A0A077ZF88_TRITR Loading...

B9-C2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZF88, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 470 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	23.8	Very low	30.8	Very low	240 Å²	240	155.8 Å²	155.8	100%	1.182	86%	0.855	S	S	*	*				0	100.9	0	-147.4	178.2	-157.9	0	0	108.2
2	A	27.3	Very low	33	Very low	86 Å²	86	149 Å²	149	71%	0.711	83%	0.827	S	S	*	*			trans	-149.5	105.7	162.4	0	0	0	0	0	105.4
3	L	24.4	Very low	35.8	Very low	160 Å²	160	141.5 Å²	141.5	84%	0.838	79%	0.791	S	S	*	*			trans	-64.5	132.8	163.8	-79.9	108.2	0	0	0	108.8
4	C	24.1	Very low	38.7	Very low	119 Å²	119	136.7 Å²	136.7	80%	0.804	77%	0.767	S	S	*	*			trans	174.2	128.9	149.6	-92.9	0	0	0	0	105.4
5	K	25.1	Very low	41.2	Very low	186 Å²	186	135.3 Å²	135.3	81%	0.809	75%	0.751	S	S	*	*			cis	-150.3	152.9	11.4	-96.9	169.1	175.4	175.1	0	107.4	N7	K5-N7 VanDerWaalsContact C-N 3.34Å; K5-N7 PolarHBondContact O-N 3.39Å
6	N	25.9	Very low	43.8	Very low	161 Å²	161	134.8 Å²	134.8	86%	0.861	74%	0.739	S	S	*	*			trans	-46.8	93.7	160.9	-63.3	-23.9	0	0	0	110.7
7	N	31.5	Very low	46.2	Very low	154 Å²	154	133.8 Å²	133.8	82%	0.824	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-93.9	125.7	144.7	-78.3	-14.3	0	0	0	105.4	K5	K5-N7 VanDerWaalsContact C-N 3.34Å; K5-N7 PolarHBondContact O-N 3.39Å
8	L	31.9	Very low	48.4	Very low	162 Å²	162	129.1 Å²	129.1	85%	0.848	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-47.5	156.1	172.1	-91.2	102.4	0	0	0	111.4	G10	L8-G10 PolarHBondContact O-N 3.05Å
9	P	35.8	Very low	50.5	Low	126 Å²	126	126.3 Å²	126.3	82%	0.818	69%	0.691	S	S	*	*	S	Bend	trans	-61.7	135.1	-166.6	26.9	-35.3	0	0	0	112.3
10	G	45.4	Very low	52.4	Low	77 Å²	77	125.4 Å²	125.4	79%	0.794	68%	0.683	S	S	*	*				113.7	25.4	112.6	0	0	0	0	0	118.2	L8	L8-G10 PolarHBondContact O-N 3.05Å
11	R	43.5	Very low	54	Low	243 Å²	243	120.6 Å²	120.6	92%	0.917	66%	0.66	S	S	*	*			trans	-144.7	101.9	161.3	-139.6	172.4	-174.7	171.5	0.2	110.6
12	S	57.4	Low	57	Low	74 Å²	74	112.5 Å²	112.5	52%	0.517	62%	0.617	S	S	.	*			trans	-60	132.9	157.6	44.8	0	0	0	0	107.8	V14 D46	S12-V14 PolarHBondContact O-N 3.43Å; S12-D46 WeakPolarHBondContact CA-OD1 3.08Å; S12-D46 WeakPolarHBondContact CB-OD1 3.48Å
13	S	69.2	Low	59.8	Low	51 Å²	51	109.4 Å²	109.4	36%	0.357	59%	0.588	S	S	.	*			trans	-80.7	114.9	171.3	53.3	0	0	0	0	106.8	D46	S13-D46 PolarHBondContact N-OD1 2.84Å; S13-D46 VanDerWaalsContact N-OD1 3.09Å; S13-D46 PolarHBondContact O-N 2.79Å
14	V	76.8	Confident	62.5	Low	75 Å²	75	102.2 Å²	102.2	46%	0.455	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.7	108.8	172	-177	0	0	0	0	106.9	S12 E43 L44 I45	S12-V14 PolarHBondContact O-N 3.43Å; V14-E43 HydrophobicContact CG1-CB 4.29Å; V14-E43 HydrophobicContact CG1-CG 4.4Å; V14-L44 WeakPolarHBondContact CA-O 3.36Å; V14-I45 HydrophobicContact CG1-CG1 4.46Å; V14-I45 HydrophobicContact CG2-CG1 4.38Å; V14-I45 HydrophobicContact CG2-CG2 4.46Å
15	Q	76	Confident	65.2	Low	115 Å²	115	100 Å²	100	54%	0.537	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	130.1	168.3	-63.9	-175.1	-3.9	0	0	108.2	E43 L44	Q15-E43 CarbonylContact O-C 3.53Å; Q15-E43 WeakPolarHBondContact O-CA 3.32Å; Q15-L44 HydrophobicContact CB-CB 4.28Å; Q15-L44 PolarHBondContact N-O 2.95Å; Q15-L44 PolarHBondContact O-N 2.78Å
