydrophobicContact CE1-CD1 3.76Å; F90-L113 HydrophobicContact CZ-CD1 3.78Å; F90-M116 HydrophobicContact CE2-SD 4.26Å; F90-M116 HydrophobicContact CZ-CG 4.42Å; F90-M116 HydrophobicContact CZ-SD 4.14Å
91	V	98	Very high	96.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.3	171.7	-176.8	0	0	0	0	108.8	T33 L34 V35 I36 L49 L52 I103 I104 F105 L166	T33-V91 HydrophobicContact CG2-CG2 3.69Å; L34-V91 PolarHBondContact O-N 2.76Å; V35-V91 WeakPolarHBondContact CA-O 3.31Å; V35-V91 HydrophobicContact CG2-CB 4.44Å; I36-V91 PolarHBondContact N-O 3.43Å; L49-V91 HydrophobicContact CD2-CG1 3.69Å; L52-V91 HydrophobicContact CD2-CB 4.11Å; L52-V91 HydrophobicContact CD2-CG1 3.91Å; L52-V91 HydrophobicContact CD2-CG2 3.67Å; V91-I103 HydrophobicContact CG1-CG2 3.78Å; V91-I104 CarbonylContact C-O 3.52Å; V91-I104 VanDerWaalsContact CA-O 3.28Å; V91-I104 WeakPolarHBondContact CA-O 3.37Å; V91-F105 HydrophobicContact CB-CD1 4.1Å; V91-F105 HydrophobicContact CB-CE1 4.31Å; V91-F105 HydrophobicContact CG1-CD1 3.7Å; V91-F105 HydrophobicContact CG1-CE1 3.59Å; V91-F105 HydrophobicContact CG2-CD1 3.51Å; V91-F105 HydrophobicContact CG2-CE1 3.78Å; V91-L166 HydrophobicContact CG2-CD1 4.27Å
92	V	97.8	Very high	96.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.8	175.5	-173	0	0	0	0	109.7	I36 I69 P71 I78 F90 M94 I103 I104	I36-V92 HydrophobicContact CB-CG2 4.26Å; I36-V92 HydrophobicContact CD1-CG2 4.48Å; I36-V92 WeakPolarHBondContact O-CA 3.33Å; I69-V92 HydrophobicContact CD1-CG1 3.66Å; I69-V92 HydrophobicContact CD1-CG2 3.97Å; I69-V92 HydrophobicContact CG1-CG1 4.23Å; P71-V92 HydrophobicContact CG-CB 4.28Å; P71-V92 HydrophobicContact CG-CG1 4.18Å; P71-V92 HydrophobicContact CG-CG2 4.08Å; I78-V92 HydrophobicContact CD1-CG2 3.85Å; F90-V92 HydrophobicContact CD2-CG2 3.96Å; F90-V92 HydrophobicContact CE2-CG2 4.35Å; V92-M94 HydrophobicContact CG1-CG 3.76Å; V92-M94 HydrophobicContact CG1-SD 4.14Å; V92-I103 WeakPolarHBondContact O-CA 3.49Å; V92-I104 HydrophobicContact CB-CB 4.28Å; V92-I104 PolarHBondContact N-O 2.96Å; V92-I104 PolarHBondContact O-N 2.95Å
93	G	97.7	Very high	96.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.7	169.1	0	0	0	0	0	111.7	I36 G38 T41	I36-G93 PolarHBondContact O-N 3.11Å; G38-G93 WeakPolarHBondContact CA-O 3.41Å; G38-G93 PolarHBondContact N-O 3.05Å; T41-G93 VanDerWaalsContact CG2-O 3.27Å; T41-G93 WeakPolarHBondContact CG2-O 3.49Å
94	M	97.1	Very high	96.5	Very high	30 Å²	30	47.7 Å²	47.7	15%	0.148	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	162.7	178.6	-53.1	-175.1	69.8	0	0	111.3	H40 I69 L70 P71 V92 N102 I104	H40-M94 CarbonylContact O-C 3.34Å; H40-M94 VanDerWaalsContact O-CA 3.28Å; H40-M94 WeakPolarHBondContact O-CA 3.16Å; I69-M94 WeakPolarHBondContact O-CE 3.21Å; L70-M94 HydrophobicContact CD2-CE 4.04Å; P71-M94 HydrophobicContact CG-SD 4.29Å; V92-M94 HydrophobicContact CG1-CG 3.76Å; V92-M94 HydrophobicContact CG1-SD 4.14Å; M94-N102 HydrophobicContact CB-CB 4.26Å; M94-N102 PolarHBondContact N-O 3.45Å; M94-N102 WeakPolarHBondContact O-CA 3Å; M94-N102 WeakPolarHBondContact O-CB 3.22Å; M94-N102 PolarHBondContact O-N 3.41Å; M94-I104 HydrophobicContact SD-CD1 4.02Å
95	H	96.7	Very high	96.6	Very high	64 Å²	64	41.4 Å²	41.4	30%	0.296	20%	0.201	S	C	.	.			trans	-147.5	133.7	172.7	-173.5	95.9	0	0	0	109.8	H40 S42 H101	H40-H95 WeakPolarHBondContact CB-O 3.13Å; H40-H95 PolarHBondContact O-N 2.93Å; S42-H95 WeakPolarHBondContact CB-ND1 3.44Å; S42-H95 PolarHBondContact OG-ND1 3.1Å; H95-H101 AromaticContact CE1-CE1 3.62Å; H95-H101 AromaticContact CE1-ND1 3.78Å; H95-H101 AromaticContact ND1-CE1 3.81Å; H95-H101 PolarHBondContact ND1-N 3.26Å; H95-H101 AromaticContact ND1-ND1 3.51Å
96	S	95.7	Very high	96.8	Very high	52 Å²	52	38.3 Å²	38.3	36%	0.364	19%	0.188	S	C	.	.			trans	-149.7	162.8	174.5	66.1	0	0	0	0	110	K98 R99 P100	S96-K98 VanDerWaalsContact C-N 3.3Å; S96-K98 PolarHBondContact O-N 3.36Å; S96-R99 PolarHBondContact N-O 3.37Å; S96-R99 VanDerWaalsContact N-O 3.09Å; S96-R99 CarbonylContact O-C 3.59Å; S96-R99 PolarHBondContact O-N 2.93Å; S96-R99 VanDerWaalsContact O-O 3.14Å; S96-R99 WeakPolarHBondContact OG-CB 3.44Å; S96-R99 PolarHBondContact OG-N 2.86Å; S96-R99 PolarHBondContact OG-O 2.89Å; S96-P100 WeakPolarHBondContact O-CA 3.43Å; S96-P100 VanDerWaalsContact O-N 3.11Å
97	K	95.5	Very high	96.9	Very high	218 Å²	218	36 Å²	36	95%	0.948	18%	0.175	S	C	*	.	S	Bend	trans	-56.9	-42.4	175.2	-68.6	-175.2	178.4	-178.3	0	112.4
98	K	95.3	Very high	96.9	Very high	170 Å²	170	36.4 Å²	36.4	74%	0.739	18%	0.176	S	C	*	.	S	Bend	trans	-70.8	-32.5	178.4	-175.7	172	-179	168.9	0	113	S96	S96-K98 VanDerWaalsContact C-N 3.3Å; S96-K98 PolarHBondContact O-N 3.36Å
99	R	94.5	Very high	96.8	Very high	56 Å²	56	37.6 Å²	37.6	21%	0.211	18%	0.178	C	C	.	.	S	Bend	trans	-135.2	80.8	-176.2	-64.9	-170.1	-176.4	81.1	0.8	109.3	S96 N102 E118	S96-R99 PolarHBondContact N-O 3.37Å; S96-R99 VanDerWaalsContact N-O 3.09Å; S96-R99 CarbonylContact O-C 3.59Å; S96-R99 PolarHBondContact O-N 2.93Å; S96-R99 VanDerWaalsContact O-O 3.14Å; S96-R99 WeakPolarHBondContact OG-CB 3.44Å; S96-R99 PolarHBondContact OG-N 2.86Å; S96-R99 PolarHBondContact OG-O 2.89Å; R99-N102 HydrophobicContact CB-CB 4.41Å; R99-E118 WeakPolarHBondContact CD-OE1 3.5Å; R99-E118 WeakPolarHBondContact CD-OE2 3.34Å; R99-E118 IonicContact NE-OE1 2.67Å; R99-E118 IonicContact NE-OE2 3.4Å; R99-E118 PolarHBondContact NE-OE2 2.99Å
100	P	96.3	Very high	96.6	Very high	50 Å²	50	44.4 Å²	44.4	33%	0.325	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	151.7	177.6	28.5	-34.5	0	0	0	110.3	S96 N102 R243	S96-P100 WeakPolarHBondContact O-CA 3.43Å; S96-P100 VanDerWaalsContact O-N 3.11Å; P100-N102 VanDerWaalsContact C-N 3.35Å; P100-N102 PolarHBondContact O-N 3.37Å; P100-R243 PolarHBondContact O-NH1 3.13Å; P100-R243 PolarHBondContact O-NH2 2.91Å
101	H	97	Very high	96.3	Very high	50 Å²	50	45.5 Å²	45.5	23%	0.231	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	41.1	55.5	176.8	-47.9	-60.3	0	0	0	114	S42 V45 H95 I121	S42-H101 WeakPolarHBondContact CB-ND1 3.39Å; S42-H101 PolarHBondContact OG-ND1 2.79Å; V45-H101 VanDerWaalsContact CG2-CA 3.5Å; V45-H101 HydrophobicContact CG2-CB 4.01Å; H95-H101 AromaticContact CE1-CE1 3.62Å; H95-H101 AromaticContact CE1-ND1 3.78Å; H95-H101 AromaticContact ND1-CE1 3.81Å; H95-H101 PolarHBondContact ND1-N 3.26Å; H95-H101 AromaticContact ND1-ND1 3.51Å; H101-I121 HydrophobicContact CB-CB 4.01Å; H101-I121 PolarHBondContact O-N 3.3Å
102	N	97.5	Very high	96.1	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.3	-168.2	-159.9	51.6	0	0	0	111.4	M94 R99 P100 E118 R243	M94-N102 HydrophobicContact CB-CB 4.26Å; M94-N102 PolarHBondContact N-O 3.45Å; M94-N102 WeakPolarHBondContact O-CA 3Å; M94-N102 WeakPolarHBondContact O-CB 3.22Å; M94-N102 PolarHBondContact O-N 3.41Å; R99-N102 HydrophobicContact CB-CB 4.41Å; P100-N102 VanDerWaalsContact C-N 3.35Å; P100-N102 PolarHBondContact O-N 3.37Å; N102-E118 PolarHBondContact ND2-OE1 2.94Å; N102-E118 WeakPolarHBondContact OD1-CG 3.49Å; N102-E118 PolarHBondContact OD1-OE1 3.44Å; N102-R243 PolarHBondContact OD1-NH1 3.14Å
103	I	97.6	Very high	96	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133	171.2	-63.3	-62.2	0	0	0	108.1	V45 F48 L49 V91 V92 F105 L119 I121	V45-I103 HydrophobicContact CG1-CD1 3.83Å; V45-I103 HydrophobicContact CG2-CD1 4.38Å; F48-I103 HydrophobicContact CD1-CD1 3.75Å; F48-I103 HydrophobicContact CD1-CG1 3.87Å; F48-I103 HydrophobicContact CE1-CD1 4.23Å; F48-I103 HydrophobicContact CE1-CG1 4.02Å; F48-I103 HydrophobicContact CE1-CG2 4.16Å; L49-I103 HydrophobicContact CD2-CD1 3.97Å; L49-I103 HydrophobicContact CG-CD1 4.35Å; V91-I103 HydrophobicContact CG1-CG2 3.78Å; V92-I103 WeakPolarHBondContact O-CA 3.49Å; I103-F105 HydrophobicContact CG2-CD1 3.83Å; I103-F105 HydrophobicContact CG2-CE1 3.38Å; I103-F105 HydrophobicContact CG2-CE2 4.29Å; I103-F105 HydrophobicContact CG2-CG 4.45Å; I103-F105 HydrophobicContact CG2-CZ 3.64Å; I103-L119 PolarHBondContact N-O 2.9Å; I103-L119 PolarHBondContact O-N 3.27Å; I103-I121 HydrophobicContact CD1-CD1 4.07Å; I103-I121 HydrophobicContact CG1-CD1 3.5Å; I103-I121 VanDerWaalsContact CG1-CD1 3.5Å; I103-I121 HydrophobicContact CG1-CG1 3.75Å
104	I	97.9	Very high	95.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.5	175.4	-61.2	165.7	0	0	0	107.3	P71 F72 F90 V91 V92 M94 M116 F117 E118	P71-I104 HydrophobicContact CB-CD1 4.12Å; P71-I104 HydrophobicContact CG-CD1 3.71Å; F72-I104 HydrophobicContact CD2-CD1 4.24Å; F72-I104 HydrophobicContact CE2-CD1 4Å; F72-I104 HydrophobicContact CE2-CG1 4.26Å; F72-I104 HydrophobicContact CE2-CG2 4.37Å; F90-I104 HydrophobicContact CE2-CG2 4.44Å; V91-I104 CarbonylContact C-O 3.52Å; V91-I104 VanDerWaalsContact CA-O 3.28Å; V91-I104 WeakPolarHBondContact CA-O 3.37Å; V92-I104 HydrophobicContact CB-CB 4.28Å; V92-I104 PolarHBondContact N-O 2.96Å; V92-I104 PolarHBondContact O-N 2.95Å; M94-I104 HydrophobicContact SD-CD1 4.02Å; I104-M116 HydrophobicContact CG2-CG 3.37Å; I104-M116 HydrophobicContact CG2-SD 3.55Å; I104-M116 VanDerWaalsContact CG2-SD 3.55Å; I104-F117 CarbonylContact C-O 3.56Å; I104-F117 WeakPolarHBondContact CA-O 3.32Å; I104-E118 HydrophobicContact CG1-CB 4.22Å; I104-E118 HydrophobicContact CG1-CG 3.98Å
105	F	97.7	Very high	95.9	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140	169.9	-57.9	-47.4	0	0	0	109.5	F48 L52 V91 I103 M116 F117 L119 L162 L163 L166	F48-F105 HydrophobicContact CE1-CE1 4.42Å; F48-F105 HydrophobicContact CE1-CZ 4.16Å; F48-F105 HydrophobicContact CZ-CZ 4.16Å; L52-F105 HydrophobicContact CD2-CE1 4.3Å; V91-F105 HydrophobicContact CB-CD1 4.1Å; V91-F105 HydrophobicContact CB-CE1 4.31Å; V91-F105 HydrophobicContact CG1-CD1 3.7Å; V91-F105 HydrophobicContact CG1-CE1 3.59Å; V91-F105 HydrophobicContact CG2-CD1 3.51Å; V91-F105 HydrophobicContact CG2-CE1 3.78Å; I103-F105 HydrophobicContact CG2-CD1 3.83Å; I103-F105 HydrophobicContact CG2-CE1 3.38Å; I103-F105 HydrophobicContact CG2-CE2 4.29Å; I103-F105 HydrophobicContact CG2-CG 4.45Å; I103-F105 HydrophobicContact CG2-CZ 3.64Å; F105-M116 CarbonylContact O-C 3.58Å; F105-M116 VanDerWaalsContact O-CA 3.31Å; F105-M116 WeakPolarHBondContact O-CA 3.2Å; F105-F117 PolarHBondContact N-O 3.22Å; F105-F117 PolarHBondContact O-N 2.9Å; F105-L119 HydrophobicContact CD2-CD1 3.63Å; F105-L119 HydrophobicContact CD2-CG 4.47Å; F105-L119 HydrophobicContact CE2-CD1 3.4Å; F105-L119 HydrophobicContact CZ-CD1 4.48Å; F105-L162 HydrophobicContact CB-CD1 4.29Å; F105-L162 HydrophobicContact CB-CD2 3.77Å; F105-L162 HydrophobicContact CD2-CD2 4.35Å; F105-L162 HydrophobicContact CG-CD2 4.36Å; F105-L163 HydrophobicContact CE2-CD2 4.41Å; F105-L166 HydrophobicContact CD1-CD2 3.91Å; F105-L166 HydrophobicContact CD2-CD2 4.41Å; F105-L166 HydrophobicContact CE1-CD2 3.81Å; F105-L166 HydrophobicContact CE2-CD2 4.32Å; F105-L166 HydrophobicContact CG-CD2 4.22Å; F105-L166 HydrophobicContact CZ-CD2 4.03Å
106	G	97.6	Very high	95.9	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	159.9	172.2	0	0	0	0	0	113.4	M89 F90 D115	M89-G106 WeakPolarHBondContact CA-O 3.31Å; F90-G106 PolarHBondContact N-O 3.04Å; F90-G106 PolarHBondContact O-N 3.26Å; G106-D115 CarbonylContact C-O 3.59Å; G106-D115 WeakPolarHBondContact CA-O 3.3Å
107	R	97.1	Very high	96	Very high	8 Å²	8	44.9 Å²	44.9	3%	0.03	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144	176.5	-56.1	-175.1	-74.1	-177.6	-4.2	109.9	S88 M89 L114 D115 S161 L162 D165	S88-R107 CarbonylContact O-C 3.59Å; S88-R107 WeakPolarHBondContact O-CA 3.4Å; M89-R107 HydrophobicContact CE-CG 3.91Å; M89-R107 HydrophobicContact CG-CG 4.21Å; R107-L114 HydrophobicContact CB-CB 4.41Å; R107-L114 WeakPolarHBondContact O-CB 3.32Å; R107-L114 PolarHBondContact O-N 2.84Å; R107-D115 VanDerWaalsContact CB-OD1 3.27Å; R107-D115 WeakPolarHBondContact CB-OD1 3.23Å; R107-D115 WeakPolarHBondContact CG-OD1 3.47Å; R107-D115 IonicContact CZ-OD1 2.65Å; R107-D115 IonicContact CZ-OD2 3.16Å; R107-D115 PolarHBondContact N-O 2.79Å; R107-D115 IonicContact NE-OD1 2.71Å; R107-D115 PolarHBondContact NE-OD1 3.19Å; R107-D115 IonicContact NE-OD2 2.71Å; R107-D115 PolarHBondContact NE-OD2 2.95Å; R107-D115 IonicContact NH2-OD1 2.88Å; R107-D115 IonicContact NH2-OD2 2.69Å; R107-D115 PolarHBondContact NH2-OD2 3.5Å; R107-S161 PolarHBondContact NH1-OG 3.4Å; R107-S161 PolarHBondContact NH2-OG 3.02Å; R107-L162 HydrophobicContact CG-CD1 4.31Å; R107-L162 HydrophobicContact CG-CG 4.18Å; R107-D165 IonicContact CZ-OD2 2.74Å; R107-D165 IonicContact NH1-OD2 2.79Å; R107-D165 PolarHBondContact NH1-OD2 2.99Å
108	L	96.7	Very high	96.1	Very high	16 Å²	16	34.6 Å²	34.6	8%	0.084	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	147.3	169.8	-55.3	-175.8	0	0	0	109.4	E79 C82 S88 F90 E112 L113	E79-L108 HydrophobicContact CG-CD1 4.48Å; E79-L108 HydrophobicContact CG-CD2 4.17Å; C82-L108 HydrophobicContact CB-CD1 3.24Å; C82-L108 HydrophobicContact CB-CG 4.47Å; S88-L108 PolarHBondContact O-N 3.19Å; F90-L108 HydrophobicContact CD1-CD2 4.22Å; F90-L108 HydrophobicContact CD1-CG 4.25Å; F90-L108 HydrophobicContact CE1-CD2 3.82Å; F90-L108 HydrophobicContact CE1-CG 4.32Å; L108-E112 CarbonylContact C-O 3.54Å; L108-E112 WeakPolarHBondContact CA-O 3.33Å; L108-L113 HydrophobicContact CD2-CB 4.34Å; L108-L113 HydrophobicContact CD2-CD1 4.16Å
109	H	95.2	Very high	96.2	Very high	63 Å²	63	26.5 Å²	26.5	29%	0.292	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	125.3	168.7	176.2	-80.5	0	0	0	107.8	G111 E112 L114 A256	H109-G111 PolarHBondContact O-N 3.27Å; H109-E112 PolarHBondContact N-O 3.37Å; H109-E112 PolarHBondContact O-N 2.86Å; H109-E112 VanDerWaalsContact O-N 3.14Å; H109-L114 HydrophobicContact CB-CB 4.16Å; H109-L114 HydrophobicContact CB-CD1 4.37Å; H109-L114 HydrophobicContact CB-CD2 4.46Å; H109-A256 HydrophobicContact CB-CB 4.36Å; H109-A256 VanDerWaalsContact CD2-CB 3.47Å; H109-A256 WeakPolarHBondContact CD2-CB 3.5Å; H109-A256 WeakPolarHBondContact NE2-CA 3.46Å
110	D	92.1	Very high	96.3	Very high	145 Å²	145	23.8 Å²	23.8	78%	0.775	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	39.2	-177.1	-157.7	21.5	0	0	0	113.6	E112	D110-E112 PolarHBondContact O-N 3.37Å
111	G	90.9	Very high	96.4	Very high	24 Å²	24	21.8 Å²	21.8	25%	0.247	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-9.8	179.9	0	0	0	0	0	115.7	H109	H109-G111 PolarHBondContact O-N 3.27Å
112	E	93.9	Very high	96.3	Very high	98 Å²	98	24.4 Å²	24.4	46%	0.458	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	155.6	-178.6	-57.7	-179.9	170.5	0	0	112.7	E79 L108 H109 D110 L114 K252	E79-E112 WeakPolarHBondContact OE1-CA 3.24Å; L108-E112 CarbonylContact C-O 3.54Å; L108-E112 WeakPolarHBondContact CA-O 3.33Å; H109-E112 PolarHBondContact N-O 3.37Å; H109-E112 PolarHBondContact O-N 2.86Å; H109-E112 VanDerWaalsContact O-N 3.14Å; D110-E112 PolarHBondContact O-N 3.37Å; E112-L114 PolarHBondContact O-N 2.91Å; E112-K252 IonicContact OE2-NZ 3.68Å; E112-K252 PolarHBondContact OE2-NZ 3.1Å
113	L	96	Very high	96.2	Very high	20 Å²	20	31.2 Å²	31.2	11%	0.105	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	120.4	176.1	-173.8	67.2	0	0	0	113.7	L75 E79 F90 L108 M116 K252	L75-L113 HydrophobicContact CD1-CB 3.94Å; L75-L113 HydrophobicContact CD1-CD2 3.35Å; L75-L113 HydrophobicContact CD1-CG 4.17Å; L75-L113 HydrophobicContact CD2-CD2 4.17Å; L75-L113 HydrophobicContact CG-CD2 4.4Å; E79-L113 PolarHBondContact OE1-N 3.03Å; E79-L113 VanDerWaalsContact OE1-N 3.1Å; F90-L113 HydrophobicContact CE1-CD1 3.76Å; F90-L113 HydrophobicContact CZ-CD1 3.78Å; L108-L113 HydrophobicContact CD2-CB 4.34Å; L108-L113 HydrophobicContact CD2-CD1 4.16Å; L113-M116 HydrophobicContact CD1-CB 4.23Å; L113-M116 HydrophobicContact CD2-CB 4.14Å; L113-M116 HydrophobicContact CD2-CE 4.18Å; L113-K252 WeakPolarHBondContact O-CE 3.49Å; L113-K252 PolarHBondContact O-NZ 3.06Å
114	L	96.4	Very high	96.1	Very high	14 Å²	14	33 Å²	33	7%	0.073	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-62.5	169.9	-177.7	66.6	0	0	0	110.3	R107 H109 E112 P248 K252 W253 A256	R107-L114 HydrophobicContact CB-CB 4.41Å; R107-L114 WeakPolarHBondContact O-CB 3.32Å; R107-L114 PolarHBondContact O-N 2.84Å; H109-L114 HydrophobicContact CB-CB 4.16Å; H109-L114 HydrophobicContact CB-CD1 4.37Å; H109-L114 HydrophobicContact CB-CD2 4.46Å; E112-L114 PolarHBondContact O-N 2.91Å; L114-P248 HydrophobicContact CD1-CB 3.95Å; L114-P248 HydrophobicContact CD1-CG 4.36Å; L114-P248 WeakPolarHBondContact O-CA 3.28Å; L114-P248 VanDerWaalsContact O-CB 3.23Å; L114-P248 WeakPolarHBondContact O-CB 3.33Å; L114-K252 HydrophobicContact CD1-CG 3.99Å; L114-W253 HydrophobicContact CD1-CE3 4.44Å; L114-A256 HydrophobicContact CD1-CB 3.86Å; L114-A256 HydrophobicContact CD2-CB 4.19Å
115	D	96.9	Very high	96	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	155.2	-178.6	64.2	-11.6	0	0	0	112.1	G106 R107 F117 S246 P248	G106-D115 CarbonylContact C-O 3.59Å; G106-D115 WeakPolarHBondContact CA-O 3.3Å; R107-D115 VanDerWaalsContact CB-OD1 3.27Å; R107-D115 WeakPolarHBondContact CB-OD1 3.23Å; R107-D115 WeakPolarHBondContact CG-OD1 3.47Å; R107-D115 IonicContact CZ-OD1 2.65Å; R107-D115 IonicContact CZ-OD2 3.16Å; R107-D115 PolarHBondContact N-O 2.79Å; R107-D115 IonicContact NE-OD1 2.71Å; R107-D115 PolarHBondContact NE-OD1 3.19Å; R107-D115 IonicContact NE-OD2 2.71Å; R107-D115 PolarHBondContact NE-OD2 2.95Å; R107-D115 IonicContact NH2-OD1 2.88Å; R107-D115 IonicContact NH2-OD2 2.69Å; R107-D115 PolarHBondContact NH2-OD2 3.5Å; D115-F117 HydrophobicContact CB-CE2 4.48Å; D115-S246 WeakPolarHBondContact CA-O 3.17Å; D115-P248 HydrophobicContact CB-CG 4.45Å
116	M	97.3	Very high	95.9	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	133.1	-177.5	-170.1	170.1	51.1	0	0	111.5	P71 F72 L75 F90 I104 F105 L113 V245 S246	P71-M116 HydrophobicContact CB-SD 3.76Å; P71-M116 WeakPolarHBondContact O-CE 3.34Å; F72-M116 HydrophobicContact CD1-CE 3.63Å; F72-M116 HydrophobicContact CD2-CE 3.94Å; F72-M116 HydrophobicContact CE1-CE 3.62Å; F72-M116 HydrophobicContact CE2-CE 3.93Å; F72-M116 HydrophobicContact CE2-SD 4.27Å; F72-M116 HydrophobicContact CG-CE 3.8Å; F72-M116 HydrophobicContact CZ-CE 3.77Å; F72-M116 HydrophobicContact CZ-CG 4.27Å; F72-M116 HydrophobicContact CZ-SD 4.41Å; L75-M116 HydrophobicContact CD2-CE 4.39Å; L75-M116 HydrophobicContact CD2-SD 4.15Å; F90-M116 HydrophobicContact CE2-SD 4.26Å; F90-M116 HydrophobicContact CZ-CG 4.42Å; F90-M116 HydrophobicContact CZ-SD 4.14Å; I104-M116 HydrophobicContact CG2-CG 3.37Å; I104-M116 HydrophobicContact CG2-SD 3.55Å; I104-M116 VanDerWaalsContact CG2-SD 3.55Å; F105-M116 CarbonylContact O-C 3.58Å; F105-M116 VanDerWaalsContact O-CA 3.31Å; F105-M116 WeakPolarHBondContact O-CA 3.2Å; L113-M116 HydrophobicContact CD1-CB 4.23Å; L113-M116 HydrophobicContact CD2-CB 4.14Å; L113-M116 HydrophobicContact CD2-CE 4.18Å; M116-V245 CarbonylContact O-C 3.55Å; M116-V245 WeakPolarHBondContact O-CA 3.26Å; M116-S246 PolarHBondContact N-O 3.21Å; M116-S246 PolarHBondContact O-N 3.2Å
117	F	97.6	Very high	95.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.8	179.4	-75.3	-99.1	0	0	0	110.5	I104 F105 D115 K155 L159 L162 V245 L247	I104-F117 CarbonylContact C-O 3.56Å; I104-F117 WeakPolarHBondContact CA-O 3.32Å; F105-F117 PolarHBondContact N-O 3.22Å; F105-F117 PolarHBondContact O-N 2.9Å; D115-F117 HydrophobicContact CB-CE2 4.48Å; F117-K155 HydrophobicContact CE1-CG 4.25Å; F117-K155 WeakPolarHBondContact CZ-O 3.45Å; F117-L159 HydrophobicContact CB-CD1 4.23Å; F117-L159 HydrophobicContact CD1-CB 4.2Å; F117-L159 HydrophobicContact CD1-CD1 3.78Å; F117-L159 HydrophobicContact CD1-CG 4.41Å; F117-L159 HydrophobicContact CD2-CD1 4.36Å; F117-L159 HydrophobicContact CE1-CB 3.72Å; F117-L159 HydrophobicContact CE1-CD1 4.19Å; F117-L159 HydrophobicContact CE1-CG 4.39Å; F117-L159 HydrophobicContact CE2-CB 4.42Å; F117-L159 HydrophobicContact CG-CD1 3.86Å; F117-L159 HydrophobicContact CZ-CB 3.84Å; F117-L162 HydrophobicContact CD2-CD1 3.76Å; F117-L162 HydrophobicContact CE2-CD1 4.4Å; F117-V245 HydrophobicContact CD1-CB 4.24Å; F117-V245 HydrophobicContact CD1-CG1 3.75Å; F117-V245 HydrophobicContact CD1-CG2 3.51Å; F117-V245 HydrophobicContact CD2-CG1 4.36Å; F117-V245 HydrophobicContact CE1-CB 4.19Å; F117-V245 HydrophobicContact CE1-CG1 3.38Å; F117-V245 HydrophobicContact CE1-CG2 3.67Å; F117-V245 HydrophobicContact CE2-CG1 4.06Å; F117-V245 HydrophobicContact CG-CG1 4.23Å; F117-V245 HydrophobicContact CG-CG2 4.39Å; F117-V245 HydrophobicContact CZ-CG1 3.55Å; F117-L247 HydrophobicContact CZ-CD2 3.98Å
118	E	97.4	Very high	95.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.4	174.7	-174.2	177.6	-130	0	0	110.5	F72 R99 N102 I104 R243 R244	F72-E118 HydrophobicContact CE2-CB 3.78Å; F72-E118 HydrophobicContact CE2-CG 4.31Å; F72-E118 HydrophobicContact CZ-CB 3.82Å; R99-E118 WeakPolarHBondContact CD-OE1 3.5Å; R99-E118 WeakPolarHBondContact CD-OE2 3.34Å; R99-E118 IonicContact NE-OE1 2.67Å; R99-E118 IonicContact NE-OE2 3.4Å; R99-E118 PolarHBondContact NE-OE2 2.99Å; N102-E118 PolarHBondContact ND2-OE1 2.94Å; N102-E118 WeakPolarHBondContact OD1-CG 3.49Å; N102-E118 PolarHBondContact OD1-OE1 3.44Å; I104-E118 HydrophobicContact CG1-CB 4.22Å; I104-E118 HydrophobicContact CG1-CG 3.98Å; E118-R243 HydrophobicContact CB-CB 4.06Å; E118-R243 HydrophobicContact CG-CB 3.92Å; E118-R243 WeakPolarHBondContact O-CB 3.37Å; E118-R243 PolarHBondContact O-N 3.31Å; E118-R243 WeakPolarHBondContact OE2-CB 3.12Å; E118-R244 HydrophobicContact CB-CB 4.21Å; E118-R244 WeakPolarHBondContact CB-O 3.3Å; E118-R244 PolarHBondContact N-O 2.83Å; E118-R244 IonicContact OE1-CZ 3.54Å; E118-R244 IonicContact OE1-NE 3.52Å; E118-R244 IonicContact OE1-NH2 2.72Å; E118-R244 PolarHBondContact OE1-NH2 2.62Å; E118-R244 WeakPolarHBondContact OE2-CB 3.47Å; E118-R244 WeakPolarHBondContact OE2-CG 3.47Å; E118-R244 IonicContact OE2-CZ 3.55Å; E118-R244 PolarHBondContact OE2-N 3.26Å; E118-R244 IonicContact OE2-NE 2.74Å; E118-R244 PolarHBondContact OE2-NE 2.97Å; E118-R244 IonicContact OE2-NH2 3.5Å
119	L	97.1	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	133	-177.4	-56.6	-177.8	0	0	0	110.5	I103 F105 L194 F240 D241 L242	I103-L119 PolarHBondContact N-O 2.9Å; I103-L119 PolarHBondContact O-N 3.27Å; F105-L119 HydrophobicContact CD2-CD1 3.63Å; F105-L119 HydrophobicContact CD2-CG 4.47Å; F105-L119 HydrophobicContact CE2-CD1 3.4Å; F105-L119 HydrophobicContact CZ-CD1 4.48Å; L119-L194 HydrophobicContact CD1-CD2 4.38Å; L119-F240 HydrophobicContact CB-CB 4.2Å; L119-F240 HydrophobicContact CB-CD1 3.96Å; L119-F240 HydrophobicContact CB-CG 4.36Å; L119-F240 HydrophobicContact CD1-CB 4.32Å; L119-F240 HydrophobicContact CD1-CD1 4.11Å; L119-F240 HydrophobicContact CD1-CG 4.1Å; L119-F240 HydrophobicContact CD2-CB 4.42Å; L119-D241 CarbonylContact C-O 3.03Å; L119-D241 WeakPolarHBondContact CA-O 3.25Å; L119-L242 HydrophobicContact CD2-CD2 3.27Å; L119-L242 HydrophobicContact CD2-CG 3.9Å
120	G	97.3	Very high	94.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.5	168.6	0	0	0	0	0	111.2	F240 D241	G120-F240 CarbonylContact O-C 3.57Å; G120-F240 VanDerWaalsContact O-CA 3.26Å; G120-F240 WeakPolarHBondContact O-CA 3.32Å; G120-D241 PolarHBondContact N-O 2.58Å; G120-D241 PolarHBondContact O-N 2.67Å
121	I	97.4	Very high	94.4	Very high	7 Å²	7	49.6 Å²	49.6	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	132.5	176.6	-53.3	173.5	0	0	0	110.3	I44 V45 F48 H101 I103 Y124 D239 F240	I44-I121 HydrophobicContact CG2-CD1 4.42Å; I44-I121 HydrophobicContact CG2-CG2 4.05Å; V45-I121 HydrophobicContact CG2-CD1 4.24Å; F48-I121 HydrophobicContact CB-CD1 3.69Å; F48-I121 HydrophobicContact CD1-CD1 4.04Å; F48-I121 HydrophobicContact CD2-CD1 4.02Å; F48-I121 HydrophobicContact CG-CD1 3.63Å; H101-I121 HydrophobicContact CB-CB 4.01Å; H101-I121 PolarHBondContact O-N 3.3Å; I103-I121 HydrophobicContact CD1-CD1 4.07Å; I103-I121 HydrophobicContact CG1-CD1 3.5Å; I103-I121 VanDerWaalsContact CG1-CD1 3.5Å; I103-I121 HydrophobicContact CG1-CG1 3.75Å; I121-Y124 HydrophobicContact CG2-CD2 4.4Å; I121-Y124 HydrophobicContact CG2-CG 4.22Å; I121-D239 CarbonylContact C-O 3.59Å; I121-F240 HydrophobicContact CG1-CD1 4.25Å; I121-F240 HydrophobicContact CG1-CE1 3.98Å
122	K	95.5	Very high	94	Very high	105 Å²	105	50.4 Å²	50.4	46%	0.457	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.6	168.6	-76.5	-178.6	169.4	160.3	0	110	Y124 D239 D241	K122-Y124 PolarHBondContact O-N 3.46Å; K122-Y124 VanDerWaalsContact O-N 3.09Å; K122-D239 HydrophobicContact CB-CB 4Å; K122-D239 PolarHBondContact N-O 2.59Å; K122-D239 WeakPolarHBondContact O-CA 3.43Å; K122-D239 PolarHBondContact O-N 2.86Å; K122-D239 VanDerWaalsContact O-O 3.06Å; K122-D241 WeakPolarHBondContact CD-OD1 3.26Å; K122-D241 WeakPolarHBondContact CD-OD2 3.49Å; K122-D241 VanDerWaalsContact CE-CG 3.46Å; K122-D241 WeakPolarHBondContact CE-OD1 3.22Å; K122-D241 WeakPolarHBondContact CE-OD2 3.22Å; K122-D241 IonicContact NZ-OD1 3.3Å; K122-D241 PolarHBondContact NZ-OD1 2.89Å; K122-D241 IonicContact NZ-OD2 3.19Å; K122-D241 PolarHBondContact NZ-OD2 2.91Å
123	M	94.1	Very high	93.4	Very high	148 Å²	148	55.2 Å²	55.2	73%	0.729	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47	44.3	172.8	-57.8	-56.8	-75.1	0	0	114.2	D239	M123-D239 HydrophobicContact CB-CB 4.44Å
124	Y	96.5	Very high	92.7	Very high	36 Å²	36	58.5 Å²	58.5	14%	0.141	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	129.7	-176.5	-174.3	-121.3	0	0	0	112	I44 T47 F48 D51 I121 K122 P126 P236 S237 A238	I44-Y124 HydrophobicContact CG2-CD1 4.09Å; I44-Y124 HydrophobicContact CG2-CG 4.26Å; T47-Y124 HydrophobicContact CG2-CE1 4.06Å; F48-Y124 WeakPolarHBondContact CA-OH 3.28Å; F48-Y124 HydrophobicContact CB-CE1 4.19Å; F48-Y124 HydrophobicContact CB-CE2 4.41Å; F48-Y124 HydrophobicContact CD2-CD2 4Å; F48-Y124 AromaticContact CD2-CE2 3.49Å; F48-Y124 HydrophobicContact CD2-CE2 3.49Å; F48-Y124 VanDerWaalsContact CD2-CE2 3.49Å; F48-Y124 AromaticContact CD2-CZ 3.88Å; F48-Y124 HydrophobicContact CE2-CE2 4.26Å; F48-Y124 HydrophobicContact CG-CE2 4.44Å; D51-Y124 WeakPolarHBondContact CB-OH 3.46Å; D51-Y124 VanDerWaalsContact CG-OH 3.32Å; D51-Y124 PolarHBondContact OD2-OH 3.2Å; I121-Y124 HydrophobicContact CG2-CD2 4.4Å; I121-Y124 HydrophobicContact CG2-CG 4.22Å; K122-Y124 PolarHBondContact O-N 3.46Å; K122-Y124 VanDerWaalsContact O-N 3.09Å; Y124-P126 HydrophobicContact CE1-CB 3.81Å; Y124-P236 HydrophobicContact CE2-CB 4.03Å; Y124-S237 WeakPolarHBondContact CA-O 3.44Å; Y124-S237 VanDerWaalsContact CD2-O 3.24Å; Y124-S237 WeakPolarHBondContact CD2-O 2.9Å; Y124-A238 HydrophobicContact CD2-CB 3.82Å; Y124-A238 HydrophobicContact CE2-CB 4.38Å
125	K	95.9	Very high	92	Very high	118 Å²	118	58.4 Å²	58.4	51%	0.513	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117.2	166.2	-58	-178.1	179.7	176.9	0	109.3	T235 P236 S237	K125-T235 HydrophobicContact CB-CG2 4.12Å; K125-P236 CarbonylContact O-C 3.49Å; K125-P236 WeakPolarHBondContact O-CA 2.87Å; K125-S237 WeakPolarHBondContact CB-OG 3.42Å; K125-S237 PolarHBondContact N-O 2.86Å; K125-S237 PolarHBondContact O-N 3.35Å
126	P	94.8	Very high	91.4	Very high	16 Å²	16	63 Å²	63	10%	0.104	31%	0.313	C	S	.	.			trans	-71.9	168.3	-178.6	29.6	-37.4	0	0	0	114.1	T47 D51 Y124 S128 D129 T235	T47-P126 HydrophobicContact CG2-CB 3.61Å; T47-P126 HydrophobicContact CG2-CG 4.39Å; D51-P126 VanDerWaalsContact OD2-CA 3.23Å; D51-P126 WeakPolarHBondContact OD2-CA 3.22Å; D51-P126 VanDerWaalsContact OD2-CB 3.3Å; D51-P126 WeakPolarHBondContact OD2-CB 3.39Å; Y124-P126 HydrophobicContact CE1-CB 3.81Å; P126-S128 WeakPolarHBondContact CG-OG 3.33Å; P126-S128 PolarHBondContact O-N 2.71Å; P126-D129 WeakPolarHBondContact CD-OD2 3.43Å; P126-D129 HydrophobicContact CG-CB 4.43Å; P126-D129 PolarHBondContact O-N 3.39Å; P126-D129 VanDerWaalsContact O-N 3.12Å; P126-T235 WeakPolarHBondContact O-CB 3.38Å; P126-T235 PolarHBondContact O-OG1 2.85Å
127	I	92.4	Very high	90.4	Very high	29 Å²	29	65.4 Å²	65.4	15%	0.149	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-56.6	-34.5	173.5	-71.9	172.3	0	0	0	111.5	D51 A54 L55 D129 C130 Y137 T235 P236	D51-I127 HydrophobicContact CB-CD1 3.58Å; D51-I127 HydrophobicContact CB-CG1 3.91Å; D51-I127 PolarHBondContact OD2-N 2.81Å; A54-I127 HydrophobicContact CB-CD1 4.19Å; L55-I127 HydrophobicContact CD2-CD1 4.18Å; L55-I127 HydrophobicContact CG-CD1 4.33Å; I127-D129 PolarHBondContact O-N 2.79Å; I127-D129 VanDerWaalsContact O-N 3.15Å; I127-C130 WeakPolarHBondContact O-CB 3.24Å; I127-C130 PolarHBondContact O-N 2.69Å; I127-C130 VanDerWaalsContact O-N 3.11Å; I127-Y137 HydrophobicContact CD1-CD1 4.4Å; I127-Y137 HydrophobicContact CD1-CD2 4.47Å; I127-Y137 HydrophobicContact CD1-CE1 4.45Å; I127-Y137 HydrophobicContact CD1-CG 4.37Å; I127-Y137 HydrophobicContact CG1-CE1 4.31Å; I127-Y137 HydrophobicContact CG1-CE2 4.42Å; I127-Y137 HydrophobicContact CG2-CD2 3.94Å; I127-Y137 HydrophobicContact CG2-CE2 3.39Å; I127-T235 WeakPolarHBondContact CA-OG1 3.33Å; I127-T235 PolarHBondContact O-OG1 3Å; I127-P236 HydrophobicContact CG1-CB 4.2Å; I127-P236 HydrophobicContact CG1-CG 4.06Å
128	S	90.4	Very high	89.6	Confident	95 Å²	95	67.5 Å²	67.5	66%	0.664	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-58.7	-25.4	178.6	54.3	0	0	0	0	114	P126 C130	P126-S128 WeakPolarHBondContact CG-OG 3.33Å; P126-S128 PolarHBondContact O-N 2.71Å; S128-C130 VanDerWaalsContact C-N 3.27Å; S128-C130 PolarHBondContact O-N 2.85Å
129	D	91.9	Very high	89	Confident	96 Å²	96	68.6 Å²	68.6	51%	0.513	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-88.3	3.7	-176.8	-64.5	8.8	0	0	0	112.2	P126 I127 K131 T235	P126-D129 WeakPolarHBondContact CD-OD2 3.43Å; P126-D129 HydrophobicContact CG-CB 4.43Å; P126-D129 PolarHBondContact O-N 3.39Å; P126-D129 VanDerWaalsContact O-N 3.12Å; I127-D129 PolarHBondContact O-N 2.79Å; I127-D129 VanDerWaalsContact O-N 3.15Å; D129-K131 PolarHBondContact O-N 3.19Å; D129-T235 HydrophobicContact CB-CG2 4.38Å
130	C	87.1	Confident	88.6	Confident	19 Å²	19	71.7 Å²	71.7	13%	0.128	37%	0.366	C	S	.	.			trans	-65.1	123.1	178	-159	0	0	0	0	110.1	I127 S128 D132 T235	I127-C130 WeakPolarHBondContact O-CB 3.24Å; I127-C130 PolarHBondContact O-N 2.69Å; I127-C130 VanDerWaalsContact O-N 3.11Å; S128-C130 VanDerWaalsContact C-N 3.27Å; S128-C130 PolarHBondContact O-N 2.85Å; C130-D132 VanDerWaalsContact C-N 3.26Å; C130-D132 PolarHBondContact O-N 2.91Å; C130-D132 PolarHBondContact SG-O 3.28Å; C130-T235 WeakPolarHBondContact CA-OG1 3.38Å; C130-T235 WeakPolarHBondContact CB-OG1 3.14Å; C130-T235 PolarHBondContact N-OG1 2.79Å
131	K	85.9	Confident	88.4	Confident	213 Å²	213	72.4 Å²	72.4	93%	0.926	37%	0.371	S	S	*	.	S	Bend	trans	-63.5	-37.2	173.3	-66.6	-177	179	-178.8	0	111.3	D129	D129-K131 PolarHBondContact O-N 3.19Å
132	D	82.2	Confident	88.1	Confident	42 Å²	42	75.9 Å²	75.9	23%	0.225	39%	0.388	C	S	.	.			trans	-95.9	111.1	-178.1	-168.1	-9.3	0	0	0	111.2	C130 T134 K200	C130-D132 VanDerWaalsContact C-N 3.26Å; C130-D132 PolarHBondContact O-N 2.91Å; C130-D132 PolarHBondContact SG-O 3.28Å; D132-T134 VanDerWaalsContact C-N 3.3Å; D132-T134 VanDerWaalsContact OD1-CB 3.31Å; D132-T134 WeakPolarHBondContact OD1-CB 3.4Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.4Å; D132-T134 PolarHBondContact OD1-N 2.83Å; D132-T134 PolarHBondContact OD1-OG1 3.24Å; D132-T134 PolarHBondContact OD2-OG1 2.77Å; D132-K200 IonicContact OD1-NZ 3.97Å; D132-K200 WeakPolarHBondContact OD2-CD 3.34Å; D132-K200 WeakPolarHBondContact OD2-CE 3.29Å; D132-K200 IonicContact OD2-NZ 3.95Å; D132-K200 PolarHBondContact OD2-NZ 3.08Å
133	K	81.1	Confident	88.1	Confident	198 Å²	198	73.4 Å²	73.4	86%	0.861	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.6	178.9	-63.3	-177.8	-179.1	177.6	0	113.4	L135	K133-L135 VanDerWaalsContact C-N 3.29Å
134	T	81.5	Confident	88.2	Confident	89 Å²	89	69.8 Å²	69.8	55%	0.546	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.4	-179.4	64.9	0	0	0	0	113.3	D132 I136 K200	D132-T134 VanDerWaalsContact C-N 3.3Å; D132-T134 VanDerWaalsContact OD1-CB 3.31Å; D132-T134 WeakPolarHBondContact OD1-CB 3.4Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.4Å; D132-T134 PolarHBondContact OD1-N 2.83Å; D132-T134 PolarHBondContact OD1-OG1 3.24Å; D132-T134 PolarHBondContact OD2-OG1 2.77Å; T134-I136 PolarHBondContact O-N 2.96Å; T134-K200 PolarHBondContact OG1-NZ 3.09Å
135	L	82.4	Confident	88.2	Confident	12 Å²	12	70.1 Å²	70.1	6%	0.063	36%	0.364	C	S	.	.			trans	-72.7	124.2	-175.5	-170.7	66.8	0	0	0	112.2	K133 Y137 E181 H182 K200 A234	K133-L135 VanDerWaalsContact C-N 3.29Å; L135-Y137 HydrophobicContact CD2-CD1 4.41Å; L135-Y137 HydrophobicContact CD2-CE1 3.61Å; L135-Y137 HydrophobicContact CG-CE1 4.27Å; L135-Y137 PolarHBondContact O-N 3.29Å; L135-E181 HydrophobicContact CD1-CB 4.29Å; L135-H182 HydrophobicContact CD1-CB 3.87Å; L135-H182 HydrophobicContact CD2-CB 4.45Å; L135-K200 HydrophobicContact CD1-CB 4.24Å; L135-K200 HydrophobicContact CD1-CD 4.42Å; L135-K200 HydrophobicContact CD1-CG 4.07Å; L135-A234 HydrophobicContact CD2-CB 3.89Å