16	K	82.2	Confident	67.3	Low	127 Å²	127	97.9 Å²	97.9	55%	0.552	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.8	-174	-176.5	172	-178	133.3	0	109.9	T41 L42 E43	K16-T41 HydrophobicContact CD-CG2 4.23Å; K16-T41 HydrophobicContact CG-CG2 4.02Å; K16-L42 CarbonylContact C-O 3.54Å; K16-L42 WeakPolarHBondContact CA-O 3.3Å; K16-E43 HydrophobicContact CB-CG 4.28Å; K16-E43 HydrophobicContact CD-CG 4.28Å; K16-E43 HydrophobicContact CG-CG 3.94Å; K16-E43 IonicContact NZ-OE1 3.88Å; K16-E43 PolarHBondContact NZ-OE1 2.8Å
17	M	84.4	Confident	69.6	Low	119 Å²	119	99.2 Å²	99.2	59%	0.586	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.5	171.6	177.2	179.1	-177.7	0	0	108.2	T41 L42	M17-T41 CarbonylContact O-C 3.48Å; M17-L42 HydrophobicContact CB-CB 4.22Å; M17-L42 HydrophobicContact CG-CD1 4.4Å; M17-L42 PolarHBondContact N-O 2.9Å; M17-L42 PolarHBondContact O-N 2.75Å; M17-L42 HydrophobicContact SD-CD1 4.13Å
18	C	87.2	Confident	71.3	Confident	49 Å²	49	95.4 Å²	95.4	33%	0.331	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.2	175	-61.8	0	0	0	0	108.8	M20 V38	C18-M20 HydrophobicContact CB-CG 4.14Å; C18-V38 HydrophobicContact CB-CG1 4.31Å
19	I	88.5	Confident	72.8	Confident	76 Å²	76	95.3 Å²	95.3	39%	0.39	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.9	166.5	-54.2	-168.7	0	0	0	106.8	L39 C40 L42	I19-L39 PolarHBondContact O-N 2.74Å; I19-C40 PolarHBondContact N-O 3.17Å; I19-C40 PolarHBondContact O-N 3.27Å; I19-L42 HydrophobicContact CD1-CD1 4.07Å; I19-L42 HydrophobicContact CG1-CD1 4.2Å
20	M	88	Confident	74.3	Confident	108 Å²	108	93.9 Å²	93.9	53%	0.532	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.5	-175	-57.6	-177.8	-67.4	0	0	110.2	C18 I37 V38	C18-M20 HydrophobicContact CB-CG 4.14Å; M20-I37 CarbonylContact C-O 3.44Å; M20-I37 VanDerWaalsContact CA-O 3.26Å; M20-I37 WeakPolarHBondContact CA-O 3.27Å; M20-V38 HydrophobicContact CG-CG2 4.08Å; M20-V38 HydrophobicContact SD-CG2 4.32Å
21	A	86	Confident	75.6	Confident	25 Å²	25	93.9 Å²	93.9	21%	0.207	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.4	171.3	0	0	0	0	0	110.4	L23 I37 L39	A21-L23 HydrophobicContact CB-CD2 4.2Å; A21-I37 PolarHBondContact N-O 2.98Å; A21-I37 PolarHBondContact O-N 2.97Å; A21-L39 HydrophobicContact CB-CD1 3.76Å; A21-L39 HydrophobicContact CB-CD2 3.98Å; A21-L39 HydrophobicContact CB-CG 3.81Å
22	Y	85.7	Confident	77.2	Confident	69 Å²	69	83.9 Å²	83.9	27%	0.271	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	109.8	170.5	-178.3	-101.8	0	0	0	109.1	L26 T30 Y31 D32 D35 E36	Y22-L26 HydrophobicContact CD1-CD2 4.1Å; Y22-L26 HydrophobicContact CE1-CD2 4.2Å; Y22-T30 PolarHBondContact OH-O 3.26Å; Y22-Y31 HydrophobicContact CD2-CD2 4.14Å; Y22-Y31 HydrophobicContact CD2-CE2 4.16Å; Y22-Y31 AromaticContact CE2-CD2 3.77Å; Y22-Y31 HydrophobicContact CE2-CD2 3.77Å; Y22-Y31 HydrophobicContact CE2-CE2 4.11Å; Y22-D32 WeakPolarHBondContact CE2-O 3.48Å; Y22-D32 PolarHBondContact OH-N 3.45Å; Y22-D35 HydrophobicContact CD2-CB 4.14Å; Y22-D35 HydrophobicContact CE2-CB 3.68Å; Y22-E36 HydrophobicContact CD2-CG 4.06Å