136	I	82.8	Confident	88.2	Confident	98 Å²	98	66.7 Å²	66.7	50%	0.503	36%	0.355	S	S	.	.			trans	-94.4	103	-178.5	-49.9	-179.4	0	0	0	110.3	T134 G138 E181	T134-I136 PolarHBondContact O-N 2.96Å; I136-G138 PolarHBondContact O-N 2.93Å; I136-E181 WeakPolarHBondContact CB-OE2 3.43Å; I136-E181 WeakPolarHBondContact CD1-OE1 3.36Å; I136-E181 WeakPolarHBondContact CG1-OE2 3.41Å; I136-E181 PolarHBondContact N-OE2 3.22Å; I136-E181 VanDerWaalsContact N-OE2 3.12Å
137	Y	78.2	Confident	88.1	Confident	52 Å²	52	67.5 Å²	67.5	20%	0.204	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	112.8	170.9	-56.9	-72.8	0	0	0	110	L55 I127 L135 T235	L55-Y137 HydrophobicContact CD2-CD1 3.28Å; L55-Y137 HydrophobicContact CD2-CE1 4.04Å; L55-Y137 HydrophobicContact CD2-CG 3.97Å; I127-Y137 HydrophobicContact CD1-CD1 4.4Å; I127-Y137 HydrophobicContact CD1-CD2 4.47Å; I127-Y137 HydrophobicContact CD1-CE1 4.45Å; I127-Y137 HydrophobicContact CD1-CG 4.37Å; I127-Y137 HydrophobicContact CG1-CE1 4.31Å; I127-Y137 HydrophobicContact CG1-CE2 4.42Å; I127-Y137 HydrophobicContact CG2-CD2 3.94Å; I127-Y137 HydrophobicContact CG2-CE2 3.39Å; L135-Y137 HydrophobicContact CD2-CD1 4.41Å; L135-Y137 HydrophobicContact CD2-CE1 3.61Å; L135-Y137 HydrophobicContact CG-CE1 4.27Å; L135-Y137 PolarHBondContact O-N 3.29Å; Y137-T235 WeakPolarHBondContact CE1-O 3.39Å; Y137-T235 PolarHBondContact OH-O 2.96Å
138	G	79.3	Confident	88.1	Confident	43 Å²	43	73.6 Å²	73.6	44%	0.443	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	134.6	-16.5	-175.7	0	0	0	0	0	113.6	I136	I136-G138 PolarHBondContact O-N 2.93Å
139	A	85	Confident	88.2	Confident	25 Å²	25	71 Å²	71	21%	0.207	37%	0.372	C	S	.	.	S	Bend	trans	-64.7	159	165.9	0	0	0	0	0	110.9	P141	A139-P141 VanDerWaalsContact O-CD 3.26Å; A139-P141 WeakPolarHBondContact O-CD 3.48Å
140	K	89.6	Confident	88.3	Confident	64 Å²	64	66.6 Å²	66.6	28%	0.278	35%	0.349	S	S	.	.			trans	-69.3	114.8	179	-179.3	162	-176.4	151.5	0	109.8	P170 V172 I175	K140-P170 PolarHBondContact NZ-O 3.45Å; K140-V172 HydrophobicContact CD-CG2 3.64Å; K140-I175 HydrophobicContact CD-CD1 3.82Å; K140-I175 HydrophobicContact CD-CG1 4.37Å
141	P	91.6	Very high	88.6	Confident	15 Å²	15	70.5 Å²	70.5	10%	0.097	37%	0.368	C	S	.	.			trans	-75.6	149.7	-176.6	30.2	-33.9	0	0	0	111.1	A139 L143 F167 F184	A139-P141 VanDerWaalsContact O-CD 3.26Å; A139-P141 WeakPolarHBondContact O-CD 3.48Å; P141-L143 HydrophobicContact CB-CD2 4.39Å; P141-L143 HydrophobicContact CG-CD2 4.21Å; P141-F167 WeakPolarHBondContact CG-O 3.4Å; P141-F184 HydrophobicContact CB-CD2 3.6Å; P141-F184 HydrophobicContact CB-CE2 3.58Å; P141-F184 HydrophobicContact CB-CG 4.22Å; P141-F184 HydrophobicContact CB-CZ 4.19Å; P141-F184 HydrophobicContact CG-CD2 3.85Å; P141-F184 HydrophobicContact CG-CE2 3.65Å
142	M	92.6	Very high	88.9	Confident	81 Å²	81	66.3 Å²	66.3	40%	0.399	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	138.1	159.4	-69.6	-154.7	-70.4	0	0	109.9	V180 H182 Q183 F184 I201	M142-V180 HydrophobicContact CE-CG1 3.6Å; M142-V180 HydrophobicContact CG-CG1 3.91Å; M142-V180 HydrophobicContact SD-CG1 3.77Å; M142-H182 PolarHBondContact N-O 2.95Å; M142-Q183 HydrophobicContact CB-CB 4.19Å; M142-Q183 HydrophobicContact CB-CG 4.33Å; M142-Q183 CarbonylContact O-C 3.56Å; M142-Q183 VanDerWaalsContact O-CA 3.25Å; M142-Q183 WeakPolarHBondContact O-CA 3.34Å; M142-F184 PolarHBondContact O-N 2.73Å; M142-I201 HydrophobicContact CE-CD1 3.22Å; M142-I201 HydrophobicContact CE-CG1 4.12Å
143	L	95.2	Very high	89.4	Confident	52 Å²	52	67.3 Å²	67.3	27%	0.272	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.5	178.5	-54.8	-178	0	0	0	109.9	P141 F145 I164 F167 K168 F184 F186	P141-L143 HydrophobicContact CB-CD2 4.39Å; P141-L143 HydrophobicContact CG-CD2 4.21Å; L143-F145 HydrophobicContact CB-CE2 3.94Å; L143-I164 HydrophobicContact CD1-CB 4.34Å; L143-I164 HydrophobicContact CD1-CG1 4.24Å; L143-I164 HydrophobicContact CD1-CG2 4.25Å; L143-F167 HydrophobicContact CD2-CB 3.93Å; L143-K168 HydrophobicContact CD1-CB 4.31Å; L143-F184 HydrophobicContact CD2-CB 3.9Å; L143-F184 HydrophobicContact CD2-CD2 3.76Å; L143-F184 HydrophobicContact CD2-CG 4.3Å; L143-F186 HydrophobicContact CD2-CE2 4.5Å
144	M	95.7	Very high	90	Very high	72 Å²	72	62.2 Å²	62.2	36%	0.355	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135	174.8	-178.2	-177.6	-81.2	0	0	109.3	Q183 F184 H185 F186	M144-Q183 HydrophobicContact CB-CG 4.17Å; M144-F184 PolarHBondContact N-O 3.36Å; M144-H185 WeakPolarHBondContact O-CA 3.48Å; M144-F186 PolarHBondContact O-N 3.43Å
145	F	96.8	Very high	90.6	Very high	44 Å²	44	60.6 Å²	60.6	19%	0.193	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124	177.5	-66.8	-93.4	0	0	0	108.8	L143 F150 K160 L163 I164 F186	L143-F145 HydrophobicContact CB-CE2 3.94Å; F145-F150 HydrophobicContact CB-CD2 4.18Å; F145-F150 HydrophobicContact CB-CE2 4.3Å; F145-F150 HydrophobicContact CD1-CD2 4.48Å; F145-F150 HydrophobicContact CD1-CE1 4.31Å; F145-F150 HydrophobicContact CD1-CE2 4.07Å; F145-F150 AromaticContact CD1-CZ 3.97Å; F145-F150 HydrophobicContact CD1-CZ 3.97Å; F145-K160 HydrophobicContact CB-CD 4.5Å; F145-K160 HydrophobicContact CD1-CB 4.43Å; F145-K160 HydrophobicContact CD1-CD 4.41Å; F145-K160 HydrophobicContact CD1-CG 3.93Å; F145-K160 HydrophobicContact CD2-CG 4.43Å; F145-K160 HydrophobicContact CE1-CB 4.43Å; F145-K160 HydrophobicContact CE1-CG 4.04Å; F145-K160 HydrophobicContact CG-CD 4.29Å; F145-K160 HydrophobicContact CG-CG 4.15Å; F145-K160 HydrophobicContact CZ-CG 4.35Å; F145-L163 HydrophobicContact CE1-CB 4Å; F145-L163 HydrophobicContact CE1-CD1 4.17Å; F145-L163 HydrophobicContact CZ-CB 4.13Å; F145-I164 HydrophobicContact CE2-CD1 3.98Å; F145-I164 HydrophobicContact CE2-CG1 3.45Å; F145-I164 VanDerWaalsContact CE2-CG1 3.45Å; F145-I164 HydrophobicContact CZ-CD1 4.28Å; F145-I164 HydrophobicContact CZ-CG1 3.5Å; F145-I164 VanDerWaalsContact CZ-CG1 3.5Å; F145-F186 CarbonylContact C-O 3.57Å; F145-F186 WeakPolarHBondContact CA-O 3.09Å; F145-F186 HydrophobicContact CD1-CB 3.67Å; F145-F186 HydrophobicContact CD1-CD2 4.12Å; F145-F186 HydrophobicContact CD1-CG 4.18Å; F145-F186 HydrophobicContact CE1-CB 3.81Å; F145-F186 AromaticContact CE1-CD2 3.54Å; F145-F186 HydrophobicContact CE1-CD2 3.54Å; F145-F186 HydrophobicContact CE1-CE2 4.35Å; F145-F186 AromaticContact CE1-CG 3.8Å; F145-F186 HydrophobicContact CE1-CG 3.8Å; F145-F186 HydrophobicContact CE2-CD2 4.37Å; F145-F186 HydrophobicContact CG-CB 4.45Å; F145-F186 AromaticContact CZ-CD2 3.67Å; F145-F186 HydrophobicContact CZ-CD2 3.67Å; F145-F186 HydrophobicContact CZ-CE2 4.17Å; F145-F186 HydrophobicContact CZ-CG 4.39Å
146	S	95.4	Very high	91.2	Very high	45 Å²	45	60.4 Å²	60.4	32%	0.315	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137	176	-64	0	0	0	0	110.3	F150 H185 F186 I187 L188	S146-F150 WeakPolarHBondContact O-CE2 3.27Å; S146-H185 WeakPolarHBondContact CB-NE2 3.49Å; S146-H185 PolarHBondContact OG-NE2 3.31Å; S146-F186 PolarHBondContact N-O 2.84Å; S146-I187 WeakPolarHBondContact O-CA 3.45Å; S146-L188 PolarHBondContact O-N 3.16Å
147	G	93.1	Very high	91.8	Very high	33 Å²	33	59.6 Å²	59.6	34%	0.34	33%	0.325	S	S	.	.			trans	126.5	128.5	-175.7	0	0	0	0	0	110.9	L149 F150	G147-L149 VanDerWaalsContact C-N 3.3Å; G147-L149 PolarHBondContact O-N 3.45Å; G147-F150 PolarHBondContact O-N 2.89Å
148	E	92.3	Very high	92.6	Very high	157 Å²	157	57.8 Å²	57.8	73%	0.734	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-33.7	-176.6	-64.5	177.1	-178.8	0	0	112.1	F150 N151 L152	E148-F150 PolarHBondContact O-N 3.05Å; E148-F150 VanDerWaalsContact O-N 3.08Å; E148-N151 PolarHBondContact O-N 3.34Å; E148-L152 HydrophobicContact CB-CD1 4.16Å; E148-L152 PolarHBondContact O-N 3.18Å
149	L	93.2	Very high	93.4	Very high	42 Å²	42	55.7 Å²	55.7	22%	0.22	30%	0.298	C	S	.	.	H	α-helix	trans	-53	-33	179	-70.2	172.2	0	0	0	113	G147 N151 L152 D153 Y156 L188 D191	G147-L149 VanDerWaalsContact C-N 3.3Å; G147-L149 PolarHBondContact O-N 3.45Å; L149-N151 PolarHBondContact O-N 3.45Å; L149-N151 VanDerWaalsContact O-N 3.13Å; L149-L152 PolarHBondContact O-N 2.99Å; L149-D153 PolarHBondContact O-N 3.31Å; L149-Y156 HydrophobicContact CB-CD2 3.88Å; L149-Y156 HydrophobicContact CB-CE2 4.44Å; L149-Y156 HydrophobicContact CB-CG 4.3Å; L149-Y156 HydrophobicContact CD2-CE2 4.46Å; L149-Y156 WeakPolarHBondContact O-CB 3.47Å; L149-L188 HydrophobicContact CB-CD2 3.53Å; L149-L188 HydrophobicContact CB-CG 4.33Å; L149-L188 HydrophobicContact CD1-CD2 4.06Å; L149-L188 HydrophobicContact CD1-CG 4.13Å; L149-L188 HydrophobicContact CG-CD2 4.47Å; L149-D191 WeakPolarHBondContact CD1-OD1 3.48Å
150	F	94	Very high	93.9	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.013	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-19.8	176.5	-79.4	-52.9	0	0	0	114.5	F145 S146 G147 E148 Y156 M157 L159 K160 F186 L188 L194	F145-F150 HydrophobicContact CB-CD2 4.18Å; F145-F150 HydrophobicContact CB-CE2 4.3Å; F145-F150 HydrophobicContact CD1-CD2 4.48Å; F145-F150 HydrophobicContact CD1-CE1 4.31Å; F145-F150 HydrophobicContact CD1-CE2 4.07Å; F145-F150 AromaticContact CD1-CZ 3.97Å; F145-F150 HydrophobicContact CD1-CZ 3.97Å; S146-F150 WeakPolarHBondContact O-CE2 3.27Å; G147-F150 PolarHBondContact O-N 2.89Å; E148-F150 PolarHBondContact O-N 3.05Å; E148-F150 VanDerWaalsContact O-N 3.08Å; F150-Y156 WeakPolarHBondContact CD1-O 3.24Å; F150-M157 VanDerWaalsContact O-CG 3.23Å; F150-M157 WeakPolarHBondContact O-CG 3.2Å; F150-L159 HydrophobicContact CE1-CD2 4.46Å; F150-K160 HydrophobicContact CB-CD 3.99Å; F150-K160 HydrophobicContact CD1-CB 3.69Å; F150-K160 HydrophobicContact CD1-CD 4.37Å; F150-K160 HydrophobicContact CD1-CG 4.49Å; F150-K160 HydrophobicContact CE1-CB 4.11Å; F150-K160 HydrophobicContact CG-CB 4.44Å; F150-K160 HydrophobicContact CG-CD 4.31Å; F150-F186 HydrophobicContact CZ-CB 4.46Å; F150-L188 HydrophobicContact CD1-CD2 4.11Å; F150-L188 HydrophobicContact CD2-CB 3.94Å; F150-L188 HydrophobicContact CD2-CD2 4.37Å; F150-L188 HydrophobicContact CE1-CB 4.43Å; F150-L188 HydrophobicContact CE1-CD2 4.09Å; F150-L188 HydrophobicContact CE2-CB 3.43Å; F150-L188 VanDerWaalsContact CE2-CB 3.43Å; F150-L188 HydrophobicContact CE2-CD2 4.34Å; F150-L188 HydrophobicContact CG-CD2 4.27Å; F150-L188 HydrophobicContact CZ-CB 3.72Å; F150-L188 HydrophobicContact CZ-CD2 4.21Å; F150-L194 HydrophobicContact CZ-CD1 3.81Å
151	N	92.6	Very high	94.2	Very high	100 Å²	100	55.5 Å²	55.5	54%	0.535	30%	0.296	S	S	.	.	H	α-helix	trans	-116.1	-0.3	-179	-56	-38.2	0	0	0	112.8	E148 L149 M157 K160	E148-N151 PolarHBondContact O-N 3.34Å; L149-N151 PolarHBondContact O-N 3.45Å; L149-N151 VanDerWaalsContact O-N 3.13Å; N151-M157 WeakPolarHBondContact O-CE 3.12Å; N151-K160 PolarHBondContact OD1-NZ 3.33Å
152	L	93.3	Very high	94.5	Very high	125 Å²	125	54.8 Å²	54.8	65%	0.654	29%	0.292	S	S	*	.	H	α-helix	trans	-106.4	-55.2	-178.2	-67.2	174.1	0	0	0	111.8	E148 L149	E148-L152 HydrophobicContact CB-CD1 4.16Å; E148-L152 PolarHBondContact O-N 3.18Å; L149-L152 PolarHBondContact O-N 2.99Å
153	D	92.7	Very high	94.7	Very high	63 Å²	63	51 Å²	51	34%	0.337	27%	0.273	S	S	.	.			trans	-99.4	130.9	-175.4	174.2	13	0	0	0	111.5	L149 K155 Y156 M157	L149-D153 PolarHBondContact O-N 3.31Å; D153-K155 PolarHBondContact O-N 2.93Å; D153-K155 VanDerWaalsContact O-N 3.12Å; D153-K155 PolarHBondContact OD1-N 3.11Å; D153-Y156 HydrophobicContact CB-CD2 3.9Å; D153-Y156 HydrophobicContact CB-CE2 4.38Å; D153-Y156 PolarHBondContact O-N 3.23Å; D153-Y156 WeakPolarHBondContact OD2-CE2 3.46Å; D153-M157 WeakPolarHBondContact O-CG 3.41Å; D153-M157 PolarHBondContact O-N 3.26Å
154	T	92.6	Very high	94.7	Very high	92 Å²	92	51.3 Å²	51.3	56%	0.564	28%	0.275	S	S	*	.	H	α-helix	trans	-47.8	-36.1	175.3	61.2	0	0	0	0	113.5	M157 T158	T154-M157 PolarHBondContact O-N 3.15Å; T154-T158 WeakPolarHBondContact O-CB 3.47Å; T154-T158 VanDerWaalsContact O-CG2 3.28Å; T154-T158 WeakPolarHBondContact O-CG2 3.38Å; T154-T158 PolarHBondContact O-N 3.12Å; T154-T158 PolarHBondContact O-OG1 3.2Å
155	K	94.3	Very high	94.7	Very high	55 Å²	55	48.8 Å²	48.8	24%	0.239	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-40.2	177.9	-179.2	-170.8	171.9	-164.9	0	112.5	F117 D153 T158 L159 V245 L247	F117-K155 HydrophobicContact CE1-CG 4.25Å; F117-K155 WeakPolarHBondContact CZ-O 3.45Å; D153-K155 PolarHBondContact O-N 2.93Å; D153-K155 VanDerWaalsContact O-N 3.12Å; D153-K155 PolarHBondContact OD1-N 3.11Å; K155-T158 WeakPolarHBondContact CA-OG1 2.97Å; K155-T158 PolarHBondContact O-OG1 3.02Å; K155-L159 PolarHBondContact O-N 3.47Å; K155-V245 HydrophobicContact CG-CG1 4.5Å; K155-L247 HydrophobicContact CB-CD1 4.45Å
156	Y	95.2	Very high	94.6	Very high	8 Å²	8	46.9 Å²	46.9	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-85.7	-28.6	179.7	-58.5	-64.6	0	0	0	111.6	L149 F150 D153 T158 L159 K160 L188 D191 L242	L149-Y156 HydrophobicContact CB-CD2 3.88Å; L149-Y156 HydrophobicContact CB-CE2 4.44Å; L149-Y156 HydrophobicContact CB-CG 4.3Å; L149-Y156 HydrophobicContact CD2-CE2 4.46Å; L149-Y156 WeakPolarHBondContact O-CB 3.47Å; F150-Y156 WeakPolarHBondContact CD1-O 3.24Å; D153-Y156 HydrophobicContact CB-CD2 3.9Å; D153-Y156 HydrophobicContact CB-CE2 4.38Å; D153-Y156 PolarHBondContact O-N 3.23Å; D153-Y156 WeakPolarHBondContact OD2-CE2 3.46Å; Y156-T158 VanDerWaalsContact C-N 3.34Å; Y156-L159 HydrophobicContact CD1-CD2 4.28Å; Y156-L159 PolarHBondContact O-N 3.28Å; Y156-K160 WeakPolarHBondContact O-CB 3.45Å; Y156-K160 PolarHBondContact O-N 2.92Å; Y156-L188 HydrophobicContact CD1-CD1 4.42Å; Y156-L188 HydrophobicContact CD1-CD2 3.53Å; Y156-L188 HydrophobicContact CD2-CD2 4.31Å; Y156-L188 HydrophobicContact CE1-CD1 4.42Å; Y156-L188 HydrophobicContact CE1-CD2 4.13Å; Y156-L188 HydrophobicContact CG-CD2 3.66Å; Y156-D191 WeakPolarHBondContact OH-CA 3.02Å; Y156-D191 WeakPolarHBondContact OH-CB 3.36Å; Y156-D191 PolarHBondContact OH-O 3.35Å; Y156-L242 HydrophobicContact CE1-CD1 3.92Å
157	M	94.8	Very high	94.5	Very high	81 Å²	81	45.5 Å²	45.5	40%	0.399	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-44.5	168.8	-70	-178.8	-178.7	0	0	111.7	F150 N151 D153 T154 K160 S161	F150-M157 VanDerWaalsContact O-CG 3.23Å; F150-M157 WeakPolarHBondContact O-CG 3.2Å; N151-M157 WeakPolarHBondContact O-CE 3.12Å; D153-M157 WeakPolarHBondContact O-CG 3.41Å; D153-M157 PolarHBondContact O-N 3.26Å; T154-M157 PolarHBondContact O-N 3.15Å; M157-K160 PolarHBondContact O-N 3.4Å; M157-S161 WeakPolarHBondContact O-CB 3.37Å; M157-S161 PolarHBondContact O-N 3.27Å
158	T	95.4	Very high	94.5	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.08	24%	0.239	C	C	.	.	H	α-helix	trans	-65.7	-41.6	176.6	46.5	0	0	0	0	111.1	T154 K155 Y156 S161 L162 L247 W253	T154-T158 WeakPolarHBondContact O-CB 3.47Å; T154-T158 VanDerWaalsContact O-CG2 3.28Å; T154-T158 WeakPolarHBondContact O-CG2 3.38Å; T154-T158 PolarHBondContact O-N 3.12Å; T154-T158 PolarHBondContact O-OG1 3.2Å; K155-T158 WeakPolarHBondContact CA-OG1 2.97Å; K155-T158 PolarHBondContact O-OG1 3.02Å; Y156-T158 VanDerWaalsContact C-N 3.34Å; T158-S161 WeakPolarHBondContact O-CB 3.4Å; T158-S161 PolarHBondContact O-N 3.17Å; T158-L162 WeakPolarHBondContact O-CB 3.41Å; T158-L162 PolarHBondContact O-N 3.45Å; T158-L247 HydrophobicContact CG2-CD2 4.44Å; T158-L247 WeakPolarHBondContact OG1-CD2 3.45Å; T158-W253 HydrophobicContact CG2-CH2 3.63Å; T158-W253 HydrophobicContact CG2-CZ2 4.05Å; T158-W253 HydrophobicContact CG2-CZ3 3.91Å
159	L	96	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.1	-46.7	171.9	178.6	62.4	0	0	0	112.6	F117 F150 K155 Y156 S161 L162 L163 L194 L242	F117-L159 HydrophobicContact CB-CD1 4.23Å; F117-L159 HydrophobicContact CD1-CB 4.2Å; F117-L159 HydrophobicContact CD1-CD1 3.78Å; F117-L159 HydrophobicContact CD1-CG 4.41Å; F117-L159 HydrophobicContact CD2-CD1 4.36Å; F117-L159 HydrophobicContact CE1-CB 3.72Å; F117-L159 HydrophobicContact CE1-CD1 4.19Å; F117-L159 HydrophobicContact CE1-CG 4.39Å; F117-L159 HydrophobicContact CE2-CB 4.42Å; F117-L159 HydrophobicContact CG-CD1 3.86Å; F117-L159 HydrophobicContact CZ-CB 3.84Å; F150-L159 HydrophobicContact CE1-CD2 4.46Å; K155-L159 PolarHBondContact O-N 3.47Å; Y156-L159 HydrophobicContact CD1-CD2 4.28Å; Y156-L159 PolarHBondContact O-N 3.28Å; L159-S161 VanDerWaalsContact C-N 3.33Å; L159-S161 PolarHBondContact O-N 3.18Å; L159-L162 PolarHBondContact O-N 2.91Å; L159-L163 HydrophobicContact CD1-CD1 4.17Å; L159-L163 HydrophobicContact CD1-CG 4.22Å; L159-L163 HydrophobicContact CG-CD1 4.05Å; L159-L163 HydrophobicContact CG-CG 4.49Å; L159-L163 WeakPolarHBondContact O-CG 3.47Å; L159-L163 PolarHBondContact O-N 3.16Å; L159-L194 HydrophobicContact CD2-CD2 4.39Å; L159-L242 HydrophobicContact CD2-CD1 4.41Å; L159-L242 HydrophobicContact CD2-CD2 3.61Å
160	K	96.4	Very high	94.2	Very high	54 Å²	54	40.8 Å²	40.8	24%	0.235	22%	0.22	C	C	.	.	H	α-helix	trans	-57.6	-47.1	175.5	172	173.3	171.3	-174	0	110.8	F145 F150 N151 Y156 M157 L162 L163 I164	F145-K160 HydrophobicContact CB-CD 4.5Å; F145-K160 HydrophobicContact CD1-CB 4.43Å; F145-K160 HydrophobicContact CD1-CD 4.41Å; F145-K160 HydrophobicContact CD1-CG 3.93Å; F145-K160 HydrophobicContact CD2-CG 4.43Å; F145-K160 HydrophobicContact CE1-CB 4.43Å; F145-K160 HydrophobicContact CE1-CG 4.04Å; F145-K160 HydrophobicContact CG-CD 4.29Å; F145-K160 HydrophobicContact CG-CG 4.15Å; F145-K160 HydrophobicContact CZ-CG 4.35Å; F150-K160 HydrophobicContact CB-CD 3.99Å; F150-K160 HydrophobicContact CD1-CB 3.69Å; F150-K160 HydrophobicContact CD1-CD 4.37Å; F150-K160 HydrophobicContact CD1-CG 4.49Å; F150-K160 HydrophobicContact CE1-CB 4.11Å; F150-K160 HydrophobicContact CG-CB 4.44Å; F150-K160 HydrophobicContact CG-CD 4.31Å; N151-K160 PolarHBondContact OD1-NZ 3.33Å; Y156-K160 WeakPolarHBondContact O-CB 3.45Å; Y156-K160 PolarHBondContact O-N 2.92Å; M157-K160 PolarHBondContact O-N 3.4Å; K160-L162 VanDerWaalsContact C-N 3.33Å; K160-L162 PolarHBondContact O-N 3.02Å; K160-L163 PolarHBondContact O-N 3.37Å; K160-I164 HydrophobicContact CG-CD1 3.88Å; K160-I164 VanDerWaalsContact O-CG1 3.23Å; K160-I164 WeakPolarHBondContact O-CG1 3.36Å; K160-I164 PolarHBondContact O-N 3.3Å
161	S	96.1	Very high	94	Very high	30 Å²	30	45.3 Å²	45.3	21%	0.21	25%	0.248	C	C	.	.	H	α-helix	trans	-57	-45.4	175.2	177.7	0	0	0	0	112.1	R107 M157 T158 L159 I164 D165	R107-S161 PolarHBondContact NH1-OG 3.4Å; R107-S161 PolarHBondContact NH2-OG 3.02Å; M157-S161 WeakPolarHBondContact O-CB 3.37Å; M157-S161 PolarHBondContact O-N 3.27Å; T158-S161 WeakPolarHBondContact O-CB 3.4Å; T158-S161 PolarHBondContact O-N 3.17Å; L159-S161 VanDerWaalsContact C-N 3.33Å; L159-S161 PolarHBondContact O-N 3.18Å; S161-I164 PolarHBondContact O-N 3.1Å; S161-D165 PolarHBondContact O-N 3.34Å
162	L	96.7	Very high	93.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-45.6	178.1	178.9	159	0	0	0	111.9	F105 R107 F117 T158 L159 K160 I164 D165 L166	F105-L162 HydrophobicContact CB-CD1 4.29Å; F105-L162 HydrophobicContact CB-CD2 3.77Å; F105-L162 HydrophobicContact CD2-CD2 4.35Å; F105-L162 HydrophobicContact CG-CD2 4.36Å; R107-L162 HydrophobicContact CG-CD1 4.31Å; R107-L162 HydrophobicContact CG-CG 4.18Å; F117-L162 HydrophobicContact CD2-CD1 3.76Å; F117-L162 HydrophobicContact CE2-CD1 4.4Å; T158-L162 WeakPolarHBondContact O-CB 3.41Å; T158-L162 PolarHBondContact O-N 3.45Å; L159-L162 PolarHBondContact O-N 2.91Å; K160-L162 VanDerWaalsContact C-N 3.33Å; K160-L162 PolarHBondContact O-N 3.02Å; L162-I164 VanDerWaalsContact C-N 3.35Å; L162-D165 PolarHBondContact O-N 3.31Å; L162-L166 WeakPolarHBondContact O-CB 3.46Å; L162-L166 PolarHBondContact O-N 2.95Å
163	L	96.5	Very high	93.9	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-65.6	-38.4	179.7	-69.1	171.5	0	0	0	111.8	F105 F145 L159 K160 L166 F167 F186 L194	F105-L163 HydrophobicContact CE2-CD2 4.41Å; F145-L163 HydrophobicContact CE1-CB 4Å; F145-L163 HydrophobicContact CE1-CD1 4.17Å; F145-L163 HydrophobicContact CZ-CB 4.13Å; L159-L163 HydrophobicContact CD1-CD1 4.17Å; L159-L163 HydrophobicContact CD1-CG 4.22Å; L159-L163 HydrophobicContact CG-CD1 4.05Å; L159-L163 HydrophobicContact CG-CG 4.49Å; L159-L163 WeakPolarHBondContact O-CG 3.47Å; L159-L163 PolarHBondContact O-N 3.16Å; K160-L163 PolarHBondContact O-N 3.37Å; L163-L166 PolarHBondContact O-N 3.06Å; L163-F167 HydrophobicContact CD2-CE2 4.14Å; L163-F167 WeakPolarHBondContact O-CD2 3.38Å; L163-F167 PolarHBondContact O-N 3.15Å; L163-F186 HydrophobicContact CB-CZ 4.47Å; L163-F186 HydrophobicContact CD1-CD1 3.83Å; L163-F186 HydrophobicContact CD1-CE1 4.1Å; L163-F186 HydrophobicContact CD1-CG 4.23Å; L163-F186 HydrophobicContact CD2-CE1 3.99Å; L163-F186 HydrophobicContact CD2-CZ 4.42Å; L163-F186 HydrophobicContact CG-CE1 4.46Å; L163-L194 HydrophobicContact CD1-CD2 4.04Å
164	I	96.4	Very high	93.8	Very high	59 Å²	59	52.9 Å²	52.9	30%	0.303	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-51	172.6	-68.8	165.6	0	0	0	110	L143 F145 K160 S161 L162 L166 F167 K168	L143-I164 HydrophobicContact CD1-CB 4.34Å; L143-I164 HydrophobicContact CD1-CG1 4.24Å; L143-I164 HydrophobicContact CD1-CG2 4.25Å; F145-I164 HydrophobicContact CE2-CD1 3.98Å; F145-I164 HydrophobicContact CE2-CG1 3.45Å; F145-I164 VanDerWaalsContact CE2-CG1 3.45Å; F145-I164 HydrophobicContact CZ-CD1 4.28Å; F145-I164 HydrophobicContact CZ-CG1 3.5Å; F145-I164 VanDerWaalsContact CZ-CG1 3.5Å; K160-I164 HydrophobicContact CG-CD1 3.88Å; K160-I164 VanDerWaalsContact O-CG1 3.23Å; K160-I164 WeakPolarHBondContact O-CG1 3.36Å; K160-I164 PolarHBondContact O-N 3.3Å; S161-I164 PolarHBondContact O-N 3.1Å; L162-I164 VanDerWaalsContact C-N 3.35Å; I164-L166 VanDerWaalsContact C-N 3.25Å; I164-L166 PolarHBondContact O-N 3.12Å; I164-F167 PolarHBondContact O-N 3.24Å; I164-K168 WeakPolarHBondContact O-CB 3.39Å; I164-K168 VanDerWaalsContact O-CG 3.28Å; I164-K168 WeakPolarHBondContact O-CG 3.2Å; I164-K168 PolarHBondContact O-N 3.13Å
165	D	95.2	Very high	93.7	Very high	18 Å²	18	53 Å²	53	10%	0.096	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-34.4	178.2	-88.5	-25.3	0	0	0	113.1	K31 M89 R107 S161 L162 K168	K31-D165 HydrophobicContact CD-CB 4.27Å; K31-D165 VanDerWaalsContact NZ-CG 3.28Å; K31-D165 IonicContact NZ-OD1 2.79Å; K31-D165 PolarHBondContact NZ-OD1 3.17Å; K31-D165 IonicContact NZ-OD2 3.93Å; K31-D165 PolarHBondContact NZ-OD2 2.94Å; M89-D165 HydrophobicContact CE-CB 4.04Å; M89-D165 HydrophobicContact SD-CB 3.97Å; R107-D165 IonicContact CZ-OD2 2.74Å; R107-D165 IonicContact NH1-OD2 2.79Å; R107-D165 PolarHBondContact NH1-OD2 2.99Å; S161-D165 PolarHBondContact O-N 3.34Å; L162-D165 PolarHBondContact O-N 3.31Å; D165-K168 IonicContact OD1-NZ 3.22Å; D165-K168 PolarHBondContact OD1-NZ 2.65Å
166	L	95.2	Very high	93.4	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-69.5	-42.5	-179.1	-170.4	63.2	0	0	0	111.4	T33 K56 M89 V91 F105 L162 L163 I164	T33-L166 HydrophobicContact CG2-CD1 4.04Å; K56-L166 HydrophobicContact CD-CD1 4.39Å; K56-L166 PolarHBondContact NZ-O 3.28Å; M89-L166 HydrophobicContact CE-CB 3.63Å; M89-L166 HydrophobicContact CE-CD1 3.75Å; M89-L166 HydrophobicContact CE-CG 4.27Å; M89-L166 HydrophobicContact SD-CD1 4.37Å; V91-L166 HydrophobicContact CG2-CD1 4.27Å; F105-L166 HydrophobicContact CD1-CD2 3.91Å; F105-L166 HydrophobicContact CD2-CD2 4.41Å; F105-L166 HydrophobicContact CE1-CD2 3.81Å; F105-L166 HydrophobicContact CE2-CD2 4.32Å; F105-L166 HydrophobicContact CG-CD2 4.22Å; F105-L166 HydrophobicContact CZ-CD2 4.03Å; L162-L166 WeakPolarHBondContact O-CB 3.46Å; L162-L166 PolarHBondContact O-N 2.95Å; L163-L166 PolarHBondContact O-N 3.06Å; I164-L166 VanDerWaalsContact C-N 3.25Å; I164-L166 PolarHBondContact O-N 3.12Å
167	F	93.8	Very high	92.8	Very high	16 Å²	16	65.2 Å²	65.2	7%	0.07	33%	0.329	C	S	.	.	H	α-helix	trans	-110	-8.9	-168.5	-67.9	-74.9	0	0	0	115.7	L52 L55 P141 L143 L163 I164 G169 F184 F186	L52-F167 HydrophobicContact CD1-CE1 3.61Å; L52-F167 HydrophobicContact CD1-CZ 3.8Å; L55-F167 HydrophobicContact CD1-CE1 4.24Å; P141-F167 WeakPolarHBondContact CG-O 3.4Å; L143-F167 HydrophobicContact CD2-CB 3.93Å; L163-F167 HydrophobicContact CD2-CE2 4.14Å; L163-F167 WeakPolarHBondContact O-CD2 3.38Å; L163-F167 PolarHBondContact O-N 3.15Å; I164-F167 PolarHBondContact O-N 3.24Å; F167-G169 PolarHBondContact O-N 3.34Å; F167-G169 VanDerWaalsContact O-N 3.09Å; F167-F184 HydrophobicContact CB-CD2 3.83Å; F167-F184 HydrophobicContact CB-CE2 4.08Å; F167-F184 AromaticContact CD1-CD2 3.96Å; F167-F184 HydrophobicContact CD1-CD2 3.96Å; F167-F184 AromaticContact CD1-CE2 3.67Å; F167-F184 HydrophobicContact CD1-CE2 3.67Å; F167-F184 HydrophobicContact CD1-CZ 4.49Å; F167-F184 HydrophobicContact CE1-CE2 4.5Å; F167-F184 HydrophobicContact CG-CD2 4.07Å; F167-F184 HydrophobicContact CG-CE2 4.2Å; F167-F186 HydrophobicContact CD2-CE1 4.36Å; F167-F186 HydrophobicContact CD2-CE2 4.24Å; F167-F186 AromaticContact CD2-CZ 3.48Å; F167-F186 HydrophobicContact CD2-CZ 3.48Å; F167-F186 VanDerWaalsContact CD2-CZ 3.48Å; F167-F186 HydrophobicContact CE2-CE1 4.09Å; F167-F186 AromaticContact CE2-CZ 3.62Å; F167-F186 HydrophobicContact CE2-CZ 3.62Å; F167-F186 HydrophobicContact CG-CZ 4.25Å; F167-F186 HydrophobicContact CZ-CZ 4.49Å
168	K	91.8	Very high	92.3	Very high	60 Å²	60	68.9 Å²	68.9	26%	0.261	35%	0.349	S	S	.	.	S	Bend	trans	-60.3	-21.7	-177.8	65.8	-175.4	-172.4	-168.6	0	115.3	L143 I164 D165	L143-K168 HydrophobicContact CD1-CB 4.31Å; I164-K168 WeakPolarHBondContact O-CB 3.39Å; I164-K168 VanDerWaalsContact O-CG 3.28Å; I164-K168 WeakPolarHBondContact O-CG 3.2Å; I164-K168 PolarHBondContact O-N 3.13Å; D165-K168 IonicContact OD1-NZ 3.22Å; D165-K168 PolarHBondContact OD1-NZ 2.65Å
169	G	89.6	Confident	91.8	Very high	22 Å²	22	69.3 Å²	69.3	23%	0.227	36%	0.357	C	S	.	.			trans	67.8	-155.6	-174.6	0	0	0	0	0	113	F167	F167-G169 PolarHBondContact O-N 3.34Å; F167-G169 VanDerWaalsContact O-N 3.09Å
170	P	90.6	Very high	91.4	Very high	52 Å²	52	71.2 Å²	71.2	34%	0.338	37%	0.368	S	S	.	.	S	Bend	trans	-70.6	145.3	-177.6	28	-34.1	0	0	0	113.1	D30 K140 V172	D30-P170 VanDerWaalsContact OD1-CA 3.3Å; D30-P170 WeakPolarHBondContact OD1-CA 3.32Å; D30-P170 WeakPolarHBondContact OD2-CA 3.38Å; D30-P170 VanDerWaalsContact OD2-CB 3.28Å; D30-P170 WeakPolarHBondContact OD2-CB 3.34Å; K140-P170 PolarHBondContact NZ-O 3.45Å; P170-V172 HydrophobicContact CB-CG1 4.49Å; P170-V172 HydrophobicContact CG-CG1 4.47Å; P170-V172 PolarHBondContact O-N 2.82Å
171	T	89.9	Confident	91.1	Very high	97 Å²	97	70.8 Å²	70.8	60%	0.595	37%	0.367	S	S	*	.			trans	-72.8	121.3	169.3	55	0	0	0	0	109.6	D30	D30-T171 PolarHBondContact OD1-N 3.38Å; D30-T171 PolarHBondContact OD1-OG1 3.44Å
172	V	90.7	Very high	90.8	Very high	71 Å²	71	69.5 Å²	69.5	43%	0.43	36%	0.358	S	S	.	.			trans	-134.6	140.5	-178	-63.8	0	0	0	0	109.1	K140 P170 I175	K140-V172 HydrophobicContact CD-CG2 3.64Å; P170-V172 HydrophobicContact CB-CG1 4.49Å; P170-V172 HydrophobicContact CG-CG1 4.47Å; P170-V172 PolarHBondContact O-N 2.82Å; V172-I175 HydrophobicContact CG2-CD1 4.17Å; V172-I175 HydrophobicContact CG2-CG1 3.61Å
173	E	91.7	Very high	90.7	Very high	192 Å²	192	70.1 Å²	70.1	90%	0.897	36%	0.361	S	S	*	.	S	Bend	trans	-77.1	-34.7	179	-64.3	-180	176.9	0	0	112.6
174	K	92.1	Very high	90.6	Very high	185 Å²	185	70.3 Å²	70.3	80%	0.804	36%	0.361	S	S	*	.			trans	-132	140.1	-177	-61.7	-179.5	-175.6	176.8	0	109.7
175	I	89.7	Confident	90.6	Very high	95 Å²	95	68.1 Å²	68.1	49%	0.487	35%	0.35	S	S	.	.			trans	-120.7	133.7	178.1	-60.9	170	0	0	0	107.6	K140 V172 V180	K140-I175 HydrophobicContact CD-CD1 3.82Å; K140-I175 HydrophobicContact CD-CG1 4.37Å; V172-I175 HydrophobicContact CG2-CD1 4.17Å; V172-I175 HydrophobicContact CG2-CG1 3.61Å; I175-V180 HydrophobicContact CG2-CG2 3.91Å
176	R	88.1	Confident	90.7	Very high	213 Å²	213	67.3 Å²	67.3	80%	0.804	35%	0.346	S	S	*	.			trans	-71.9	136.5	171.2	-68.4	-179.5	175.3	175.7	-2	108.7	L178 G179	R176-L178 PolarHBondContact O-N 2.88Å; R176-G179 WeakPolarHBondContact O-CA 3.46Å; R176-G179 PolarHBondContact O-N 3.42Å
177	T	83.4	Confident	90.8	Very high	105 Å²	105	69.1 Å²	69.1	64%	0.644	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-54.8	-39.3	178.4	-45.5	0	0	0	0	112.4	G179 V180 L203	T177-G179 PolarHBondContact O-N 3.2Å; T177-V180 PolarHBondContact O-N 3.26Å; T177-L203 HydrophobicContact CG2-CD1 4.01Å
178	L	84.4	Confident	90.8	Very high	158 Å²	158	68.7 Å²	68.7	83%	0.827	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-63.6	-23.6	175.5	-66.9	174.2	0	0	0	113.8	R176 V180 E181	R176-L178 PolarHBondContact O-N 2.88Å; L178-V180 VanDerWaalsContact C-N 3.26Å; L178-V180 PolarHBondContact O-N 3Å; L178-E181 WeakPolarHBondContact O-CG 3.47Å
179	G	84.7	Confident	90.7	Very high	23 Å²	23	70.1 Å²	70.1	24%	0.237	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-80.5	-3.9	178.8	0	0	0	0	0	114.1	R176 T177 E181	R176-G179 WeakPolarHBondContact O-CA 3.46Å; R176-G179 PolarHBondContact O-N 3.42Å; T177-G179 PolarHBondContact O-N 3.2Å; G179-E181 VanDerWaalsContact C-N 3.32Å; G179-E181 PolarHBondContact O-N 3.36Å
180	V	87	Confident	90.7	Very high	39 Å²	39	71.2 Å²	71.2	24%	0.236	38%	0.375	C	S	.	.			trans	-89	73.5	176.6	-173.3	0	0	0	0	108.7	M142 I175 T177 L178 I201	M142-V180 HydrophobicContact CE-CG1 3.6Å; M142-V180 HydrophobicContact CG-CG1 3.91Å; M142-V180 HydrophobicContact SD-CG1 3.77Å; I175-V180 HydrophobicContact CG2-CG2 3.91Å; T177-V180 PolarHBondContact O-N 3.26Å; L178-V180 VanDerWaalsContact C-N 3.26Å; L178-V180 PolarHBondContact O-N 3Å; V180-I201 HydrophobicContact CG1-CD1 4.23Å
181	E	89.3	Confident	90.5	Very high	45 Å²	45	73.1 Å²	73.1	21%	0.21	38%	0.382	C	S	.	.			trans	-96.3	-34.8	-170.8	-64.6	-174	-174.8	0	0	114.1	L135 I136 L178 G179 K200 I201	L135-E181 HydrophobicContact CD1-CB 4.29Å; I136-E181 WeakPolarHBondContact CB-OE2 3.43Å; I136-E181 WeakPolarHBondContact CD1-OE1 3.36Å; I136-E181 WeakPolarHBondContact CG1-OE2 3.41Å; I136-E181 PolarHBondContact N-OE2 3.22Å; I136-E181 VanDerWaalsContact N-OE2 3.12Å; L178-E181 WeakPolarHBondContact O-CG 3.47Å; G179-E181 VanDerWaalsContact C-N 3.32Å; G179-E181 PolarHBondContact O-N 3.36Å; E181-K200 WeakPolarHBondContact O-CA 3.37Å; E181-I201 PolarHBondContact O-N 3.36Å
182	H	91.1	Very high	90.5	Very high	3 Å²	3	75.6 Å²	75.6	1%	0.014	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	154.7	-176.1	59.1	-80.1	0	0	0	113.8	L135 M142 F184 V198 R199 I201	L135-H182 HydrophobicContact CD1-CB 3.87Å; L135-H182 HydrophobicContact CD2-CB 4.45Å; M142-H182 PolarHBondContact N-O 2.95Å; H182-F184 AromaticContact CD2-CE1 3.64Å; H182-F184 AromaticContact CD2-CZ 3.84Å; H182-F184 AromaticContact NE2-CZ 3.81Å; H182-V198 HydrophobicContact CB-CG1 4.45Å; H182-R199 CarbonylContact C-O 3.46Å; H182-R199 VanDerWaalsContact CA-O 3.26Å; H182-R199 WeakPolarHBondContact CA-O 3.38Å; H182-I201 VanDerWaalsContact C-CD1 3.49Å
183	Q	93.2	Very high	90.7	Very high	14 Å²	14	75.6 Å²	75.6	7%	0.065	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.6	175	174.3	175.4	63.7	0	0	110.3	M142 M144 V198 R199 I201	M142-Q183 HydrophobicContact CB-CB 4.19Å; M142-Q183 HydrophobicContact CB-CG 4.33Å; M142-Q183 CarbonylContact O-C 3.56Å; M142-Q183 VanDerWaalsContact O-CA 3.25Å; M142-Q183 WeakPolarHBondContact O-CA 3.34Å; M144-Q183 HydrophobicContact CB-CG 4.17Å; Q183-V198 WeakPolarHBondContact O-CA 3.5Å; Q183-R199 PolarHBondContact N-O 3.45Å; Q183-R199 PolarHBondContact O-N 2.94Å; Q183-I201 HydrophobicContact CB-CD1 3.99Å; Q183-I201 HydrophobicContact CB-CG1 4.44Å
184	F	95	Very high	90.9	Very high	5 Å²	5	66.5 Å²	66.5	2%	0.022	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.7	163.2	-61	-29.5	0	0	0	109.5	L55 P141 M142 L143 M144 F167 H182 F186 L196 V198	L55-F184 HydrophobicContact CD1-CE1 4.41Å; L55-F184 HydrophobicContact CD1-CZ 3.95Å; L55-F184 HydrophobicContact CD2-CE1 4.46Å; L55-F184 HydrophobicContact CD2-CZ 4.02Å; L55-F184 HydrophobicContact CG-CZ 4.44Å; P141-F184 HydrophobicContact CB-CD2 3.6Å; P141-F184 HydrophobicContact CB-CE2 3.58Å; P141-F184 HydrophobicContact CB-CG 4.22Å; P141-F184 HydrophobicContact CB-CZ 4.19Å; P141-F184 HydrophobicContact CG-CD2 3.85Å; P141-F184 HydrophobicContact CG-CE2 3.65Å; M142-F184 PolarHBondContact O-N 2.73Å; L143-F184 HydrophobicContact CD2-CB 3.9Å; L143-F184 HydrophobicContact CD2-CD2 3.76Å; L143-F184 HydrophobicContact CD2-CG 4.3Å; M144-F184 PolarHBondContact N-O 3.36Å; F167-F184 HydrophobicContact CB-CD2 3.83Å; F167-F184 HydrophobicContact CB-CE2 4.08Å; F167-F184 AromaticContact CD1-CD2 3.96Å; F167-F184 HydrophobicContact CD1-CD2 3.96Å; F167-F184 AromaticContact CD1-CE2 3.67Å; F167-F184 HydrophobicContact CD1-CE2 3.67Å; F167-F184 HydrophobicContact CD1-CZ 4.49Å; F167-F184 HydrophobicContact CE1-CE2 4.5Å; F167-F184 HydrophobicContact CG-CD2 4.07Å; F167-F184 HydrophobicContact CG-CE2 4.2Å; H182-F184 AromaticContact CD2-CE1 3.64Å; H182-F184 AromaticContact CD2-CZ 3.84Å; H182-F184 AromaticContact NE2-CZ 3.81Å; F184-F186 HydrophobicContact CB-CE2 3.92Å; F184-F186 HydrophobicContact CB-CZ 4.41Å; F184-L196 HydrophobicContact CB-CD1 4.25Å; F184-V198 HydrophobicContact CD1-CB 4.3Å; F184-V198 HydrophobicContact CD1-CG1 4.01Å; F184-V198 HydrophobicContact CD1-CG2 3.54Å; F184-V198 HydrophobicContact CE1-CB 4.47Å; F184-V198 HydrophobicContact CE1-CG1 3.93Å; F184-V198 HydrophobicContact CE1-CG2 3.7Å