23	L	86.7	Confident	78.2	Confident	21 Å²	21	87.7 Å²	87.7	11%	0.11	44%	0.441	C	S	.	.			trans	-102.9	26.4	-177.7	-56.5	-177.6	0	0	0	112.7	A21 D35 I37 I66 T70 Y73	A21-L23 HydrophobicContact CB-CD2 4.2Å; L23-D35 PolarHBondContact N-O 2.92Å; L23-I37 HydrophobicContact CB-CD1 4.4Å; L23-I37 HydrophobicContact CD1-CD1 3.51Å; L23-I37 HydrophobicContact CG-CD1 4.19Å; L23-I66 HydrophobicContact CD1-CD1 3.48Å; L23-I66 VanDerWaalsContact CD1-CD1 3.48Å; L23-I66 HydrophobicContact CD1-CG1 3.96Å; L23-T70 WeakPolarHBondContact O-CG2 3.27Å; L23-T70 PolarHBondContact O-OG1 3.09Å; L23-Y73 HydrophobicContact CB-CD2 4.41Å; L23-Y73 HydrophobicContact CB-CE2 3.99Å; L23-Y73 HydrophobicContact CD1-CD2 3.54Å; L23-Y73 HydrophobicContact CD1-CE2 3.99Å; L23-Y73 HydrophobicContact CD1-CG 4.17Å; L23-Y73 HydrophobicContact CD2-CD1 4.47Å; L23-Y73 HydrophobicContact CD2-CD2 4.13Å; L23-Y73 HydrophobicContact CD2-CE2 4.2Å; L23-Y73 HydrophobicContact CD2-CG 4.26Å; L23-Y73 HydrophobicContact CG-CD2 4.23Å; L23-Y73 HydrophobicContact CG-CE2 4.28Å
24	G	81.6	Confident	78.8	Confident	9 Å²	9	94.3 Å²	94.3	9%	0.093	46%	0.458	C	S	.	.	S	Bend	trans	-83.5	170.4	177.9	0	0	0	0	0	112.9	L26 D35	G24-L26 PolarHBondContact O-N 2.83Å; G24-L26 VanDerWaalsContact O-N 3.09Å; G24-D35 VanDerWaalsContact CA-OD2 3.3Å; G24-D35 WeakPolarHBondContact CA-OD2 3.15Å
25	D	80	Confident	79.2	Confident	72 Å²	72	90.9 Å²	90.9	39%	0.385	44%	0.437	S	S	.	.			trans	-76.1	99.1	175.8	-175.5	2.9	0	0	0	110.9	K27 T28 T70	D25-K27 PolarHBondContact O-N 3.36Å; D25-K27 VanDerWaalsContact O-N 3.08Å; D25-K27 VanDerWaalsContact OD1-CB 3.26Å; D25-K27 WeakPolarHBondContact OD1-CB 3.44Å; D25-K27 PolarHBondContact OD1-N 2.85Å; D25-T28 HydrophobicContact CB-CG2 4.08Å; D25-T28 PolarHBondContact O-N 2.97Å; D25-T28 VanDerWaalsContact O-N 3.12Å; D25-T28 PolarHBondContact O-OG1 2.91Å; D25-T28 WeakPolarHBondContact OD2-CG2 3.45Å; D25-T70 HydrophobicContact CB-CG2 4.26Å
26	L	70.5	Confident	79.7	Confident	142 Å²	142	88.5 Å²	88.5	74%	0.743	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-57.2	-21.4	177.2	-66.6	169.9	0	0	0	113.5	Y22 G24	Y22-L26 HydrophobicContact CD1-CD2 4.1Å; Y22-L26 HydrophobicContact CE1-CD2 4.2Å; G24-L26 PolarHBondContact O-N 2.83Å; G24-L26 VanDerWaalsContact O-N 3.09Å
27	K	74	Confident	79.9	Confident	190 Å²	190	84.2 Å²	84.2	83%	0.826	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-71.7	-31.5	178.9	-62.7	179.2	179.6	175.1	0	112.6	D25 K29	D25-K27 PolarHBondContact O-N 3.36Å; D25-K27 VanDerWaalsContact O-N 3.08Å; D25-K27 VanDerWaalsContact OD1-CB 3.26Å; D25-K27 WeakPolarHBondContact OD1-CB 3.44Å; D25-K27 PolarHBondContact OD1-N 2.85Å; K27-K29 PolarHBondContact O-N 2.75Å
28	T	67.7	Low	80.2	Confident	73 Å²	73	82 Å²	82	45%	0.448	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-71.4	-16.5	-177.2	61.1	0	0	0	0	112.9	D25 T30	D25-T28 HydrophobicContact CB-CG2 4.08Å; D25-T28 PolarHBondContact O-N 2.97Å; D25-T28 VanDerWaalsContact O-N 3.12Å; D25-T28 PolarHBondContact O-OG1 2.91Å; D25-T28 WeakPolarHBondContact OD2-CG2 3.45Å; T28-T30 WeakPolarHBondContact CB-OG1 3.14Å; T28-T30 PolarHBondContact O-N 2.88Å; T28-T30 PolarHBondContact OG1-OG1 2.89Å; T28-T30 VanDerWaalsContact OG1-OG1 3.06Å
29	K	61.9	Low	80.4	Confident	161 Å²	161	81.2 Å²	81.2	70%	0.7	39%	0.394	S	S	*	.			trans	53.2	12.6	-173.1	-62.4	-170.4	175.6	-169.6	0	114.3	K27	K27-K29 PolarHBondContact O-N 2.75Å