185	H	96.5	Very high	91.1	Very high	14 Å²	14	58.4 Å²	58.4	7%	0.065	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	112	178.2	-173.2	-167	0	0	0	109.4	M144 S146 I187 R197 R199	M144-H185 WeakPolarHBondContact O-CA 3.48Å; S146-H185 WeakPolarHBondContact CB-NE2 3.49Å; S146-H185 PolarHBondContact OG-NE2 3.31Å; H185-I187 VanDerWaalsContact CE1-CG1 3.5Å; H185-I187 WeakPolarHBondContact CE1-CG1 3.43Å; H185-I187 WeakPolarHBondContact NE2-CG1 3.43Å; H185-R197 HydrophobicContact CB-CB 4.35Å; H185-R197 PolarHBondContact N-O 3.37Å; H185-R197 PolarHBondContact O-N 2.9Å; H185-R199 PolarHBondContact ND1-NH1 2.95Å; H185-R199 VanDerWaalsContact ND1-NH1 3.1Å
186	F	97.1	Very high	91.4	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.2	172.8	-64	-81.7	0	0	0	109.2	L143 M144 F145 S146 F150 L163 F167 F184 L194 C195 L196	L143-F186 HydrophobicContact CD2-CE2 4.5Å; M144-F186 PolarHBondContact O-N 3.43Å; F145-F186 CarbonylContact C-O 3.57Å; F145-F186 WeakPolarHBondContact CA-O 3.09Å; F145-F186 HydrophobicContact CD1-CB 3.67Å; F145-F186 HydrophobicContact CD1-CD2 4.12Å; F145-F186 HydrophobicContact CD1-CG 4.18Å; F145-F186 HydrophobicContact CE1-CB 3.81Å; F145-F186 AromaticContact CE1-CD2 3.54Å; F145-F186 HydrophobicContact CE1-CD2 3.54Å; F145-F186 HydrophobicContact CE1-CE2 4.35Å; F145-F186 AromaticContact CE1-CG 3.8Å; F145-F186 HydrophobicContact CE1-CG 3.8Å; F145-F186 HydrophobicContact CE2-CD2 4.37Å; F145-F186 HydrophobicContact CG-CB 4.45Å; F145-F186 AromaticContact CZ-CD2 3.67Å; F145-F186 HydrophobicContact CZ-CD2 3.67Å; F145-F186 HydrophobicContact CZ-CE2 4.17Å; F145-F186 HydrophobicContact CZ-CG 4.39Å; S146-F186 PolarHBondContact N-O 2.84Å; F150-F186 HydrophobicContact CZ-CB 4.46Å; L163-F186 HydrophobicContact CB-CZ 4.47Å; L163-F186 HydrophobicContact CD1-CD1 3.83Å; L163-F186 HydrophobicContact CD1-CE1 4.1Å; L163-F186 HydrophobicContact CD1-CG 4.23Å; L163-F186 HydrophobicContact CD2-CE1 3.99Å; L163-F186 HydrophobicContact CD2-CZ 4.42Å; L163-F186 HydrophobicContact CG-CE1 4.46Å; F167-F186 HydrophobicContact CD2-CE1 4.36Å; F167-F186 HydrophobicContact CD2-CE2 4.24Å; F167-F186 AromaticContact CD2-CZ 3.48Å; F167-F186 HydrophobicContact CD2-CZ 3.48Å; F167-F186 VanDerWaalsContact CD2-CZ 3.48Å; F167-F186 HydrophobicContact CE2-CE1 4.09Å; F167-F186 AromaticContact CE2-CZ 3.62Å; F167-F186 HydrophobicContact CE2-CZ 3.62Å; F167-F186 HydrophobicContact CG-CZ 4.25Å; F167-F186 HydrophobicContact CZ-CZ 4.49Å; F184-F186 HydrophobicContact CB-CE2 3.92Å; F184-F186 HydrophobicContact CB-CZ 4.41Å; F186-L194 HydrophobicContact CB-CD1 4.34Å; F186-L194 HydrophobicContact CD1-CD1 4.5Å; F186-C195 CarbonylContact C-O 3.52Å; F186-C195 WeakPolarHBondContact CA-O 3.47Å; F186-L196 HydrophobicContact CD1-CB 4.49Å; F186-L196 HydrophobicContact CD1-CD1 4.17Å; F186-L196 HydrophobicContact CE1-CB 4.34Å; F186-L196 HydrophobicContact CE1-CD1 3.67Å; F186-L196 HydrophobicContact CE1-CG 4.4Å; F186-L196 HydrophobicContact CE2-CD1 4.43Å; F186-L196 HydrophobicContact CZ-CD1 3.8Å
187	I	97	Very high	91.8	Very high	42 Å²	42	47.3 Å²	47.3	22%	0.215	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.1	-179.9	-54	167	0	0	0	107.9	S146 H185 L194 C195 R197	S146-I187 WeakPolarHBondContact O-CA 3.45Å; H185-I187 VanDerWaalsContact CE1-CG1 3.5Å; H185-I187 WeakPolarHBondContact CE1-CG1 3.43Å; H185-I187 WeakPolarHBondContact NE2-CG1 3.43Å; I187-L194 CarbonylContact O-C 3.56Å; I187-L194 WeakPolarHBondContact O-CA 3.5Å; I187-C195 HydrophobicContact CB-CB 4.24Å; I187-C195 PolarHBondContact N-O 3.04Å; I187-C195 PolarHBondContact O-N 3.42Å; I187-R197 HydrophobicContact CD1-CG 4.38Å
188	L	95.4	Very high	92.3	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	94.8	172.5	-174.5	62.7	0	0	0	108	S146 L149 F150 Y156 S190 L194 L242	S146-L188 PolarHBondContact O-N 3.16Å; L149-L188 HydrophobicContact CB-CD2 3.53Å; L149-L188 HydrophobicContact CB-CG 4.33Å; L149-L188 HydrophobicContact CD1-CD2 4.06Å; L149-L188 HydrophobicContact CD1-CG 4.13Å; L149-L188 HydrophobicContact CG-CD2 4.47Å; F150-L188 HydrophobicContact CD1-CD2 4.11Å; F150-L188 HydrophobicContact CD2-CB 3.94Å; F150-L188 HydrophobicContact CD2-CD2 4.37Å; F150-L188 HydrophobicContact CE1-CB 4.43Å; F150-L188 HydrophobicContact CE1-CD2 4.09Å; F150-L188 HydrophobicContact CE2-CB 3.43Å; F150-L188 VanDerWaalsContact CE2-CB 3.43Å; F150-L188 HydrophobicContact CE2-CD2 4.34Å; F150-L188 HydrophobicContact CG-CD2 4.27Å; F150-L188 HydrophobicContact CZ-CB 3.72Å; F150-L188 HydrophobicContact CZ-CD2 4.21Å; Y156-L188 HydrophobicContact CD1-CD1 4.42Å; Y156-L188 HydrophobicContact CD1-CD2 3.53Å; Y156-L188 HydrophobicContact CD2-CD2 4.31Å; Y156-L188 HydrophobicContact CE1-CD1 4.42Å; Y156-L188 HydrophobicContact CE1-CD2 4.13Å; Y156-L188 HydrophobicContact CG-CD2 3.66Å; L188-S190 VanDerWaalsContact CD1-O 3.24Å; L188-S190 WeakPolarHBondContact CD1-O 3.23Å; L188-L194 HydrophobicContact CD1-CB 4.37Å; L188-L242 HydrophobicContact CD1-CD1 3.78Å
189	S	89.2	Confident	92.7	Very high	89 Å²	89	37.9 Å²	37.9	62%	0.622	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	-29.6	-175.8	-61	0	0	0	0	112.8	N193	S189-N193 PolarHBondContact N-O 2.71Å
190	S	89.2	Confident	93	Very high	45 Å²	45	38.6 Å²	38.6	32%	0.315	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	170.4	176.7	68.6	0	0	0	0	109.8	L188 K192 N193	L188-S190 VanDerWaalsContact CD1-O 3.24Å; L188-S190 WeakPolarHBondContact CD1-O 3.23Å; S190-K192 PolarHBondContact O-N 3.41Å; S190-N193 PolarHBondContact O-N 2.88Å; S190-N193 WeakPolarHBondContact OG-CB 3.44Å; S190-N193 PolarHBondContact OG-N 2.88Å; S190-N193 PolarHBondContact OG-ND2 2.83Å
191	D	86.7	Confident	93.3	Very high	92 Å²	92	37.3 Å²	37.3	49%	0.492	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-20.5	-179.6	-65.2	-11.8	0	0	0	114.6	L149 Y156	L149-D191 WeakPolarHBondContact CD1-OD1 3.48Å; Y156-D191 WeakPolarHBondContact OH-CA 3.02Å; Y156-D191 WeakPolarHBondContact OH-CB 3.36Å; Y156-D191 PolarHBondContact OH-O 3.35Å
192	K	89.8	Confident	93.2	Very high	149 Å²	149	36.9 Å²	36.9	65%	0.648	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.2	-19	-176.3	-64.3	-178.3	-176.9	173.9	0	114.4	S190 D241 L242	S190-K192 PolarHBondContact O-N 3.41Å; K192-D241 CarbonylContact O-C 3.53Å; K192-D241 WeakPolarHBondContact O-CA 3.42Å; K192-L242 PolarHBondContact O-N 2.97Å
193	N	94.4	Very high	93	Very high	71 Å²	71	40.7 Å²	40.7	38%	0.38	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	109.9	-171.3	-64.4	-34.5	0	0	0	111	S189 S190	S189-N193 PolarHBondContact N-O 2.71Å; S190-N193 PolarHBondContact O-N 2.88Å; S190-N193 WeakPolarHBondContact OG-CB 3.44Å; S190-N193 PolarHBondContact OG-N 2.88Å; S190-N193 PolarHBondContact OG-ND2 2.83Å
194	L	96.3	Very high	92.5	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.8	172.9	171.9	73.5	0	0	0	109.3	L119 F150 L159 L163 F186 I187 L188 D239 F240 L242	L119-L194 HydrophobicContact CD1-CD2 4.38Å; F150-L194 HydrophobicContact CZ-CD1 3.81Å; L159-L194 HydrophobicContact CD2-CD2 4.39Å; L163-L194 HydrophobicContact CD1-CD2 4.04Å; F186-L194 HydrophobicContact CB-CD1 4.34Å; F186-L194 HydrophobicContact CD1-CD1 4.5Å; I187-L194 CarbonylContact O-C 3.56Å; I187-L194 WeakPolarHBondContact O-CA 3.5Å; L188-L194 HydrophobicContact CD1-CB 4.37Å; L194-D239 CarbonylContact O-C 3.54Å; L194-F240 HydrophobicContact CB-CB 4.16Å; L194-F240 HydrophobicContact CD2-CD2 4.12Å; L194-F240 HydrophobicContact CG-CD2 4.24Å; L194-F240 PolarHBondContact N-O 3.04Å; L194-F240 WeakPolarHBondContact O-CA 3.49Å; L194-F240 WeakPolarHBondContact O-CB 3.37Å; L194-F240 WeakPolarHBondContact O-CD2 3.17Å; L194-F240 PolarHBondContact O-N 3.44Å; L194-L242 HydrophobicContact CB-CD1 4.18Å; L194-L242 HydrophobicContact CB-CG 4.42Å
195	C	96.3	Very high	91.8	Very high	16 Å²	16	46.4 Å²	46.4	11%	0.108	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.6	177.9	-57.2	0	0	0	0	110.1	F186 I187 D239	F186-C195 CarbonylContact C-O 3.52Å; F186-C195 WeakPolarHBondContact CA-O 3.47Å; I187-C195 HydrophobicContact CB-CB 4.24Å; I187-C195 PolarHBondContact N-O 3.04Å; I187-C195 PolarHBondContact O-N 3.42Å; C195-D239 PolarHBondContact SG-OD1 3.27Å; C195-D239 VanDerWaalsContact SG-OD1 3.39Å
196	L	96.2	Very high	90.7	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.8	166.9	170.1	61.5	0	0	0	108.8	F184 F186 V198 S237 A238 F240	F184-L196 HydrophobicContact CB-CD1 4.25Å; F186-L196 HydrophobicContact CD1-CB 4.49Å; F186-L196 HydrophobicContact CD1-CD1 4.17Å; F186-L196 HydrophobicContact CE1-CB 4.34Å; F186-L196 HydrophobicContact CE1-CD1 3.67Å; F186-L196 HydrophobicContact CE1-CG 4.4Å; F186-L196 HydrophobicContact CE2-CD1 4.43Å; F186-L196 HydrophobicContact CZ-CD1 3.8Å; L196-V198 HydrophobicContact CD1-CG2 4.38Å; L196-S237 WeakPolarHBondContact O-CA 3.42Å; L196-A238 PolarHBondContact N-O 3.43Å; L196-A238 PolarHBondContact O-N 2.79Å; L196-A238 VanDerWaalsContact O-N 3.08Å; L196-F240 HydrophobicContact CB-CE2 3.8Å; L196-F240 HydrophobicContact CD2-CE2 4.45Å
197	R	95.2	Very high	89.1	Confident	70 Å²	70	53.4 Å²	53.4	26%	0.264	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.1	171.4	-59.6	-63.4	178.7	-91.9	0	108.9	H185 I187 A238 D239	H185-R197 HydrophobicContact CB-CB 4.35Å; H185-R197 PolarHBondContact N-O 3.37Å; H185-R197 PolarHBondContact O-N 2.9Å; I187-R197 HydrophobicContact CD1-CG 4.38Å; R197-A238 PolarHBondContact NH1-O 3.31Å; R197-D239 IonicContact CZ-OD1 3.68Å; R197-D239 IonicContact NH1-OD1 3.96Å; R197-D239 PolarHBondContact NH1-OD1 3.14Å; R197-D239 IonicContact NH2-OD1 2.85Å; R197-D239 PolarHBondContact NH2-OD1 3.12Å; R197-D239 IonicContact NH2-OD2 3.7Å
198	V	93.9	Very high	87.2	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.1	176.3	-178.2	0	0	0	0	107	H182 Q183 F184 L196 A234 P236	H182-V198 HydrophobicContact CB-CG1 4.45Å; Q183-V198 WeakPolarHBondContact O-CA 3.5Å; F184-V198 HydrophobicContact CD1-CB 4.3Å; F184-V198 HydrophobicContact CD1-CG1 4.01Å; F184-V198 HydrophobicContact CD1-CG2 3.54Å; F184-V198 HydrophobicContact CE1-CB 4.47Å; F184-V198 HydrophobicContact CE1-CG1 3.93Å; F184-V198 HydrophobicContact CE1-CG2 3.7Å; L196-V198 HydrophobicContact CD1-CG2 4.38Å; V198-A234 HydrophobicContact CG1-CB 4.26Å; V198-A234 CarbonylContact O-C 3.46Å; V198-A234 WeakPolarHBondContact O-CA 3.5Å; V198-A234 PolarHBondContact O-N 3.22Å; V198-A234 VanDerWaalsContact O-O 3.1Å; V198-P236 HydrophobicContact CG2-CG 4.46Å; V198-P236 WeakPolarHBondContact CG2-O 3.38Å
199	R	93	Very high	85.3	Confident	63 Å²	63	64.3 Å²	64.3	24%	0.238	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132	178.6	-70	178.4	177.7	142.6	0.4	109.5	H182 Q183 H185 L231 E232 D233	H182-R199 CarbonylContact C-O 3.46Å; H182-R199 VanDerWaalsContact CA-O 3.26Å; H182-R199 WeakPolarHBondContact CA-O 3.38Å; Q183-R199 PolarHBondContact N-O 3.45Å; Q183-R199 PolarHBondContact O-N 2.94Å; H185-R199 PolarHBondContact ND1-NH1 2.95Å; H185-R199 VanDerWaalsContact ND1-NH1 3.1Å; R199-L231 HydrophobicContact CB-CB 4.48Å; R199-E232 CarbonylContact C-O 3.57Å; R199-E232 VanDerWaalsContact CA-O 3.22Å; R199-E232 WeakPolarHBondContact CA-O 3.28Å; R199-D233 WeakPolarHBondContact CG-OD1 3.23Å; R199-D233 IonicContact NE-OD1 2.78Å; R199-D233 PolarHBondContact NE-OD1 2.79Å
200	K	92.2	Very high	83.5	Confident	39 Å²	39	67.9 Å²	67.9	17%	0.17	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.9	167	-179.8	176.9	172	-177.6	0	108.4	D132 T134 L135 E181 T202 L231 E232	D132-K200 IonicContact OD1-NZ 3.97Å; D132-K200 WeakPolarHBondContact OD2-CD 3.34Å; D132-K200 WeakPolarHBondContact OD2-CE 3.29Å; D132-K200 IonicContact OD2-NZ 3.95Å; D132-K200 PolarHBondContact OD2-NZ 3.08Å; T134-K200 PolarHBondContact OG1-NZ 3.09Å; L135-K200 HydrophobicContact CD1-CB 4.24Å; L135-K200 HydrophobicContact CD1-CD 4.42Å; L135-K200 HydrophobicContact CD1-CG 4.07Å; E181-K200 WeakPolarHBondContact O-CA 3.37Å; K200-T202 HydrophobicContact CD-CG2 4.41Å; K200-T202 HydrophobicContact CG-CG2 4.39Å; K200-L231 WeakPolarHBondContact O-CA 3.12Å; K200-E232 HydrophobicContact CB-CB 4.44Å; K200-E232 PolarHBondContact N-O 2.83Å; K200-E232 PolarHBondContact O-N 2.86Å
201	I	91.6	Very high	81.9	Confident	12 Å²	12	68.7 Å²	68.7	6%	0.062	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.4	177.1	-59.7	141.1	0	0	0	107.6	M142 V180 E181 H182 Q183 L203 I229 L231	M142-I201 HydrophobicContact CE-CD1 3.22Å; M142-I201 HydrophobicContact CE-CG1 4.12Å; V180-I201 HydrophobicContact CG1-CD1 4.23Å; E181-I201 PolarHBondContact O-N 3.36Å; H182-I201 VanDerWaalsContact C-CD1 3.49Å; Q183-I201 HydrophobicContact CB-CD1 3.99Å; Q183-I201 HydrophobicContact CB-CG1 4.44Å; I201-L203 HydrophobicContact CG2-CD2 4.12Å; I201-L203 HydrophobicContact CG2-CG 4.38Å; I201-I229 HydrophobicContact CG2-CG2 4Å; I201-L231 HydrophobicContact CB-CD2 4.28Å; I201-L231 HydrophobicContact CG1-CD2 3.6Å; I201-L231 HydrophobicContact CG2-CD2 4.45Å
202	T	88.7	Confident	80.3	Confident	36 Å²	36	71 Å²	71	22%	0.221	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123	172.7	44.3	0	0	0	0	108.5	K200 S230	K200-T202 HydrophobicContact CD-CG2 4.41Å; K200-T202 HydrophobicContact CG-CG2 4.39Å; T202-S230 PolarHBondContact N-O 2.8Å; T202-S230 PolarHBondContact O-N 2.8Å; T202-S230 PolarHBondContact O-OG 2.82Å; T202-S230 WeakPolarHBondContact OG1-CB 3.46Å; T202-S230 PolarHBondContact OG1-O 3.1Å; T202-S230 PolarHBondContact OG1-OG 3.4Å
203	L	86	Confident	78.6	Confident	83 Å²	83	72.7 Å²	72.7	44%	0.435	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.2	177.2	-60.1	175	0	0	0	107.7	T177 I201 V227 I229	T177-L203 HydrophobicContact CG2-CD1 4.01Å; I201-L203 HydrophobicContact CG2-CD2 4.12Å; I201-L203 HydrophobicContact CG2-CG 4.38Å; L203-V227 HydrophobicContact CB-CG1 4.38Å; L203-V227 HydrophobicContact CD2-CG1 4.19Å; L203-I229 HydrophobicContact CD2-CB 4.41Å; L203-I229 HydrophobicContact CD2-CD1 4.48Å; L203-I229 HydrophobicContact CD2-CG1 3.79Å; L203-I229 HydrophobicContact CD2-CG2 4.33Å
204	S	83.7	Confident	76.7	Confident	46 Å²	46	74.9 Å²	74.9	32%	0.322	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.1	173.2	58.9	0	0	0	0	109.6	Q228	S204-Q228 PolarHBondContact N-O 2.96Å; S204-Q228 PolarHBondContact O-N 3.08Å; S204-Q228 PolarHBondContact OG-O 3.27Å
205	T	80.4	Confident	75	Confident	92 Å²	92	81 Å²	81	56%	0.564	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.6	171.1	55.9	0	0	0	0	108.2	T221 V227	T205-T221 HydrophobicContact CG2-CG2 4.42Å; T205-V227 HydrophobicContact CG2-CG2 4.43Å
206	K	72.3	Confident	73.6	Confident	102 Å²	102	85.1 Å²	85.1	44%	0.443	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	145.4	169.7	-78.1	-175	167.9	172.7	0	109.3	T209 V226	K206-T209 HydrophobicContact CB-CG2 4.33Å; K206-T209 HydrophobicContact CD-CG2 4.46Å; K206-V226 PolarHBondContact N-O 2.89Å
207	G	62.7	Low	72.3	Confident	61 Å²	61	90.3 Å²	90.3	63%	0.629	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-59.3	168.2	165.4	0	0	0	0	0	110.8	T209	G207-T209 WeakPolarHBondContact O-CG2 3.5Å; G207-T209 PolarHBondContact O-N 2.82Å
208	K	57.6	Low	71.2	Confident	212 Å²	212	89.9 Å²	89.9	92%	0.922	51%	0.511	S	S	*	.			trans	-47	110.1	-179.7	-70.7	179.2	179.7	177.3	0	110.4
209	T	55.3	Low	70.4	Confident	66 Å²	66	94.9 Å²	94.9	41%	0.405	54%	0.537	S	S	.	.			trans	-99.4	126.1	173	54.4	0	0	0	0	109.2	K206 G207 S211	K206-T209 HydrophobicContact CB-CG2 4.33Å; K206-T209 HydrophobicContact CD-CG2 4.46Å; G207-T209 WeakPolarHBondContact O-CG2 3.5Å; G207-T209 PolarHBondContact O-N 2.82Å; T209-S211 PolarHBondContact O-N 3.45Å; T209-S211 PolarHBondContact OG1-OG 3.16Å
210	N	52.8	Low	69.8	Low	164 Å²	164	98.2 Å²	98.2	88%	0.877	55%	0.553	S	S	*	*			trans	-75.4	67.3	170.1	-64.5	-17.7	0	0	0	109.2