30	T	67.2	Low	80.5	Confident	95 Å²	95	77.9 Å²	77.9	58%	0.583	38%	0.377	S	S	*	.			trans	-103.1	108.7	176.7	51.3	0	0	0	0	108.9	Y22 T28	Y22-T30 PolarHBondContact OH-O 3.26Å; T28-T30 WeakPolarHBondContact CB-OG1 3.14Å; T28-T30 PolarHBondContact O-N 2.88Å; T28-T30 PolarHBondContact OG1-OG1 2.89Å; T28-T30 VanDerWaalsContact OG1-OG1 3.06Å
31	Y	73.4	Confident	80.6	Confident	78 Å²	78	73.7 Å²	73.7	31%	0.306	36%	0.358	S	S	.	.			trans	-67	134	172.8	168.5	-92.7	0	0	0	110.6	Y22 K33 E36	Y22-Y31 HydrophobicContact CD2-CD2 4.14Å; Y22-Y31 HydrophobicContact CD2-CE2 4.16Å; Y22-Y31 AromaticContact CE2-CD2 3.77Å; Y22-Y31 HydrophobicContact CE2-CD2 3.77Å; Y22-Y31 HydrophobicContact CE2-CE2 4.11Å; Y31-K33 HydrophobicContact CE1-CB 4.35Å; Y31-E36 HydrophobicContact CE2-CG 4.1Å; Y31-E36 WeakPolarHBondContact CE2-OE1 3.39Å; Y31-E36 VanDerWaalsContact CZ-OE1 3.26Å; Y31-E36 PolarHBondContact OH-OE1 3.24Å; Y31-E36 PolarHBondContact OH-OE2 2.92Å
32	D	77.3	Confident	80.8	Confident	32 Å²	32	74.2 Å²	74.2	17%	0.171	36%	0.357	C	S	.	.			trans	-132.2	115.6	176.4	-171	-20	0	0	0	108.8	Y22 R34 D35 R69	Y22-D32 WeakPolarHBondContact CE2-O 3.48Å; Y22-D32 PolarHBondContact OH-N 3.45Å; D32-R34 PolarHBondContact O-N 3.44Å; D32-R34 WeakPolarHBondContact OD1-CB 3.5Å; D32-R34 WeakPolarHBondContact OD1-CG 3.41Å; D32-R34 IonicContact OD1-CZ 3.2Å; D32-R34 PolarHBondContact OD1-N 2.97Å; D32-R34 VanDerWaalsContact OD1-N 3.07Å; D32-R34 IonicContact OD1-NE 2.71Å; D32-R34 PolarHBondContact OD1-NE 2.94Å; D32-R34 IonicContact OD1-NH2 3.37Å; D32-R34 IonicContact OD2-CZ 3.28Å; D32-R34 IonicContact OD2-NE 2.93Å; D32-R34 PolarHBondContact OD2-NE 3.41Å; D32-R34 IonicContact OD2-NH2 3.8Å; D32-R34 PolarHBondContact OD2-NH2 2.88Å; D32-D35 PolarHBondContact O-N 2.74Å; D32-R69 IonicContact OD2-CZ 3.63Å; D32-R69 IonicContact OD2-NH1 3.25Å; D32-R69 PolarHBondContact OD2-NH1 3.2Å; D32-R69 IonicContact OD2-NH2 2.71Å; D32-R69 PolarHBondContact OD2-NH2 2.71Å
33	K	77.4	Confident	80.8	Confident	155 Å²	155	72 Å²	72	67%	0.674	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-55.2	-25.2	-179.6	-174	176	-179.3	178.8	0	113	Y31 D35 E36	Y31-K33 HydrophobicContact CE1-CB 4.35Å; K33-D35 PolarHBondContact O-N 2.71Å; K33-E36 WeakPolarHBondContact O-CB 3.34Å; K33-E36 PolarHBondContact O-N 2.79Å
34	R	81.9	Confident	80.6	Confident	189 Å²	189	73.4 Å²	73.4	71%	0.713	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-69.6	-17.4	177.7	-62.9	175.5	-67.7	-177.7	-0	113.5	D32	D32-R34 PolarHBondContact O-N 3.44Å; D32-R34 WeakPolarHBondContact OD1-CB 3.5Å; D32-R34 WeakPolarHBondContact OD1-CG 3.41Å; D32-R34 IonicContact OD1-CZ 3.2Å; D32-R34 PolarHBondContact OD1-N 2.97Å; D32-R34 VanDerWaalsContact OD1-N 3.07Å; D32-R34 IonicContact OD1-NE 2.71Å; D32-R34 PolarHBondContact OD1-NE 2.94Å; D32-R34 IonicContact OD1-NH2 3.37Å; D32-R34 IonicContact OD2-CZ 3.28Å; D32-R34 IonicContact OD2-NE 2.93Å; D32-R34 PolarHBondContact OD2-NE 3.41Å; D32-R34 IonicContact OD2-NH2 3.8Å; D32-R34 PolarHBondContact OD2-NH2 2.88Å