211	S	53.9	Low	69.1	Low	62 Å²	62	98 Å²	98	43%	0.434	56%	0.555	S	S	.	*			trans	-115.6	93.5	-174.4	52.3	0	0	0	0	111	T209 E213	T209-S211 PolarHBondContact O-N 3.45Å; T209-S211 PolarHBondContact OG1-OG 3.16Å; S211-E213 PolarHBondContact O-N 2.76Å
212	T	53	Low	68.6	Low	140 Å²	140	104 Å²	104	86%	0.859	60%	0.595	S	S	*	*			trans	-78.8	14.9	177.9	1.4	0	0	0	0	114
213	E	55.6	Low	68.2	Low	184 Å²	184	108.9 Å²	108.9	86%	0.86	62%	0.62	S	S	*	*			trans	-139.6	38.1	-165.7	-63.1	-175.1	176.5	0	0	114.8	S211	S211-E213 PolarHBondContact O-N 2.76Å
214	L	54.2	Low	68	Low	117 Å²	117	107 Å²	107	61%	0.613	62%	0.621	S	S	*	*			trans	-109.5	124.7	167.9	-78.6	111.6	0	0	0	110.9	V216	L214-V216 PolarHBondContact O-N 3.35Å
215	S	59.4	Low	67.9	Low	131 Å²	131	110.7 Å²	110.7	92%	0.916	63%	0.631	S	S	*	*	S	Bend	trans	-60.9	-12.3	174.1	178.2	0	0	0	0	113.6
216	V	66.9	Low	68.1	Low	102 Å²	102	107.8 Å²	107.8	62%	0.618	61%	0.613	S	S	*	*	S	Bend	trans	-126.3	131.6	-178.8	-174.4	0	0	0	0	108.2	L214	L214-V216 PolarHBondContact O-N 3.35Å
217	P	69.9	Low	68.6	Low	113 Å²	113	104.1 Å²	104.1	73%	0.734	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-57.1	133.3	178.9	22.6	-33.2	0	0	0	110.7
218	P	71.6	Confident	69.7	Low	62 Å²	62	105 Å²	105	40%	0.403	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-66.3	137.8	-177	25.9	-33.3	0	0	0	110.6	K220 V226	P218-K220 PolarHBondContact O-N 3.22Å; P218-V226 HydrophobicContact CB-CG1 3.84Å; P218-V226 HydrophobicContact CB-CG2 4.35Å
219	L	77.9	Confident	71.1	Confident	106 Å²	106	99.3 Å²	99.3	56%	0.555	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-67.1	130.8	173.3	-159.9	74.2	0	0	0	108.9	V226 V227 I229	L219-V226 WeakPolarHBondContact O-CA 3.38Å; L219-V227 HydrophobicContact CB-CB 4.48Å; L219-V227 PolarHBondContact O-N 3.17Å; L219-I229 HydrophobicContact CD2-CD1 4.19Å
220	K	79.6	Confident	72.7	Confident	133 Å²	133	98 Å²	98	58%	0.578	56%	0.559	S	S	*	*	B	Isolated β-bridge	trans	-117.8	144.4	-180	-65.5	179.3	-175.4	177.3	0	110.8	P218 K225 V226	P218-K220 PolarHBondContact O-N 3.22Å; K220-K225 CarbonylContact C-O 3.48Å; K220-K225 WeakPolarHBondContact CA-O 3.4Å; K220-V226 HydrophobicContact CG-CG2 4.41Å
221	T	78.9	Confident	74.6	Confident	33 Å²	33	94.1 Å²	94.1	20%	0.202	54%	0.538	C	S	.	.			trans	-66.3	163.5	166	64.5	0	0	0	0	110	T205 D223 G224 K225 V227	T205-T221 HydrophobicContact CG2-CG2 4.42Å; T221-D223 PolarHBondContact O-N 3.3Å; T221-D223 VanDerWaalsContact O-N 3.13Å; T221-D223 PolarHBondContact OG1-N 3.48Å; T221-G224 WeakPolarHBondContact O-CA 2.98Å; T221-G224 PolarHBondContact O-N 3.03Å; T221-K225 HydrophobicContact CG2-CB 4.3Å; T221-K225 PolarHBondContact N-O 2.8Å; T221-K225 WeakPolarHBondContact OG1-CB 3.46Å; T221-K225 PolarHBondContact OG1-N 3.33Å; T221-K225 VanDerWaalsContact OG1-N 3.09Å; T221-V227 HydrophobicContact CG2-CG2 3.42Å; T221-V227 VanDerWaalsContact CG2-CG2 3.42Å
222	P	80.7	Confident	76.4	Confident	140 Å²	140	95.8 Å²	95.8	91%	0.909	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-32.4	170.7	-27.9	36.3	0	0	0	113.1	G224	P222-G224 PolarHBondContact O-N 3.08Å
223	D	80.8	Confident	78.3	Confident	137 Å²	137	95.4 Å²	95.4	73%	0.733	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	2.9	176.7	-48.2	-30.6	0	0	0	114	T221 K225	T221-D223 PolarHBondContact O-N 3.3Å; T221-D223 VanDerWaalsContact O-N 3.13Å; T221-D223 PolarHBondContact OG1-N 3.48Å; D223-K225 PolarHBondContact O-N 3.11Å
224	G	81.2	Confident	80	Confident	45 Å²	45	87.2 Å²	87.2	46%	0.464	50%	0.496	S	S	.	.	S	Bend	trans	82.2	5.4	178	0	0	0	0	0	116.1	T221 P222	T221-G224 WeakPolarHBondContact O-CA 2.98Å; T221-G224 PolarHBondContact O-N 3.03Å; P222-G224 PolarHBondContact O-N 3.08Å
225	K	81.2	Confident	81.8	Confident	122 Å²	122	82.2 Å²	82.2	53%	0.53	47%	0.47	S	S	.	.			trans	-75.2	139.4	176	-63.7	179.8	-178.8	172.6	0	110.5	K220 T221 D223	K220-K225 CarbonylContact C-O 3.48Å; K220-K225 WeakPolarHBondContact CA-O 3.4Å; T221-K225 HydrophobicContact CG2-CB 4.3Å; T221-K225 PolarHBondContact N-O 2.8Å; T221-K225 WeakPolarHBondContact OG1-CB 3.46Å; T221-K225 PolarHBondContact OG1-N 3.33Å; T221-K225 VanDerWaalsContact OG1-N 3.09Å; D223-K225 PolarHBondContact O-N 3.11Å
226	V	83.7	Confident	83.5	Confident	32 Å²	32	76.2 Å²	76.2	19%	0.194	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.8	177.9	177	0	0	0	0	110	K206 P218 L219 K220	K206-V226 PolarHBondContact N-O 2.89Å; P218-V226 HydrophobicContact CB-CG1 3.84Å; P218-V226 HydrophobicContact CB-CG2 4.35Å; L219-V226 WeakPolarHBondContact O-CA 3.38Å; K220-V226 HydrophobicContact CG-CG2 4.41Å
227	V	84.4	Confident	84.8	Confident	24 Å²	24	72 Å²	72	15%	0.145	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.7	176.2	-175.4	0	0	0	0	108.6	L203 T205 L219 T221	L203-V227 HydrophobicContact CB-CG1 4.38Å; L203-V227 HydrophobicContact CD2-CG1 4.19Å; T205-V227 HydrophobicContact CG2-CG2 4.43Å; L219-V227 HydrophobicContact CB-CB 4.48Å; L219-V227 PolarHBondContact O-N 3.17Å; T221-V227 HydrophobicContact CG2-CG2 3.42Å; T221-V227 VanDerWaalsContact CG2-CG2 3.42Å
228	Q	84.3	Confident	86.1	Confident	81 Å²	81	66.6 Å²	66.6	38%	0.379	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.1	169.9	-179.2	174.2	-12.1	0	0	109.3	S204	S204-Q228 PolarHBondContact N-O 2.96Å; S204-Q228 PolarHBondContact O-N 3.08Å; S204-Q228 PolarHBondContact OG-O 3.27Å
229	I	87.9	Confident	87.3	Confident	91 Å²	91	65.4 Å²	65.4	47%	0.467	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	120.5	175.1	-52.6	178.7	0	0	0	107.6	I201 L203 L219 L231	I201-I229 HydrophobicContact CG2-CG2 4Å; L203-I229 HydrophobicContact CD2-CB 4.41Å; L203-I229 HydrophobicContact CD2-CD1 4.48Å; L203-I229 HydrophobicContact CD2-CG1 3.79Å; L203-I229 HydrophobicContact CD2-CG2 4.33Å; L219-I229 HydrophobicContact CD2-CD1 4.19Å; I229-L231 HydrophobicContact CG2-CD2 4.25Å
230	S	89.4	Confident	88.2	Confident	40 Å²	40	60.6 Å²	60.6	28%	0.28	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	140.5	168.1	33.8	0	0	0	0	109.6	T202	T202-S230 PolarHBondContact N-O 2.8Å; T202-S230 PolarHBondContact O-N 2.8Å; T202-S230 PolarHBondContact O-OG 2.82Å; T202-S230 WeakPolarHBondContact OG1-CB 3.46Å; T202-S230 PolarHBondContact OG1-O 3.1Å; T202-S230 PolarHBondContact OG1-OG 3.4Å
231	L	91.8	Very high	89	Confident	82 Å²	82	55.8 Å²	55.8	43%	0.429	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.7	177.5	-61	178	0	0	0	108.5	R199 K200 I201 I229	R199-L231 HydrophobicContact CB-CB 4.48Å; K200-L231 WeakPolarHBondContact O-CA 3.12Å; I201-L231 HydrophobicContact CB-CD2 4.28Å; I201-L231 HydrophobicContact CG1-CD2 3.6Å; I201-L231 HydrophobicContact CG2-CD2 4.45Å; I229-L231 HydrophobicContact CG2-CD2 4.25Å
232	E	92.4	Very high	89.8	Confident	96 Å²	96	54.9 Å²	54.9	45%	0.449	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133	176.1	-68.7	173.2	-165.9	0	0	108.8	R199 K200 A234	R199-E232 CarbonylContact C-O 3.57Å; R199-E232 VanDerWaalsContact CA-O 3.22Å; R199-E232 WeakPolarHBondContact CA-O 3.28Å; K200-E232 HydrophobicContact CB-CB 4.44Å; K200-E232 PolarHBondContact N-O 2.83Å; K200-E232 PolarHBondContact O-N 2.86Å; E232-A234 PolarHBondContact O-N 2.78Å
233	D	92	Very high	90.4	Very high	133 Å²	133	51.1 Å²	51.1	71%	0.711	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.5	178.3	-73.7	-24.1	0	0	0	110.4	R199	R199-D233 WeakPolarHBondContact CG-OD1 3.23Å; R199-D233 IonicContact NE-OD1 2.78Å; R199-D233 PolarHBondContact NE-OD1 2.79Å
234	A	92.6	Very high	91.2	Very high	12 Å²	12	48.3 Å²	48.3	10%	0.099	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	175.7	-179.4	0	0	0	0	0	110.4	L135 V198 E232	L135-A234 HydrophobicContact CD2-CB 3.89Å; V198-A234 HydrophobicContact CG1-CB 4.26Å; V198-A234 CarbonylContact O-C 3.46Å; V198-A234 WeakPolarHBondContact O-CA 3.5Å; V198-A234 PolarHBondContact O-N 3.22Å; V198-A234 VanDerWaalsContact O-O 3.1Å; E232-A234 PolarHBondContact O-N 2.78Å
235	T	91.9	Very high	91.9	Very high	12 Å²	12	48.1 Å²	48.1	7%	0.074	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	163.9	174.3	65.4	0	0	0	0	110.2	K125 P126 I127 D129 C130 Y137	K125-T235 HydrophobicContact CB-CG2 4.12Å; P126-T235 WeakPolarHBondContact O-CB 3.38Å; P126-T235 PolarHBondContact O-OG1 2.85Å; I127-T235 WeakPolarHBondContact CA-OG1 3.33Å; I127-T235 PolarHBondContact O-OG1 3Å; D129-T235 HydrophobicContact CB-CG2 4.38Å; C130-T235 WeakPolarHBondContact CA-OG1 3.38Å; C130-T235 WeakPolarHBondContact CB-OG1 3.14Å; C130-T235 PolarHBondContact N-OG1 2.79Å; Y137-T235 WeakPolarHBondContact CE1-O 3.39Å; Y137-T235 PolarHBondContact OH-O 2.96Å
236	P	93.9	Very high	92.6	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-71.6	149.3	-0.1	32	-32	0	0	0	112.2	L55 Y124 K125 I127 V198	L55-P236 HydrophobicContact CD1-CG 3.9Å; Y124-P236 HydrophobicContact CE2-CB 4.03Å; K125-P236 CarbonylContact O-C 3.49Å; K125-P236 WeakPolarHBondContact O-CA 2.87Å; I127-P236 HydrophobicContact CG1-CB 4.2Å; I127-P236 HydrophobicContact CG1-CG 4.06Å; V198-P236 HydrophobicContact CG2-CG 4.46Å; V198-P236 WeakPolarHBondContact CG2-O 3.38Å
237	S	94.9	Very high	93.1	Very high	13 Å²	13	46.7 Å²	46.7	9%	0.091	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.3	168.6	64.1	0	0	0	0	109.3	Y124 K125 L196	Y124-S237 WeakPolarHBondContact CA-O 3.44Å; Y124-S237 VanDerWaalsContact CD2-O 3.24Å; Y124-S237 WeakPolarHBondContact CD2-O 2.9Å; K125-S237 WeakPolarHBondContact CB-OG 3.42Å; K125-S237 PolarHBondContact N-O 2.86Å; K125-S237 PolarHBondContact O-N 3.35Å; L196-S237 WeakPolarHBondContact O-CA 3.42Å
238	A	96.2	Very high	93.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	143.4	-176	0	0	0	0	0	110.1	F48 Y124 L196 R197 F240	F48-A238 HydrophobicContact CE2-CB 4.49Å; Y124-A238 HydrophobicContact CD2-CB 3.82Å; Y124-A238 HydrophobicContact CE2-CB 4.38Å; L196-A238 PolarHBondContact N-O 3.43Å; L196-A238 PolarHBondContact O-N 2.79Å; L196-A238 VanDerWaalsContact O-N 3.08Å; R197-A238 PolarHBondContact NH1-O 3.31Å; A238-F240 HydrophobicContact CB-CD2 4.49Å; A238-F240 HydrophobicContact CB-CE1 4.07Å; A238-F240 HydrophobicContact CB-CE2 3.8Å; A238-F240 HydrophobicContact CB-CZ 3.56Å
239	D	96.8	Very high	94.1	Very high	37 Å²	37	46.3 Å²	46.3	20%	0.198	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	146.6	162.1	-63.4	-14.8	0	0	0	108.2	I121 K122 M123 L194 C195 R197	I121-D239 CarbonylContact C-O 3.59Å; K122-D239 HydrophobicContact CB-CB 4Å; K122-D239 PolarHBondContact N-O 2.59Å; K122-D239 WeakPolarHBondContact O-CA 3.43Å; K122-D239 PolarHBondContact O-N 2.86Å; K122-D239 VanDerWaalsContact O-O 3.06Å; M123-D239 HydrophobicContact CB-CB 4.44Å; L194-D239 CarbonylContact O-C 3.54Å; C195-D239 PolarHBondContact SG-OD1 3.27Å; C195-D239 VanDerWaalsContact SG-OD1 3.39Å; R197-D239 IonicContact CZ-OD1 3.68Å; R197-D239 IonicContact NH1-OD1 3.96Å; R197-D239 PolarHBondContact NH1-OD1 3.14Å; R197-D239 IonicContact NH2-OD1 2.85Å; R197-D239 PolarHBondContact NH2-OD1 3.12Å; R197-D239 IonicContact NH2-OD2 3.7Å
240	F	97.1	Very high	94.4	Very high	6 Å²	6	48.2 Å²	48.2	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.9	-176.9	-60.1	-74	0	0	0	110.3	F48 L119 G120 I121 L194 L196 A238	F48-F240 HydrophobicContact CE2-CE1 4.01Å; F48-F240 AromaticContact CE2-CZ 3.7Å; F48-F240 HydrophobicContact CE2-CZ 3.7Å; F48-F240 HydrophobicContact CZ-CE1 4.04Å; F48-F240 AromaticContact CZ-CZ 3.81Å; F48-F240 HydrophobicContact CZ-CZ 3.81Å; L119-F240 HydrophobicContact CB-CB 4.2Å; L119-F240 HydrophobicContact CB-CD1 3.96Å; L119-F240 HydrophobicContact CB-CG 4.36Å; L119-F240 HydrophobicContact CD1-CB 4.32Å; L119-F240 HydrophobicContact CD1-CD1 4.11Å; L119-F240 HydrophobicContact CD1-CG 4.1Å; L119-F240 HydrophobicContact CD2-CB 4.42Å; G120-F240 CarbonylContact O-C 3.57Å; G120-F240 VanDerWaalsContact O-CA 3.26Å; G120-F240 WeakPolarHBondContact O-CA 3.32Å; I121-F240 HydrophobicContact CG1-CD1 4.25Å; I121-F240 HydrophobicContact CG1-CE1 3.98Å; L194-F240 HydrophobicContact CB-CB 4.16Å; L194-F240 HydrophobicContact CD2-CD2 4.12Å; L194-F240 HydrophobicContact CG-CD2 4.24Å; L194-F240 PolarHBondContact N-O 3.04Å; L194-F240 WeakPolarHBondContact O-CA 3.49Å; L194-F240 WeakPolarHBondContact O-CB 3.37Å; L194-F240 WeakPolarHBondContact O-CD2 3.17Å; L194-F240 PolarHBondContact O-N 3.44Å; L196-F240 HydrophobicContact CB-CE2 3.8Å; L196-F240 HydrophobicContact CD2-CE2 4.45Å; A238-F240 HydrophobicContact CB-CD2 4.49Å; A238-F240 HydrophobicContact CB-CE1 4.07Å; A238-F240 HydrophobicContact CB-CE2 3.8Å; A238-F240 HydrophobicContact CB-CZ 3.56Å
241	D	96.2	Very high	94.7	Very high	31 Å²	31	51.6 Å²	51.6	17%	0.166	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	117	163.5	-66.5	-27.9	0	0	0	109.3	L119 G120 K122 K192 R243	L119-D241 CarbonylContact C-O 3.03Å; L119-D241 WeakPolarHBondContact CA-O 3.25Å; G120-D241 PolarHBondContact N-O 2.58Å; G120-D241 PolarHBondContact O-N 2.67Å; K122-D241 WeakPolarHBondContact CD-OD1 3.26Å; K122-D241 WeakPolarHBondContact CD-OD2 3.49Å; K122-D241 VanDerWaalsContact CE-CG 3.46Å; K122-D241 WeakPolarHBondContact CE-OD1 3.22Å; K122-D241 WeakPolarHBondContact CE-OD2 3.22Å; K122-D241 IonicContact NZ-OD1 3.3Å; K122-D241 PolarHBondContact NZ-OD1 2.89Å; K122-D241 IonicContact NZ-OD2 3.19Å; K122-D241 PolarHBondContact NZ-OD2 2.91Å; K192-D241 CarbonylContact O-C 3.53Å; K192-D241 WeakPolarHBondContact O-CA 3.42Å; D241-R243 PolarHBondContact O-N 3.37Å
242	L	95.7	Very high	94.8	Very high	15 Å²	15	48.8 Å²	48.8	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	125.1	171.9	-71.7	152.3	0	0	0	110.2	L119 Y156 L159 L188 K192 L194	L119-L242 HydrophobicContact CD2-CD2 3.27Å; L119-L242 HydrophobicContact CD2-CG 3.9Å; Y156-L242 HydrophobicContact CE1-CD1 3.92Å; L159-L242 HydrophobicContact CD2-CD1 4.41Å; L159-L242 HydrophobicContact CD2-CD2 3.61Å; L188-L242 HydrophobicContact CD1-CD1 3.78Å; K192-L242 PolarHBondContact O-N 2.97Å; L194-L242 HydrophobicContact CB-CD1 4.18Å; L194-L242 HydrophobicContact CB-CG 4.42Å
243	R	95.1	Very high	94.9	Very high	60 Å²	60	47.7 Å²	47.7	23%	0.226	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-121.7	-175.8	-62.5	173.5	176.4	169	0.2	110.5	P100 N102 E118 D241	P100-R243 PolarHBondContact O-NH1 3.13Å; P100-R243 PolarHBondContact O-NH2 2.91Å; N102-R243 PolarHBondContact OD1-NH1 3.14Å; E118-R243 HydrophobicContact CB-CB 4.06Å; E118-R243 HydrophobicContact CG-CB 3.92Å; E118-R243 WeakPolarHBondContact O-CB 3.37Å; E118-R243 PolarHBondContact O-N 3.31Å; E118-R243 WeakPolarHBondContact OE2-CB 3.12Å; D241-R243 PolarHBondContact O-N 3.37Å
244	R	96.1	Very high	95	Very high	78 Å²	78	47 Å²	47	29%	0.294	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	148.7	178.9	-66.5	179.9	-73.4	-179.4	3	111	F72 E118	F72-R244 HydrophobicContact CD1-CB 4.1Å; F72-R244 VanDerWaalsContact CD2-CZ 3.45Å; F72-R244 HydrophobicContact CE1-CB 3.43Å; F72-R244 VanDerWaalsContact CE1-CB 3.43Å; F72-R244 HydrophobicContact CE1-CG 4.49Å; F72-R244 HydrophobicContact CE2-CB 4.14Å; F72-R244 HydrophobicContact CZ-CB 3.45Å; F72-R244 VanDerWaalsContact CZ-CB 3.45Å; E118-R244 HydrophobicContact CB-CB 4.21Å; E118-R244 WeakPolarHBondContact CB-O 3.3Å; E118-R244 PolarHBondContact N-O 2.83Å; E118-R244 IonicContact OE1-CZ 3.54Å; E118-R244 IonicContact OE1-NE 3.52Å; E118-R244 IonicContact OE1-NH2 2.72Å; E118-R244 PolarHBondContact OE1-NH2 2.62Å; E118-R244 WeakPolarHBondContact OE2-CB 3.47Å; E118-R244 WeakPolarHBondContact OE2-CG 3.47Å; E118-R244 IonicContact OE2-CZ 3.55Å; E118-R244 PolarHBondContact OE2-N 3.26Å; E118-R244 IonicContact OE2-NE 2.74Å; E118-R244 PolarHBondContact OE2-NE 2.97Å; E118-R244 IonicContact OE2-NH2 3.5Å
245	V	96	Very high	95.1	Very high	41 Å²	41	53.3 Å²	53.3	25%	0.248	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	139.8	176.4	-177.9	0	0	0	0	108.5	M116 F117 K155 L247	M116-V245 CarbonylContact O-C 3.55Å; M116-V245 WeakPolarHBondContact O-CA 3.26Å; F117-V245 HydrophobicContact CD1-CB 4.24Å; F117-V245 HydrophobicContact CD1-CG1 3.75Å; F117-V245 HydrophobicContact CD1-CG2 3.51Å; F117-V245 HydrophobicContact CD2-CG1 4.36Å; F117-V245 HydrophobicContact CE1-CB 4.19Å; F117-V245 HydrophobicContact CE1-CG1 3.38Å; F117-V245 HydrophobicContact CE1-CG2 3.67Å; F117-V245 HydrophobicContact CE2-CG1 4.06Å; F117-V245 HydrophobicContact CG-CG1 4.23Å; F117-V245 HydrophobicContact CG-CG2 4.39Å; F117-V245 HydrophobicContact CZ-CG1 3.55Å; K155-V245 HydrophobicContact CG-CG1 4.5Å; V245-L247 HydrophobicContact CG1-CD2 3.64Å; V245-L247 HydrophobicContact CG1-CG 3.86Å
246	S	95.8	Very high	95.2	Very high	45 Å²	45	54.1 Å²	54.1	32%	0.315	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	108.9	166.6	-171.5	0	0	0	0	107.5	D115 M116	D115-S246 WeakPolarHBondContact CA-O 3.17Å; M116-S246 PolarHBondContact N-O 3.21Å; M116-S246 PolarHBondContact O-N 3.2Å
247	L	95.2	Very high	95.1	Very high	79 Å²	79	58.5 Å²	58.5	41%	0.414	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-89.3	150.5	177.5	-65	176.8	0	0	0	110.3	F117 K155 T158 V245	F117-L247 HydrophobicContact CZ-CD2 3.98Å; K155-L247 HydrophobicContact CB-CD1 4.45Å; T158-L247 HydrophobicContact CG2-CD2 4.44Å; T158-L247 WeakPolarHBondContact OG1-CD2 3.45Å; V245-L247 HydrophobicContact CG1-CD2 3.64Å; V245-L247 HydrophobicContact CG1-CG 3.86Å
248	P	94.6	Very high	95	Very high	27 Å²	27	67.1 Å²	67.1	18%	0.175	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-71.5	151.9	174.2	20.9	-19	0	0	0	110.9	L114 D115 K252 W253	L114-P248 HydrophobicContact CD1-CB 3.95Å; L114-P248 HydrophobicContact CD1-CG 4.36Å; L114-P248 WeakPolarHBondContact O-CA 3.28Å; L114-P248 VanDerWaalsContact O-CB 3.23Å; L114-P248 WeakPolarHBondContact O-CB 3.33Å; D115-P248 HydrophobicContact CB-CG 4.45Å; P248-K252 HydrophobicContact CB-CB 4.48Å; P248-W253 HydrophobicContact CB-CB 4.43Å; P248-W253 HydrophobicContact CB-CE3 4.32Å; P248-W253 HydrophobicContact CG-CB 4.34Å; P248-W253 HydrophobicContact CG-CD2 4.19Å; P248-W253 HydrophobicContact CG-CE3 3.36Å; P248-W253 HydrophobicContact CG-CZ3 3.96Å
249	S	94.7	Very high	94.7	Very high	70 Å²	70	71 Å²	71	49%	0.49	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-65	154.5	163.3	64.4	0	0	0	0	110.7	D251 K252 W253	S249-D251 VanDerWaalsContact C-N 3.27Å; S249-D251 PolarHBondContact O-N 2.92Å; S249-K252 PolarHBondContact O-N 3.45Å; S249-K252 VanDerWaalsContact O-N 3.1Å; S249-K252 WeakPolarHBondContact OG-CB 3.46Å; S249-K252 PolarHBondContact OG-N 3.22Å; S249-W253 PolarHBondContact O-N 2.8Å
250	E	93.9	Very high	94.3	Very high	132 Å²	132	71.4 Å²	71.4	62%	0.617	35%	0.347	S	S	*	.	H	α-helix	trans	-57.9	-39.7	-177.8	-166.6	-176.8	164.4	0	0	112.2	W253 K254	E250-W253 PolarHBondContact O-N 3.39Å; E250-K254 HydrophobicContact CG-CD 4.33Å; E250-K254 WeakPolarHBondContact O-CB 3.2Å; E250-K254 WeakPolarHBondContact O-CG 3.43Å; E250-K254 PolarHBondContact O-N 3.17Å; E250-K254 WeakPolarHBondContact OE1-CE 3.31Å; E250-K254 IonicContact OE1-NZ 3.37Å; E250-K254 PolarHBondContact OE1-NZ 3.16Å
251	D	95.3	Very high	93.8	Very high	110 Å²	110	73.7 Å²	73.7	59%	0.588	36%	0.362	S	S	*	.	H	α-helix	trans	-67	-38.9	177.5	-63.8	-32.9	0	0	0	112.5	S249 R255	S249-D251 VanDerWaalsContact C-N 3.27Å; S249-D251 PolarHBondContact O-N 2.92Å; D251-R255 WeakPolarHBondContact O-CB 3.37Å; D251-R255 VanDerWaalsContact O-CG 3.29Å; D251-R255 WeakPolarHBondContact O-CG 3.45Å; D251-R255 PolarHBondContact O-N 3.27Å
252	K	94	Very high	93.3	Very high	24 Å²	24	77.9 Å²	77.9	10%	0.104	38%	0.381	C	S	.	.	H	α-helix	trans	-68.4	-39.8	176.7	-166.2	168.7	-172.3	156.7	0	110.8	E112 L113 L114 P248 S249 R255 A256	E112-K252 IonicContact OE2-NZ 3.68Å; E112-K252 PolarHBondContact OE2-NZ 3.1Å; L113-K252 WeakPolarHBondContact O-CE 3.49Å; L113-K252 PolarHBondContact O-NZ 3.06Å; L114-K252 HydrophobicContact CD1-CG 3.99Å; P248-K252 HydrophobicContact CB-CB 4.48Å; S249-K252 PolarHBondContact O-N 3.45Å; S249-K252 VanDerWaalsContact O-N 3.1Å; S249-K252 WeakPolarHBondContact OG-CB 3.46Å; S249-K252 PolarHBondContact OG-N 3.22Å; K252-R255 PolarHBondContact O-N 2.84Å; K252-A256 WeakPolarHBondContact O-CB 3.29Å; K252-A256 PolarHBondContact O-N 3.2Å
253	W	94.3	Very high	92.6	Very high	73 Å²	73	80 Å²	80	28%	0.277	39%	0.394	S	S	.	.	H	α-helix	trans	-61.8	-49.2	173.9	-170.5	-105.7	0	0	0	111.7	L114 T158 P248 S249 E250 R255 A256 H257	L114-W253 HydrophobicContact CD1-CE3 4.44Å; T158-W253 HydrophobicContact CG2-CH2 3.63Å; T158-W253 HydrophobicContact CG2-CZ2 4.05Å; T158-W253 HydrophobicContact CG2-CZ3 3.91Å; P248-W253 HydrophobicContact CB-CB 4.43Å; P248-W253 HydrophobicContact CB-CE3 4.32Å; P248-W253 HydrophobicContact CG-CB 4.34Å; P248-W253 HydrophobicContact CG-CD2 4.19Å; P248-W253 HydrophobicContact CG-CE3 3.36Å; P248-W253 HydrophobicContact CG-CZ3 3.96Å; S249-W253 PolarHBondContact O-N 2.8Å; E250-W253 PolarHBondContact O-N 3.39Å; W253-R255 PolarHBondContact O-N 3.4Å; W253-A256 PolarHBondContact O-N 3.42Å; W253-H257 AromaticContact CD1-CD2 3.91Å; W253-H257 AromaticContact CD2-CD2 3.57Å; W253-H257 AromaticContact CD2-NE2 3.71Å; W253-H257 AromaticContact CE2-CD2 3.39Å; W253-H257 AromaticContact CE2-NE2 3.3Å; W253-H257 VanDerWaalsContact CE2-NE2 3.3Å; W253-H257 AromaticContact CE3-NE2 3.9Å; W253-H257 AromaticContact CG-CD2 3.94Å; W253-H257 AromaticContact CH2-NE2 3.42Å; W253-H257 WeakPolarHBondContact CH2-NE2 3.39Å; W253-H257 AromaticContact CZ2-CD2 3.81Å; W253-H257 AromaticContact CZ2-NE2 3.17Å; W253-H257 WeakPolarHBondContact CZ2-NE2 3.37Å; W253-H257 AromaticContact CZ3-NE2 3.78Å; W253-H257 AromaticContact NE1-CD2 3.58Å; W253-H257 AromaticContact NE1-NE2 3.89Å; W253-H257 WeakPolarHBondContact O-CB 3.48Å; W253-H257 PolarHBondContact O-CD2 3.19Å; W253-H257 VanDerWaalsContact O-CD2 3.26Å; W253-H257 PolarHBondContact O-N 3Å
254	K	95.2	Very high	91.7	Very high	117 Å²	117	81.4 Å²	81.4	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-59.8	-42.7	176.6	-75.3	173.2	-177.9	164.9	0	112.4	E250 H257 R258	E250-K254 HydrophobicContact CG-CD 4.33Å; E250-K254 WeakPolarHBondContact O-CB 3.2Å; E250-K254 WeakPolarHBondContact O-CG 3.43Å; E250-K254 PolarHBondContact O-N 3.17Å; E250-K254 WeakPolarHBondContact OE1-CE 3.31Å; E250-K254 IonicContact OE1-NZ 3.37Å; E250-K254 PolarHBondContact OE1-NZ 3.16Å; K254-H257 PolarHBondContact O-N 3.46Å; K254-R258 PolarHBondContact O-N 2.93Å
255	R	94	Very high	90.4	Very high	146 Å²	146	85.1 Å²	85.1	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-61.1	-45.2	175.7	-77.2	-172.3	-65.6	161.2	0.1	111.6	D251 K252 W253 H257 R258	D251-R255 WeakPolarHBondContact O-CB 3.37Å; D251-R255 VanDerWaalsContact O-CG 3.29Å; D251-R255 WeakPolarHBondContact O-CG 3.45Å; D251-R255 PolarHBondContact O-N 3.27Å; K252-R255 PolarHBondContact O-N 2.84Å; W253-R255 PolarHBondContact O-N 3.4Å; R255-H257 VanDerWaalsContact C-N 3.29Å; R255-H257 PolarHBondContact O-N 2.81Å; R255-R258 WeakPolarHBondContact O-CB 3.4Å; R255-R258 PolarHBondContact O-N 3.37Å
256	A	94	Very high	88.8	Confident	29 Å²	29	86.2 Å²	86.2	24%	0.24	44%	0.442	C	S	.	.	H	α-helix	trans	-68	-26.6	179.6	0	0	0	0	0	114	H109 L114 K252 W253	H109-A256 HydrophobicContact CB-CB 4.36Å; H109-A256 VanDerWaalsContact CD2-CB 3.47Å; H109-A256 WeakPolarHBondContact CD2-CB 3.5Å; H109-A256 WeakPolarHBondContact NE2-CA 3.46Å; L114-A256 HydrophobicContact CD1-CB 3.86Å; L114-A256 HydrophobicContact CD2-CB 4.19Å; K252-A256 WeakPolarHBondContact O-CB 3.29Å; K252-A256 PolarHBondContact O-N 3.2Å; W253-A256 PolarHBondContact O-N 3.42Å
257	H	92	Very high	87.2	Confident	96 Å²	96	90.4 Å²	90.4	44%	0.444	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	10	178.8	-77.7	-75.4	0	0	0	114.2	W253 K254 R255 V259	W253-H257 AromaticContact CD1-CD2 3.91Å; W253-H257 AromaticContact CD2-CD2 3.57Å; W253-H257 AromaticContact CD2-NE2 3.71Å; W253-H257 AromaticContact CE2-CD2 3.39Å; W253-H257 AromaticContact CE2-NE2 3.3Å; W253-H257 VanDerWaalsContact CE2-NE2 3.3Å; W253-H257 AromaticContact CE3-NE2 3.9Å; W253-H257 AromaticContact CG-CD2 3.94Å; W253-H257 AromaticContact CH2-NE2 3.42Å; W253-H257 WeakPolarHBondContact CH2-NE2 3.39Å; W253-H257 AromaticContact CZ2-CD2 3.81Å; W253-H257 AromaticContact CZ2-NE2 3.17Å; W253-H257 WeakPolarHBondContact CZ2-NE2 3.37Å; W253-H257 AromaticContact CZ3-NE2 3.78Å; W253-H257 AromaticContact NE1-CD2 3.58Å; W253-H257 AromaticContact NE1-NE2 3.89Å; W253-H257 WeakPolarHBondContact O-CB 3.48Å; W253-H257 PolarHBondContact O-CD2 3.19Å; W253-H257 VanDerWaalsContact O-CD2 3.26Å; W253-H257 PolarHBondContact O-N 3Å; K254-H257 PolarHBondContact O-N 3.46Å; R255-H257 VanDerWaalsContact C-N 3.29Å; R255-H257 PolarHBondContact O-N 2.81Å; H257-V259 PolarHBondContact O-N 3.32Å
258	R	92.7	Very high	85.9	Confident	193 Å²	193	93.4 Å²	93.4	73%	0.728	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-68.2	120.1	178.8	-177.3	-178.8	176.9	-174.9	-0.8	110.4	K254 R255	K254-R258 PolarHBondContact O-N 2.93Å; R255-R258 WeakPolarHBondContact O-CB 3.4Å; R255-R258 PolarHBondContact O-N 3.37Å
259	V	90	Very high	84.6	Confident	81 Å²	81	97.4 Å²	97.4	49%	0.491	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-84.5	127	171	-176.2	0	0	0	0	109.4	H257 V263 M264	H257-V259 PolarHBondContact O-N 3.32Å; V259-V263 HydrophobicContact CG1-CB 4.2Å; V259-V263 HydrophobicContact CG1-CG1 4.48Å; V259-M264 HydrophobicContact CB-CG 4.31Å; V259-M264 HydrophobicContact CB-SD 4.46Å; V259-M264 HydrophobicContact CG1-CG 3.76Å
260	P	89.5	Confident	83.7	Confident	46 Å²	46	97.7 Å²	97.7	30%	0.299	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-60.5	137.9	176.4	-25.5	35.5	0	0	0	112.3	L26 E262 V263 M264	L26-P260 HydrophobicContact CD1-CB 3.59Å; L26-P260 HydrophobicContact CD1-CG 3.95Å; P260-E262 WeakPolarHBondContact CB-OE2 3.47Å; P260-E262 PolarHBondContact O-N 2.91Å; P260-E262 VanDerWaalsContact O-N 3.14Å; P260-V263 HydrophobicContact CB-CG2 4.39Å; P260-V263 PolarHBondContact O-N 3.44Å; P260-V263 VanDerWaalsContact O-N 3.13Å; P260-M264 PolarHBondContact O-N 2.8Å
261	P	86.4	Confident	83.2	Confident	55 Å²	55	100.5 Å²	100.5	36%	0.357	51%	0.506	S	S	.	.	H	α-helix	trans	-57.3	-28.6	-179.7	-25.2	34.2	0	0	0	114.3	V263 M264 K265	P261-V263 VanDerWaalsContact C-N 3.33Å; P261-M264 PolarHBondContact O-N 2.8Å; P261-K265 WeakPolarHBondContact O-CB 3.48Å; P261-K265 VanDerWaalsContact O-CG 3.29Å; P261-K265 WeakPolarHBondContact O-CG 3.46Å; P261-K265 PolarHBondContact O-N 3.03Å
262	E	84.4	Confident	82.7	Confident	118 Å²	118	99.6 Å²	99.6	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-40.9	178.8	-62	73.2	-160.4	0	0	111.3	L26 P260 G266	L26-E262 HydrophobicContact CD1-CB 4Å; L26-E262 HydrophobicContact CD2-CB 4.15Å; P260-E262 WeakPolarHBondContact CB-OE2 3.47Å; P260-E262 PolarHBondContact O-N 2.91Å; P260-E262 VanDerWaalsContact O-N 3.14Å; E262-G266 PolarHBondContact O-N 3.15Å
263	V	82	Confident	82.2	Confident	59 Å²	59	105 Å²	105	36%	0.358	52%	0.524	S	S	.	.	H	α-helix	trans	-67.7	-46	174.9	-173.9	0	0	0	0	109.9	L26 V259 P260 P261 K265 G266	L26-V263 HydrophobicContact CD1-CG2 3.67Å; L26-V263 HydrophobicContact CD2-CG2 4.48Å; L26-V263 HydrophobicContact CG-CG2 4.01Å; V259-V263 HydrophobicContact CG1-CB 4.2Å; V259-V263 HydrophobicContact CG1-CG1 4.48Å; P260-V263 HydrophobicContact CB-CG2 4.39Å; P260-V263 PolarHBondContact O-N 3.44Å; P260-V263 VanDerWaalsContact O-N 3.13Å; P261-V263 VanDerWaalsContact C-N 3.33Å; V263-K265 PolarHBondContact O-N 3.32Å; V263-G266 PolarHBondContact O-N 2.96Å
264	M	75.8	Confident	81.8	Confident	90 Å²	90	104 Å²	104	44%	0.443	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-27.3	-178.9	-61.6	-178.1	73.3	0	0	114	V259 P260 P261 K268	V259-M264 HydrophobicContact CB-CG 4.31Å; V259-M264 HydrophobicContact CB-SD 4.46Å; V259-M264 HydrophobicContact CG1-CG 3.76Å; P260-M264 PolarHBondContact O-N 2.8Å; P261-M264 PolarHBondContact O-N 2.8Å; M264-K268 WeakPolarHBondContact O-CG 3.21Å
265	K	67.7	Low	81.5	Confident	156 Å²	156	103.2 Å²	103.2	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-78.7	-32.4	177.9	-76.2	173.6	-176.6	177.4	0	112.1	P261 V263 D267 K268	P261-K265 WeakPolarHBondContact O-CB 3.48Å; P261-K265 VanDerWaalsContact O-CG 3.29Å; P261-K265 WeakPolarHBondContact O-CG 3.46Å; P261-K265 PolarHBondContact O-N 3.03Å; V263-K265 PolarHBondContact O-N 3.32Å; K265-D267 VanDerWaalsContact C-N 3.32Å; K265-D267 PolarHBondContact O-N 3.21Å; K265-K268 PolarHBondContact O-N 2.9Å
266	G	63.1	Low	81.2	Confident	64 Å²	64	99.3 Å²	99.3	66%	0.66	52%	0.523	S	S	*	.	H	α-helix	trans	-61.1	-39.8	178.8	0	0	0	0	0	112.8	E262 V263	E262-G266 PolarHBondContact O-N 3.15Å; V263-G266 PolarHBondContact O-N 2.96Å
267	D	63.4	Low	81	Confident	133 Å²	133	104.6 Å²	104.6	71%	0.711	55%	0.552	S	S	*	*	H	α-helix	trans	-79.4	-23.7	-177.3	-63.8	-23.1	0	0	0	113.5	K265 T269	K265-D267 VanDerWaalsContact C-N 3.32Å; K265-D267 PolarHBondContact O-N 3.21Å; D267-T269 PolarHBondContact O-N 2.83Å
268	K	66.7	Low	80.9	Confident	143 Å²	143	108.5 Å²	108.5	62%	0.622	57%	0.568	S	S	*	*			trans	-80.1	91.1	-179.4	-71.7	178.2	-174.9	-179.2	0	109.1	M264 K265 P270	M264-K268 WeakPolarHBondContact O-CG 3.21Å; K265-K268 PolarHBondContact O-N 2.9Å; K268-P270 WeakPolarHBondContact O-CD 3.41Å; K268-P270 VanDerWaalsContact O-N 3.17Å
269	T	67.6	Low	80.6	Confident	110 Å²	110	101.7 Å²	101.7	68%	0.675	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-55.6	122.2	161.7	50.7	0	0	0	0	108	D267 K271	D267-T269 PolarHBondContact O-N 2.83Å; T269-K271 PolarHBondContact O-N 2.85Å
270	P	75.3	Confident	80.7	Confident	77 Å²	77	101.1 Å²	101.1	50%	0.5	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-57.8	136.4	-179.5	8.2	-13.1	0	0	0	109	K268 N272 K273	K268-P270 WeakPolarHBondContact O-CD 3.41Å; K268-P270 VanDerWaalsContact O-N 3.17Å; P270-N272 PolarHBondContact O-N 3.32Å; P270-K273 HydrophobicContact CB-CB 4.25Å; P270-K273 HydrophobicContact CB-CD 4.05Å; P270-K273 HydrophobicContact CB-CG 4.41Å; P270-K273 HydrophobicContact CG-CB 3.91Å; P270-K273 HydrophobicContact CG-CD 3.88Å; P270-K273 HydrophobicContact CG-CG 4.37Å; P270-K273 WeakPolarHBondContact O-CB 3.36Å; P270-K273 PolarHBondContact O-N 2.92Å
271	K	84.1	Confident	80.7	Confident	191 Å²	191	109.9 Å²	109.9	83%	0.83	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.9	136.5	179.4	-72.4	-174.5	178.9	-178.6	0	109.9	T269 K273	T269-K271 PolarHBondContact O-N 2.85Å; K271-K273 PolarHBondContact O-N 2.8Å
272	N	83.6	Confident	80.7	Confident	90 Å²	90	111 Å²	111	48%	0.481	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	63.9	11.5	-179	-53.2	-25.8	0	0	0	115.5	P270 G283 R284 H286	P270-N272 PolarHBondContact O-N 3.32Å; N272-G283 CarbonylContact O-C 3.52Å; N272-G283 VanDerWaalsContact O-CA 3.26Å; N272-G283 WeakPolarHBondContact O-CA 3.4Å; N272-R284 HydrophobicContact CB-CB 4.43Å; N272-R284 WeakPolarHBondContact CB-O 3.26Å; N272-R284 PolarHBondContact O-N 2.85Å; N272-H286 PolarHBondContact OD1-CE1 3.13Å
273	K	85	Confident	81	Confident	138 Å²	138	107.9 Å²	107.9	60%	0.6	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.4	125.6	173	-62.5	-176	-176.6	178.1	0	108.8	P270 K271 I282	P270-K273 HydrophobicContact CB-CB 4.25Å; P270-K273 HydrophobicContact CB-CD 4.05Å; P270-K273 HydrophobicContact CB-CG 4.41Å; P270-K273 HydrophobicContact CG-CB 3.91Å; P270-K273 HydrophobicContact CG-CD 3.88Å; P270-K273 HydrophobicContact CG-CG 4.37Å; P270-K273 WeakPolarHBondContact O-CB 3.36Å; P270-K273 PolarHBondContact O-N 2.92Å; K271-K273 PolarHBondContact O-N 2.8Å; K273-I282 WeakPolarHBondContact CA-O 3.48Å
274	S	86.2	Confident	81.4	Confident	51 Å²	51	113.5 Å²	113.5	36%	0.357	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.5	156.6	171.9	55.8	0	0	0	0	109.7	I282	S274-I282 PolarHBondContact N-O 3.49Å; S274-I282 PolarHBondContact O-N 3.09Å
275	V	87.4	Confident	82	Confident	102 Å²	102	115.2 Å²	115.2	62%	0.618	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.5	125.5	170.4	-177	0	0	0	0	106.2	S280	V275-S280 CarbonylContact C-O 3.6Å; V275-S280 WeakPolarHBondContact CA-O 3.46Å
276	D	89.1	Confident	82.9	Confident	63 Å²	63	114.1 Å²	114.1	34%	0.337	61%	0.613	S	S	.	*			trans	-69	165.5	175.7	-166.4	12.9	0	0	0	111	F278 G279 S280 I282	D276-F278 PolarHBondContact O-N 2.85Å; D276-F278 VanDerWaalsContact O-N 3.12Å; D276-F278 WeakPolarHBondContact OD2-CD2 3.45Å; D276-G279 PolarHBondContact O-N 3.12Å; D276-S280 PolarHBondContact N-O 3.49Å; D276-I282 HydrophobicContact CB-CD1 3.87Å; D276-I282 HydrophobicContact CB-CG1 4.49Å
277	V	88.9	Confident	84	Confident	140 Å²	140	117 Å²	117	85%	0.848	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-29.3	176.6	-174.2	0	0	0	0	111.3	G279	V277-G279 VanDerWaalsContact C-N 3.31Å; V277-G279 PolarHBondContact O-N 3.47Å
278	F	90	Very high	84.9	Confident	179 Å²	179	113.4 Å²	113.4	79%	0.785	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	2.2	176	-56.6	-70.2	0	0	0	114.5	D276 S280	D276-F278 PolarHBondContact O-N 2.85Å; D276-F278 VanDerWaalsContact O-N 3.12Å; D276-F278 WeakPolarHBondContact OD2-CD2 3.45Å; F278-S280 VanDerWaalsContact C-N 3.34Å