35	D	85.3	Confident	80.6	Confident	4 Å²	4	74.9 Å²	74.9	2%	0.021	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-92.1	-1	176.4	-60.7	-33.9	0	0	0	112.4	Y22 L23 G24 D32 K33 R69	Y22-D35 HydrophobicContact CD2-CB 4.14Å; Y22-D35 HydrophobicContact CE2-CB 3.68Å; L23-D35 PolarHBondContact N-O 2.92Å; G24-D35 VanDerWaalsContact CA-OD2 3.3Å; G24-D35 WeakPolarHBondContact CA-OD2 3.15Å; D32-D35 PolarHBondContact O-N 2.74Å; K33-D35 PolarHBondContact O-N 2.71Å; D35-R69 VanDerWaalsContact CG-NH2 3.34Å; D35-R69 WeakPolarHBondContact OD1-CB 3.26Å; D35-R69 IonicContact OD1-CZ 3.38Å; D35-R69 IonicContact OD1-NE 2.92Å; D35-R69 PolarHBondContact OD1-NE 3.33Å; D35-R69 IonicContact OD1-NH2 2.88Å; D35-R69 PolarHBondContact OD1-NH2 3.21Å; D35-R69 IonicContact OD2-CZ 2.89Å; D35-R69 IonicContact OD2-NE 3.77Å; D35-R69 IonicContact OD2-NH2 3.42Å; D35-R69 PolarHBondContact OD2-NH2 3Å
36	E	86.4	Confident	80.4	Confident	65 Å²	65	75.1 Å²	75.1	30%	0.304	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.8	169	-65	-173.4	153.9	0	0	110.5	Y22 Y31 K33	Y22-E36 HydrophobicContact CD2-CG 4.06Å; Y31-E36 HydrophobicContact CE2-CG 4.1Å; Y31-E36 WeakPolarHBondContact CE2-OE1 3.39Å; Y31-E36 VanDerWaalsContact CZ-OE1 3.26Å; Y31-E36 PolarHBondContact OH-OE1 3.24Å; Y31-E36 PolarHBondContact OH-OE2 2.92Å; K33-E36 WeakPolarHBondContact O-CB 3.34Å; K33-E36 PolarHBondContact O-N 2.79Å
37	I	88	Confident	80.4	Confident	36 Å²	36	73.3 Å²	73.3	19%	0.185	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.8	-179.5	-68.1	165.1	0	0	0	108.8	M20 A21 L23 L39 I66	M20-I37 CarbonylContact C-O 3.44Å; M20-I37 VanDerWaalsContact CA-O 3.26Å; M20-I37 WeakPolarHBondContact CA-O 3.27Å; A21-I37 PolarHBondContact N-O 2.98Å; A21-I37 PolarHBondContact O-N 2.97Å; L23-I37 HydrophobicContact CB-CD1 4.4Å; L23-I37 HydrophobicContact CD1-CD1 3.51Å; L23-I37 HydrophobicContact CG-CD1 4.19Å; I37-L39 PolarHBondContact O-N 2.93Å; I37-I66 HydrophobicContact CG2-CG2 4.26Å
38	V	89.7	Confident	80.2	Confident	72 Å²	72	67.9 Å²	67.9	44%	0.436	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	119.8	171.8	-178.5	0	0	0	0	108.1	C18 M20	C18-V38 HydrophobicContact CB-CG1 4.31Å; M20-V38 HydrophobicContact CG-CG2 4.08Å; M20-V38 HydrophobicContact SD-CG2 4.32Å
39	L	91.1	Very high	80.7	Confident	34 Å²	34	72.4 Å²	72.4	18%	0.178	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-52.9	174.3	-63.9	-173.9	0	0	0	110.4	I19 A21 I37 P54 I66 Y75	I19-L39 PolarHBondContact O-N 2.74Å; A21-L39 HydrophobicContact CB-CD1 3.76Å; A21-L39 HydrophobicContact CB-CD2 3.98Å; A21-L39 HydrophobicContact CB-CG 3.81Å; I37-L39 PolarHBondContact O-N 2.93Å; L39-P54 WeakPolarHBondContact O-CD 3.41Å; L39-I66 HydrophobicContact CD2-CD1 3.42Å; L39-I66 VanDerWaalsContact CD2-CD1 3.42Å; L39-Y75 HydrophobicContact CB-CD2 4.27Å; L39-Y75 HydrophobicContact CB-CE2 3.96Å; L39-Y75 HydrophobicContact CD2-CD1 4.28Å; L39-Y75 HydrophobicContact CD2-CD2 4.15Å; L39-Y75 HydrophobicContact CD2-CE1 4.4Å; L39-Y75 HydrophobicContact CD2-CE2 4.26Å; L39-Y75 HydrophobicContact CD2-CG 4.15Å; L39-Y75 PolarHBondContact O-OH 3.21Å
40	C	90.7	Very high	81.8	Confident	6 Å²	6	70.1 Å²	70.1	4%	0.041	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	162.8	174.1	79	0	0	0	0	112.2	I19 V52 T53 V77	I19-C40 PolarHBondContact N-O 3.17Å; I19-C40 PolarHBondContact O-N 3.27Å; C40-V52 HydrophobicContact CB-CG1 4.43Å; C40-T53 CarbonylContact C-O 3.6Å; C40-T53 VanDerWaalsContact CA-O 3.27Å; C40-T53 WeakPolarHBondContact CA-O 3.33Å; C40-V77 HydrophobicContact CB-CG1 4.44Å; C40-V77 HydrophobicContact CB-CG2 4.25Å