279	G	87.3	Confident	85.6	Confident	50 Å²	50	115.5 Å²	115.5	52%	0.515	62%	0.622	S	S	.	*	S	Bend	trans	85.6	-2.4	-179.5	0	0	0	0	0	115.3	D276 V277	D276-G279 PolarHBondContact O-N 3.12Å; V277-G279 VanDerWaalsContact C-N 3.31Å; V277-G279 PolarHBondContact O-N 3.47Å
280	S	90.5	Very high	86	Confident	68 Å²	68	113.5 Å²	113.5	48%	0.476	61%	0.612	S	S	.	*			trans	-68.6	135.6	177.4	-65	0	0	0	0	111.8	V275 D276 F278	V275-S280 CarbonylContact C-O 3.6Å; V275-S280 WeakPolarHBondContact CA-O 3.46Å; D276-S280 PolarHBondContact N-O 3.49Å; F278-S280 VanDerWaalsContact C-N 3.34Å
281	R	89.4	Confident	85.9	Confident	231 Å²	231	113.7 Å²	113.7	87%	0.872	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.5	114.6	177.6	-65	-179.5	-178.4	177.3	0.8	110.2
282	I	88.1	Confident	85.1	Confident	77 Å²	77	111.8 Å²	111.8	40%	0.395	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.1	127.9	178.9	-58.3	173.6	0	0	0	109.2	K273 S274 D276	K273-I282 WeakPolarHBondContact CA-O 3.48Å; S274-I282 PolarHBondContact N-O 3.49Å; S274-I282 PolarHBondContact O-N 3.09Å; D276-I282 HydrophobicContact CB-CD1 3.87Å; D276-I282 HydrophobicContact CB-CG1 4.49Å
283	G	90	Very high	84.4	Confident	54 Å²	54	113.3 Å²	113.3	56%	0.557	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.8	120.3	171.2	0	0	0	0	0	111	N272	N272-G283 CarbonylContact O-C 3.52Å; N272-G283 VanDerWaalsContact O-CA 3.26Å; N272-G283 WeakPolarHBondContact O-CA 3.4Å
284	R	89.3	Confident	83.7	Confident	176 Å²	176	114 Å²	114	66%	0.664	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-81.9	117.4	171.4	-74.8	-170.2	-175.6	-179	1.6	110.4	N272	N272-R284 HydrophobicContact CB-CB 4.43Å; N272-R284 WeakPolarHBondContact CB-O 3.26Å; N272-R284 PolarHBondContact O-N 2.85Å
285	V	89.4	Confident	83	Confident	126 Å²	126	118 Å²	118	76%	0.764	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-93.8	120.4	169.5	-177.8	0	0	0	0	108.2	V287	V285-V287 HydrophobicContact CG1-CG2 4.28Å; V285-V287 PolarHBondContact O-N 3.48Å
286	H	86.3	Confident	82.3	Confident	133 Å²	133	119 Å²	119	62%	0.616	64%	0.641	S	S	*	*			trans	-90.4	101	174.3	-64.6	81.3	0	0	0	107.9	N272 G288	N272-H286 PolarHBondContact OD1-CE1 3.13Å; H286-G288 PolarHBondContact O-N 3.09Å
287	V	86.6	Confident	81.5	Confident	125 Å²	125	125.7 Å²	125.7	76%	0.758	66%	0.661	S	S	*	*			trans	-78.9	118	171.8	-172.1	0	0	0	0	107.1	V285	V285-V287 HydrophobicContact CG1-CG2 4.28Å; V285-V287 PolarHBondContact O-N 3.48Å
288	G	83	Confident	80.7	Confident	58 Å²	58	121.8 Å²	121.8	60%	0.598	64%	0.639	S	S	*	*			trans	-61.7	153.8	176.5	0	0	0	0	0	111.4	H286 S290	H286-G288 PolarHBondContact O-N 3.09Å; G288-S290 PolarHBondContact O-N 3.48Å; G288-S290 VanDerWaalsContact O-N 3.09Å
289	K	80.3	Confident	79.8	Confident	187 Å²	187	115.3 Å²	115.3	81%	0.813	62%	0.622	S	S	*	*			trans	-64.3	113.2	173.1	-170.2	-176.4	-173.5	-166.8	0	108.5	S291	K289-S291 PolarHBondContact O-N 3.29Å
290	S	77	Confident	78.9	Confident	68 Å²	68	117.5 Å²	117.5	48%	0.476	63%	0.63	S	S	.	*			trans	-72.2	89.9	179.3	-48.1	0	0	0	0	110.9	G288 E292 L293	G288-S290 PolarHBondContact O-N 3.48Å; G288-S290 VanDerWaalsContact O-N 3.09Å; S290-E292 PolarHBondContact O-N 2.98Å; S290-L293 PolarHBondContact O-N 3.45Å
291	S	72.3	Confident	77.8	Confident	81 Å²	81	119.3 Å²	119.3	57%	0.566	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-22.1	172.9	48.6	0	0	0	0	112.9	K289 L293 E294	K289-S291 PolarHBondContact O-N 3.29Å; S291-L293 VanDerWaalsContact C-N 3.29Å; S291-L293 PolarHBondContact O-N 3.43Å; S291-E294 PolarHBondContact O-N 3.4Å
292	E	67.7	Low	76.7	Confident	151 Å²	151	112.9 Å²	112.9	71%	0.706	62%	0.62	S	S	*	*	H	α-helix	trans	-71.1	-21.4	179.8	-63.7	-179.9	176.8	0	0	113.7	S290 E294 N295 L296	S290-E292 PolarHBondContact O-N 2.98Å; E292-E294 VanDerWaalsContact C-N 3.32Å; E292-E294 PolarHBondContact O-N 3.37Å; E292-N295 PolarHBondContact O-N 3.17Å; E292-N295 VanDerWaalsContact O-N 3.11Å; E292-L296 PolarHBondContact O-N 3.11Å; E292-L296 VanDerWaalsContact O-N 3.17Å
293	L	68.8	Low	75.5	Confident	122 Å²	122	115 Å²	115	64%	0.639	62%	0.623	S	S	*	*	H	α-helix	trans	-67.6	-31.2	176.3	-104.2	137.9	0	0	0	112.8	S290 S291 N295 L296	S290-L293 PolarHBondContact O-N 3.45Å; S291-L293 VanDerWaalsContact C-N 3.29Å; S291-L293 PolarHBondContact O-N 3.43Å; L293-N295 PolarHBondContact O-N 3.47Å; L293-L296 HydrophobicContact CG-CD1 4.13Å; L293-L296 PolarHBondContact O-N 3.43Å
294	E	69.5	Low	74.2	Confident	152 Å²	152	114.7 Å²	114.7	71%	0.71	61%	0.611	S	S	*	*	H	α-helix	trans	-70.9	-22.8	173.4	-67.5	176.8	-174.1	0	0	111.7	S291 E292	S291-E294 PolarHBondContact O-N 3.4Å; E292-E294 VanDerWaalsContact C-N 3.32Å; E292-E294 PolarHBondContact O-N 3.37Å
295	N	72.8	Confident	72.9	Confident	134 Å²	134	110.4 Å²	110.4	72%	0.717	61%	0.613	S	S	*	*	H	α-helix	trans	-92.1	-9.3	178.6	-67.3	-37	0	0	0	113.7	E292 L293 R297	E292-N295 PolarHBondContact O-N 3.17Å; E292-N295 VanDerWaalsContact O-N 3.11Å; L293-N295 PolarHBondContact O-N 3.47Å; N295-R297 PolarHBondContact O-N 3.42Å
296	L	72.6	Confident	71.7	Confident	124 Å²	124	110.7 Å²	110.7	65%	0.649	61%	0.609	S	S	*	*			trans	-72.9	111.8	-180	-93.1	153.1	0	0	0	110.4	E292 L293	E292-L296 PolarHBondContact O-N 3.11Å; E292-L296 VanDerWaalsContact O-N 3.17Å; L293-L296 HydrophobicContact CG-CD1 4.13Å; L293-L296 PolarHBondContact O-N 3.43Å
297	R	71.8	Confident	70.8	Confident	203 Å²	203	107.9 Å²	107.9	77%	0.766	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-82.6	138.3	173.5	-68.5	178.7	175.1	169	-0.5	110	N295 G299	N295-R297 PolarHBondContact O-N 3.42Å; R297-G299 PolarHBondContact O-N 3.49Å
298	P	72.3	Confident	69.7	Low	59 Å²	59	105.1 Å²	105.1	38%	0.383	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-60.7	139.6	174.4	21.2	-29	0	0	0	110.8	I302 R303	P298-I302 HydrophobicContact CB-CB 3.99Å; P298-I302 HydrophobicContact CB-CG2 3.69Å; P298-R303 HydrophobicContact CG-CB 4.38Å
299	G	72	Confident	68.6	Low	42 Å²	42	109 Å²	109	43%	0.433	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-55.5	158.7	176	0	0	0	0	0	112.1	R297 T301 I302 R303	R297-G299 PolarHBondContact O-N 3.49Å; G299-T301 PolarHBondContact O-N 3.01Å; G299-T301 VanDerWaalsContact O-N 3.08Å; G299-I302 PolarHBondContact O-N 2.99Å; G299-R303 WeakPolarHBondContact O-CB 3.27Å; G299-R303 PolarHBondContact O-N 2.93Å
300	S	67.7	Low	67.5	Low	96 Å²	96	109.6 Å²	109.6	67%	0.671	60%	0.598	S	S	*	*	H	α-helix	trans	-53.7	-35.3	-172	57.2	0	0	0	0	113.7	T304	S300-T304 VanDerWaalsContact O-CB 3.27Å; S300-T304 WeakPolarHBondContact O-CB 3.42Å; S300-T304 PolarHBondContact O-N 2.64Å; S300-T304 PolarHBondContact O-OG1 3.24Å
301	T	67.9	Low	66.4	Low	107 Å²	107	115.4 Å²	115.4	66%	0.656	62%	0.615	S	S	*	*	H	α-helix	trans	-64.9	-51.7	175.8	43.7	0	0	0	0	112.3	G299 T304 A305	G299-T301 PolarHBondContact O-N 3.01Å; G299-T301 VanDerWaalsContact O-N 3.08Å; T301-T304 PolarHBondContact O-N 2.63Å; T301-A305 PolarHBondContact O-N 2.95Å
302	I	66.4	Low	65.4	Low	96 Å²	96	121.9 Å²	121.9	49%	0.492	63%	0.627	S	S	.	*	H	α-helix	trans	-67.2	-39.7	178.6	-62.4	173.7	0	0	0	110.6	P298 G299 T304 A305 L306	P298-I302 HydrophobicContact CB-CB 3.99Å; P298-I302 HydrophobicContact CB-CG2 3.69Å; G299-I302 PolarHBondContact O-N 2.99Å; I302-T304 VanDerWaalsContact C-N 3.32Å; I302-T304 PolarHBondContact O-N 2.97Å; I302-A305 PolarHBondContact O-N 2.92Å; I302-L306 HydrophobicContact CG2-CD1 3.67Å; I302-L306 HydrophobicContact CG2-CG 4.18Å; I302-L306 WeakPolarHBondContact O-CB 3.4Å; I302-L306 WeakPolarHBondContact O-CG 3.34Å; I302-L306 PolarHBondContact O-N 2.83Å
303	R	61	Low	64.5	Low	121 Å²	121	118 Å²	118	46%	0.457	63%	0.628	S	S	.	*	H	α-helix	trans	-64.2	-38.6	176.4	-168.2	175.1	-174.5	163.4	3.3	111.7	P298 G299 T307	P298-R303 HydrophobicContact CG-CB 4.38Å; G299-R303 WeakPolarHBondContact O-CB 3.27Å; G299-R303 PolarHBondContact O-N 2.93Å; R303-T307 HydrophobicContact CG-CG2 4.43Å; R303-T307 WeakPolarHBondContact O-CB 3.4Å; R303-T307 PolarHBondContact O-N 3.31Å; R303-T307 PolarHBondContact O-OG1 3.45Å
304	T	63.4	Low	63.2	Low	48 Å²	48	121.7 Å²	121.7	29%	0.294	64%	0.639	S	S	.	*	H	α-helix	trans	-66.9	-40	174.5	-57.5	0	0	0	0	111	S300 T301 I302 G308 R310	S300-T304 VanDerWaalsContact O-CB 3.27Å; S300-T304 WeakPolarHBondContact O-CB 3.42Å; S300-T304 PolarHBondContact O-N 2.64Å; S300-T304 PolarHBondContact O-OG1 3.24Å; T301-T304 PolarHBondContact O-N 2.63Å; I302-T304 VanDerWaalsContact C-N 3.32Å; I302-T304 PolarHBondContact O-N 2.97Å; T304-G308 WeakPolarHBondContact O-CA 3.42Å; T304-G308 PolarHBondContact O-N 2.97Å; T304-R310 HydrophobicContact CG2-CB 3.89Å; T304-R310 HydrophobicContact CG2-CG 4Å
305	A	63.1	Low	62	Low	86 Å²	86	122.8 Å²	122.8	71%	0.711	64%	0.644	S	S	*	*	H	α-helix	trans	-65.6	-40.8	175.3	0	0	0	0	0	112.9	T301 I302	T301-A305 PolarHBondContact O-N 2.95Å; I302-A305 PolarHBondContact O-N 2.92Å
306	L	63.8	Low	60.6	Low	131 Å²	131	126.5 Å²	126.5	69%	0.686	65%	0.648	S	S	*	*	H	α-helix	trans	-78.7	-31.4	-177.8	-72.7	172	0	0	0	114	I302	I302-L306 HydrophobicContact CG2-CD1 3.67Å; I302-L306 HydrophobicContact CG2-CG 4.18Å; I302-L306 WeakPolarHBondContact O-CB 3.4Å; I302-L306 WeakPolarHBondContact O-CG 3.34Å; I302-L306 PolarHBondContact O-N 2.83Å
307	T	67.4	Low	59.4	Low	74 Å²	74	128.3 Å²	128.3	45%	0.454	66%	0.656	S	S	.	*	H	α-helix	trans	-105.9	-6.4	-174.8	63.3	0	0	0	0	113.7	R303 H309	R303-T307 HydrophobicContact CG-CG2 4.43Å; R303-T307 WeakPolarHBondContact O-CB 3.4Å; R303-T307 PolarHBondContact O-N 3.31Å; R303-T307 PolarHBondContact O-OG1 3.45Å; T307-H309 PolarHBondContact O-N 3.06Å; T307-H309 PolarHBondContact O-ND1 3.08Å
308	G	62.7	Low	58.1	Low	67 Å²	67	126.9 Å²	126.9	69%	0.691	66%	0.656	S	S	*	*	S	Bend	trans	64.2	-5.3	-177.2	0	0	0	0	0	114.9	T304	T304-G308 WeakPolarHBondContact O-CA 3.42Å; T304-G308 PolarHBondContact O-N 2.97Å
309	H	59.8	Low	56.5	Low	140 Å²	140	129.7 Å²	129.7	65%	0.648	68%	0.677	S	S	*	*			trans	-109.1	107.9	-175.5	-70.8	77.5	0	0	0	110	T307 K311	T307-H309 PolarHBondContact O-N 3.06Å; T307-H309 PolarHBondContact O-ND1 3.08Å; H309-K311 VanDerWaalsContact C-N 3.3Å; H309-K311 PolarHBondContact O-N 3.23Å
310	R	56.9	Low	55	Low	199 Å²	199	131.2 Å²	131.2	75%	0.751	69%	0.692	S	S	*	*			trans	-72.6	82.5	173.4	-159.9	176.9	-176.7	-164.9	1.6	109	T304 R312	T304-R310 HydrophobicContact CG2-CB 3.89Å; T304-R310 HydrophobicContact CG2-CG 4Å; R310-R312 PolarHBondContact O-N 2.89Å
311	K	55.3	Low	53.9	Low	191 Å²	191	133.5 Å²	133.5	83%	0.83	70%	0.702	S	S	*	*			trans	-67.7	95.6	174.3	-80.1	-162.5	174.5	-169.4	0	109.9	H309	H309-K311 VanDerWaalsContact C-N 3.3Å; H309-K311 PolarHBondContact O-N 3.23Å
312	R	51.5	Low	52.5	Low	217 Å²	217	139.8 Å²	139.8	82%	0.819	71%	0.714	S	S	*	*			trans	-64.3	131.7	160.5	-69.3	180	175.5	-176.9	-1.2	108.2	R310	R310-R312 PolarHBondContact O-N 2.89Å
313	G	47.5	Very low	51.3	Low	70 Å²	70	144.3 Å²	144.3	72%	0.722	73%	0.73	S	S	*	*			trans	72	113.4	156.2	0	0	0	0	0	115.6	E315	G313-E315 VanDerWaalsContact C-N 3.32Å; G313-E315 PolarHBondContact O-N 2.9Å
314	F	41.7	Very low	50.4	Low	199 Å²	199	143.2 Å²	143.2	87%	0.873	74%	0.741	S	S	*	*			trans	-63.8	92.4	163.3	-159.9	-92.7	0	0	0	108.4	R316	F314-R316 HydrophobicContact CD1-CG 4.3Å; F314-R316 PolarHBondContact O-N 2.81Å
315	E	45.5	Very low	49.4	Very low	174 Å²	174	149.2 Å²	149.2	81%	0.813	76%	0.763	S	S	*	*			trans	-63.2	103.3	163.1	-87	-174.1	159.1	0	0	107.7	G313 I317	G313-E315 VanDerWaalsContact C-N 3.32Å; G313-E315 PolarHBondContact O-N 2.9Å; E315-I317 VanDerWaalsContact C-N 3.32Å; E315-I317 PolarHBondContact O-N 2.9Å
316	R	42.4	Very low	48.3	Very low	212 Å²	212	153.4 Å²	153.4	80%	0.8	77%	0.765	S	S	*	*			trans	-59.6	97.1	162.1	-83.6	179.5	176.8	163	-1.9	107.7	F314 K318	F314-R316 HydrophobicContact CD1-CG 4.3Å; F314-R316 PolarHBondContact O-N 2.81Å; R316-K318 VanDerWaalsContact C-N 3.3Å; R316-K318 PolarHBondContact O-N 3.02Å
317	I	46.9	Very low	47.1	Very low	162 Å²	162	152.7 Å²	152.7	83%	0.831	77%	0.766	S	S	*	*			trans	-70.7	99.1	157	-61.7	177.4	0	0	0	106.1	E315	E315-I317 VanDerWaalsContact C-N 3.32Å; E315-I317 PolarHBondContact O-N 2.9Å
318	K	45.3	Very low	45.8	Very low	174 Å²	174	153.9 Å²	153.9	76%	0.757	78%	0.777	S	S	*	*			trans	-60.7	133.5	169.9	-79.6	178.7	173.5	177.5	0	109.4	R316	R316-K318 VanDerWaalsContact C-N 3.3Å; R316-K318 PolarHBondContact O-N 3.02Å
319	S	39.3	Very low	44.8	Very low	117 Å²	117	156.6 Å²	156.6	82%	0.818	78%	0.781	S	S	*	*	S	Bend	trans	-3.3	125.5	152.9	54.1	0	0	0	0	117.8
320	G	40.5	Very low	43.7	Very low	74 Å²	74	155.4 Å²	155.4	76%	0.763	79%	0.785	S	S	*	*			trans	115.4	83.7	134.9	0	0	0	0	0	116.5
321	V	43.3	Very low	43.2	Very low	145 Å²	145	151.8 Å²	151.8	88%	0.879	79%	0.785	S	S	*	*			trans	-142.6	109.1	141.8	-177	0	0	0	0	108.9
322	R	38.5	Very low	42.2	Very low	239 Å²	239	150.2 Å²	150.2	90%	0.902	79%	0.786	S	S	*	*			trans	-64.3	137.4	164.1	-79.2	172.2	158.6	177.3	-5.7	110
323	K	42.4	Very low	41.9	Very low	191 Å²	191	147.4 Å²	147.4	83%	0.83	79%	0.786	S	S	*	*			trans	-178.8	97.7	142	-100.4	166.1	-176.9	-177.6	0	106.7
324	S	42.2	Very low	41.2	Very low	98 Å²	98	149.5 Å²	149.5	69%	0.685	79%	0.79	S	S	*	*				53.8	116.1	91.8	80.9	0	0	0	0	111
325	K	41.2	Very low	41.2	Very low	174 Å²	174	144.3 Å²	144.3	76%	0.757	78%	0.783	S	S	*	*				-179.6	144.1	59.7	-111	170.5	-179.5	173.3	0	108.2
326	K	40.6	Very low	40.8	Very low	173 Å²	173	140.8 Å²	140.8	75%	0.752	78%	0.778	S	S	*	*			trans	60	136.8	134.9	-70	-177.2	175.5	-169.8	0	117.8
327	T	38.4	Very low	40.5	Very low	116 Å²	116	139.6 Å²	139.6	71%	0.712	78%	0.778	S	S	*	*			cis	-174.1	142.5	32.4	-2.3	0	0	0	0	110.4
328	S	39.6	Very low	40.1	Very low	99 Å²	99	143.1 Å²	143.1	69%	0.692	78%	0.781	S	S	*	*			trans	41.4	135.3	141.5	58.6	0	0	0	0	120.1
329	V	42.3	Very low	39.7	Very low	125 Å²	125	146.2 Å²	146.2	76%	0.758	79%	0.788	S	S	*	*				-154.5	140.9	64	178.7	0	0	0	0	111.1	V331	V329-V331 HydrophobicContact CG1-CG2 4.49Å
330	P	36.9	Very low	39.9	Very low	115 Å²	115	150 Å²	150	75%	0.747	79%	0.79	S	S	*	*			trans	-99.3	145.8	169.8	36.5	-27	0	0	0	111.7
331	V	46.3	Very low	39.9	Very low	122 Å²	122	153.9 Å²	153.9	74%	0.739	79%	0.793	S	S	*	*			trans	-141.6	104.6	160.9	-175.9	0	0	0	0	109.2	V329 L333	V329-V331 HydrophobicContact CG1-CG2 4.49Å; V331-L333 HydrophobicContact CG1-CD1 4.06Å
332	D	34.9	Very low	40.1	Very low	159 Å²	159	156 Å²	156	85%	0.85	79%	0.79	S	S	*	*			trans	-61	136.1	157.4	-81.3	-45.4	0	0	0	109.7
333	L	44.8	Very low	40.3	Very low	157 Å²	157	150.6 Å²	150.6	82%	0.822	78%	0.784	S	S	*	*			trans	-153.2	96	156.7	-100.1	153.1	0	0	0	109.5	V331 A335	V331-L333 HydrophobicContact CG1-CD1 4.06Å; L333-A335 PolarHBondContact O-N 2.84Å
334	S	33.3	Very low	40.7	Very low	115 Å²	115	148.8 Å²	148.8	80%	0.804	78%	0.783	S	S	*	*			trans	-55.2	120.8	157.9	52.5	0	0	0	0	111.5
335	A	40.3	Very low	40.8	Very low	89 Å²	89	152.5 Å²	152.5	74%	0.736	82%	0.82	S	S	*	*			trans	-168.9	104.5	155	0	0	0	0	0	108.5	L333	L333-A335 PolarHBondContact O-N 2.84Å
336	S	37.7	Very low	40.8	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	82%	0.823	S	S	*	*				78	119.3	91.1	-162.9	0	0	0	0	114.1
337	K	36.5	Very low	40.8	Very low	187 Å²	187	150.3 Å²	150.3	81%	0.813	83%	0.827	S	S	*	*			trans	59.3	116.3	148.1	-78.8	173.9	175.9	170.9	0	118
338	R	38.3	Very low	40.9	Very low	237 Å²	237	152.2 Å²	152.2	89%	0.894	83%	0.833	S	S	*	*				179	131.8	91.2	-112.3	166	175.1	-179.9	-2.4	113.1
339	R	35.7	Very low	41	Very low	238 Å²	238	155.4 Å²	155.4	90%	0.898	84%	0.842	S	S	*	*			trans	-48.7	138.4	155.9	-67.4	171.7	-178.6	160.9	-0.4	109.9
340	K	44.5	Very low	40.9	Very low	196 Å²	196	157.3 Å²	157.3	85%	0.852	85%	0.847	S	S	*	*			trans	-120.5	111.2	153.1	-82.9	-170	176.6	-178	0	109.5
341	L	41.1	Very low	41.2	Very low	157 Å²	157	160.1 Å²	160.1	82%	0.822	85%	0.854	S	S	*	*			trans	-57.4	136.3	157.2	-69.3	145.8	0	0	0	108.3
342	F	47.6	Very low	40.8	Very low	190 Å²	190	162.8 Å²	162.8	83%	0.833	86%	0.862	S	S	*	*			trans	-100.4	109.9	156.3	-99.1	-90.7	0	0	0	107.2
343	T	41.5	Very low	41.3	Very low	125 Å²	125	163.1 Å²	163.1	77%	0.767	86%	0.863	S	S	*	*			trans	-88.2	120.3	155.5	45.5	0	0	0	0	106.4
344	D	51.3	Low	41	Very low	152 Å²	152	163.6 Å²	163.6	81%	0.813	87%	0.866	S	S	*	*			trans	-98.3	146.7	154.3	-81	-30.5	0	0	0	108
345	A	43.7	Very low	41.7	Very low	177 Å²	177	168 Å²	168	100%	1.463	87%	0.872	S	S	*	*			trans	-56.6	0	-169.8	0	0	0	0	0	115.9

Retrieved 345 of 345 residues in 139.9 ms (Link to these results)

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