41	T	90.7	Very high	82.7	Confident	19 Å²	19	71.9 Å²	71.9	12%	0.117	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.6	-177.6	-57.1	0	0	0	0	108.5	K16 M17 E43 V52 T53	K16-T41 HydrophobicContact CD-CG2 4.23Å; K16-T41 HydrophobicContact CG-CG2 4.02Å; M17-T41 CarbonylContact O-C 3.48Å; T41-E43 HydrophobicContact CG2-CG 4.03Å; T41-V52 CarbonylContact O-C 3.48Å; T41-V52 VanDerWaalsContact O-CA 3.3Å; T41-V52 WeakPolarHBondContact O-CA 3.49Å; T41-T53 PolarHBondContact N-O 2.76Å; T41-T53 PolarHBondContact O-N 3.09Å
42	L	89.3	Confident	83.4	Confident	37 Å²	37	68.9 Å²	68.9	19%	0.194	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121	175.5	-65.9	154.9	0	0	0	107.9	K16 M17 I19 L50 R51 V52	K16-L42 CarbonylContact C-O 3.54Å; K16-L42 WeakPolarHBondContact CA-O 3.3Å; M17-L42 HydrophobicContact CB-CB 4.22Å; M17-L42 HydrophobicContact CG-CD1 4.4Å; M17-L42 PolarHBondContact N-O 2.9Å; M17-L42 PolarHBondContact O-N 2.75Å; M17-L42 HydrophobicContact SD-CD1 4.13Å; I19-L42 HydrophobicContact CD1-CD1 4.07Å; I19-L42 HydrophobicContact CG1-CD1 4.2Å; L42-L50 HydrophobicContact CB-CD1 4.4Å; L42-L50 HydrophobicContact CD2-CD1 4.22Å; L42-L50 HydrophobicContact CD2-CD2 4.47Å; L42-R51 CarbonylContact C-O 3.56Å; L42-R51 WeakPolarHBondContact CA-O 3.26Å; L42-V52 HydrophobicContact CD2-CB 4.35Å; L42-V52 HydrophobicContact CD2-CG1 4.02Å; L42-V52 HydrophobicContact CD2-CG2 3.65Å
43	E	86.2	Confident	84.1	Confident	21 Å²	21	70.7 Å²	70.7	10%	0.098	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	114.1	177.8	-73.4	173	167.7	0	0	109.4	V14 Q15 K16 T41 R51	V14-E43 HydrophobicContact CG1-CB 4.29Å; V14-E43 HydrophobicContact CG1-CG 4.4Å; Q15-E43 CarbonylContact O-C 3.53Å; Q15-E43 WeakPolarHBondContact O-CA 3.32Å; K16-E43 HydrophobicContact CB-CG 4.28Å; K16-E43 HydrophobicContact CD-CG 4.28Å; K16-E43 HydrophobicContact CG-CG 3.94Å; K16-E43 IonicContact NZ-OE1 3.88Å; K16-E43 PolarHBondContact NZ-OE1 2.8Å; T41-E43 HydrophobicContact CG2-CG 4.03Å; E43-R51 HydrophobicContact CB-CB 4.33Å; E43-R51 PolarHBondContact N-O 3.32Å; E43-R51 PolarHBondContact O-N 2.89Å; E43-R51 IonicContact OE2-CZ 2.93Å; E43-R51 IonicContact OE2-NE 2.61Å; E43-R51 PolarHBondContact OE2-NE 3.12Å; E43-R51 IonicContact OE2-NH2 3.13Å; E43-R51 PolarHBondContact OE2-NH2 3.08Å
44	L	81.7	Confident	84.6	Confident	51 Å²	51	65.1 Å²	65.1	27%	0.267	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	110.1	171.2	-177.7	68.7	0	0	0	108.5	V14 Q15 Y49	V14-L44 WeakPolarHBondContact CA-O 3.36Å; Q15-L44 HydrophobicContact CB-CB 4.28Å; Q15-L44 PolarHBondContact N-O 2.95Å; Q15-L44 PolarHBondContact O-N 2.78Å; L44-Y49 CarbonylContact C-O 3.53Å; L44-Y49 WeakPolarHBondContact CA-O 3.29Å
45	I	81.3	Confident	84.9	Confident	40 Å²	40	61 Å²	61	21%	0.205	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.3	-177.5	-54.8	170.9	0	0	0	109	V14 D47 C48 Y49	V14-I45 HydrophobicContact CG1-CG1 4.46Å; V14-I45 HydrophobicContact CG2-CG1 4.38Å; V14-I45 HydrophobicContact CG2-CG2 4.46Å; I45-D47 PolarHBondContact O-N 3.41Å; I45-D47 VanDerWaalsContact O-N 3.12Å; I45-C48 PolarHBondContact O-N 2.81Å; I45-Y49 PolarHBondContact N-O 2.61Å; I45-Y49 PolarHBondContact O-N 2.71Å
46	D	77.1	Confident	85.2	Confident	78 Å²	78	64.3 Å²	64.3	42%	0.417	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	32.4	178.5	-59.2	-38	0	0	0	113	S12 S13 C48	S12-D46 WeakPolarHBondContact CA-OD1 3.08Å; S12-D46 WeakPolarHBondContact CB-OD1 3.48Å; S13-D46 PolarHBondContact N-OD1 2.84Å; S13-D46 VanDerWaalsContact N-OD1 3.09Å; S13-D46 PolarHBondContact O-N 2.79Å; D46-C48 PolarHBondContact O-N 3.23Å; D46-C48 PolarHBondContact O-SG 2.82Å
47	D	69.2	Low	85.2	Confident	104 Å²	104	61.5 Å²	61.5	56%	0.556	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	15.8	-174.4	-55.8	-39.8	0	0	0	114.7	I45	I45-D47 PolarHBondContact O-N 3.41Å; I45-D47 VanDerWaalsContact O-N 3.12Å
48	C	71.1	Confident	84.8	Confident	75 Å²	75	62.8 Å²	62.8	51%	0.507	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-32.7	-171.3	-69.6	0	0	0	0	113.7	I45 D46	I45-C48 PolarHBondContact O-N 2.81Å; D46-C48 PolarHBondContact O-N 3.23Å; D46-C48 PolarHBondContact O-SG 2.82Å
49	Y	78.8	Confident	84.3	Confident	168 Å²	168	68.1 Å²	68.1	66%	0.659	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	117.6	-175.4	-61.4	-84.9	0	0	0	110.1	L44 I45	L44-Y49 CarbonylContact C-O 3.53Å; L44-Y49 WeakPolarHBondContact CA-O 3.29Å; I45-Y49 PolarHBondContact N-O 2.61Å; I45-Y49 PolarHBondContact O-N 2.71Å
50	L	83.6	Confident	83.7	Confident	114 Å²	114	69.2 Å²	69.2	60%	0.597	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.2	168.5	-175.1	66.7	0	0	0	108.8	L42 V52	L42-L50 HydrophobicContact CB-CD1 4.4Å; L42-L50 HydrophobicContact CD2-CD1 4.22Å; L42-L50 HydrophobicContact CD2-CD2 4.47Å; L50-V52 HydrophobicContact CG-CG2 4.49Å
51	R	86	Confident	83.2	Confident	131 Å²	131	78.6 Å²	78.6	49%	0.494	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.4	172.6	174.7	167.2	72.6	-175.8	4.7	109.2	L42 E43	L42-R51 CarbonylContact C-O 3.56Å; L42-R51 WeakPolarHBondContact CA-O 3.26Å; E43-R51 HydrophobicContact CB-CB 4.33Å; E43-R51 PolarHBondContact N-O 3.32Å; E43-R51 PolarHBondContact O-N 2.89Å; E43-R51 IonicContact OE2-CZ 2.93Å; E43-R51 IonicContact OE2-NE 2.61Å; E43-R51 PolarHBondContact OE2-NE 3.12Å; E43-R51 IonicContact OE2-NH2 3.13Å; E43-R51 PolarHBondContact OE2-NH2 3.08Å
52	V	89.5	Confident	83	Confident	16 Å²	16	85.4 Å²	85.4	10%	0.097	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.8	173.9	-163.9	0	0	0	0	109	C40 T41 L42 L50 P54 F56 V77	C40-V52 HydrophobicContact CB-CG1 4.43Å; T41-V52 CarbonylContact O-C 3.48Å; T41-V52 VanDerWaalsContact O-CA 3.3Å; T41-V52 WeakPolarHBondContact O-CA 3.49Å; L42-V52 HydrophobicContact CD2-CB 4.35Å; L42-V52 HydrophobicContact CD2-CG1 4.02Å; L42-V52 HydrophobicContact CD2-CG2 3.65Å; L50-V52 HydrophobicContact CG-CG2 4.49Å; V52-P54 CarbonylContact C-O 3.51Å; V52-F56 HydrophobicContact CB-CE2 4.36Å; V52-F56 HydrophobicContact CB-CZ 4.24Å; V52-F56 HydrophobicContact CG1-CE1 4.42Å; V52-F56 HydrophobicContact CG1-CZ 4.41Å; V52-F56 HydrophobicContact CG2-CE1 4.32Å; V52-F56 HydrophobicContact CG2-CE2 3.81Å; V52-F56 HydrophobicContact CG2-CZ 3.54Å; V52-V77 HydrophobicContact CG1-CG1 4.35Å
53	T	90.2	Very high	83	Confident	70 Å²	70	86.3 Å²	86.3	43%	0.429	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	118.3	-178.9	-54.1	0	0	0	0	111.2	C40 T41	C40-T53 CarbonylContact C-O 3.6Å; C40-T53 VanDerWaalsContact CA-O 3.27Å; C40-T53 WeakPolarHBondContact CA-O 3.33Å; T41-T53 PolarHBondContact N-O 2.76Å; T41-T53 PolarHBondContact O-N 3.09Å
54	P	89.6	Confident	83.2	Confident	37 Å²	37	88.5 Å²	88.5	24%	0.24	45%	0.447	C	S	.	.	S	Bend	cis	-64.8	163	-5.2	32.4	-33.5	0	0	0	111.3	L39 V52 Y64 Y75	L39-P54 WeakPolarHBondContact O-CD 3.41Å; V52-P54 CarbonylContact C-O 3.51Å; P54-Y64 HydrophobicContact CB-CD2 4.45Å; P54-Y64 HydrophobicContact CB-CE1 4.13Å; P54-Y64 HydrophobicContact CB-CE2 3.81Å; P54-Y64 HydrophobicContact CG-CD2 3.96Å; P54-Y64 HydrophobicContact CG-CE2 3.71Å; P54-Y64 HydrophobicContact CG-CG 4.49Å; P54-Y75 WeakPolarHBondContact CG-OH 3.44Å
55	D	88.2	Confident	83.7	Confident	102 Å²	102	89.3 Å²	89.3	55%	0.545	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-68.9	173.4	-176.4	-152.5	-7.4	0	0	0	111.5	Y64	D55-Y64 WeakPolarHBondContact O-CE2 3.3Å; D55-Y64 PolarHBondContact O-OH 3.25Å
56	F	89.8	Confident	84.1	Confident	74 Å²	74	88.3 Å²	88.3	33%	0.325	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-64.4	137.2	174.7	-54.3	-73.3	0	0	0	110.9	V52 V77 Q78 D79	V52-F56 HydrophobicContact CB-CE2 4.36Å; V52-F56 HydrophobicContact CB-CZ 4.24Å; V52-F56 HydrophobicContact CG1-CE1 4.42Å; V52-F56 HydrophobicContact CG1-CZ 4.41Å; V52-F56 HydrophobicContact CG2-CE1 4.32Å; V52-F56 HydrophobicContact CG2-CE2 3.81Å; V52-F56 HydrophobicContact CG2-CZ 3.54Å; F56-V77 CarbonylContact C-O 3.52Å; F56-V77 VanDerWaalsContact CA-O 3.29Å; F56-V77 WeakPolarHBondContact CA-O 3.2Å; F56-V77 HydrophobicContact CD1-CG1 3.82Å; F56-V77 HydrophobicContact CE1-CG1 4.18Å; F56-Q78 VanDerWaalsContact CD1-C 3.46Å; F56-D79 HydrophobicContact CD1-CB 3.92Å; F56-D79 HydrophobicContact CD2-CB 4.35Å; F56-D79 HydrophobicContact CE1-CB 3.66Å; F56-D79 HydrophobicContact CE2-CB 4.11Å; F56-D79 HydrophobicContact CG-CB 4.24Å; F56-D79 HydrophobicContact CZ-CB 3.75Å
57	N	87.2	Confident	84.5	Confident	7 Å²	7	92.8 Å²	92.8	4%	0.037	46%	0.458	C	S	.	.			trans	-135.7	17.4	-178.2	78.8	-37.3	0	0	0	113.4	Q59 A60 E62 Y64 T76 V77	N57-Q59 PolarHBondContact O-N 3.34Å; N57-A60 HydrophobicContact CB-CB 4.05Å; N57-A60 WeakPolarHBondContact O-CB 3.44Å; N57-A60 PolarHBondContact O-N 2.88Å; N57-E62 PolarHBondContact ND2-O 2.71Å; N57-Y64 HydrophobicContact CB-CD2 4.34Å; N57-Y64 HydrophobicContact CB-CE2 3.66Å; N57-Y64 WeakPolarHBondContact ND2-CD2 3.22Å; N57-Y64 PolarHBondContact ND2-N 2.88Å; N57-T76 WeakPolarHBondContact OD1-CA 3.48Å; N57-T76 WeakPolarHBondContact OD1-CB 3.37Å; N57-V77 PolarHBondContact N-O 3.37Å; N57-V77 PolarHBondContact OD1-N 3.22Å
58	D	79	Confident	85.2	Confident	63 Å²	63	88.5 Å²	88.5	34%	0.337	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.3	177.1	67.2	-41.3	0	0	0	113.4	V77 Q78	D58-V77 PolarHBondContact N-O 2.88Å; D58-Q78 HydrophobicContact CB-CB 3.77Å; D58-Q78 HydrophobicContact CB-CG 3.73Å; D58-Q78 WeakPolarHBondContact OD2-CG 3.39Å; D58-Q78 PolarHBondContact OD2-NE2 2.98Å
59	Q	79	Confident	85.6	Confident	183 Å²	183	92.3 Å²	92.3	86%	0.855	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-5.7	175.2	-60	-175.9	4.3	0	0	114.2	N57	N57-Q59 PolarHBondContact O-N 3.34Å
60	A	80.3	Confident	85.7	Confident	58 Å²	58	87.4 Å²	87.4	48%	0.479	43%	0.43	S	S	.	.	S	Bend	trans	-83.2	148.2	-180	0	0	0	0	0	111.1	N57 E62	N57-A60 HydrophobicContact CB-CB 4.05Å; N57-A60 WeakPolarHBondContact O-CB 3.44Å; N57-A60 PolarHBondContact O-N 2.88Å; A60-E62 VanDerWaalsContact C-N 3.27Å; A60-E62 PolarHBondContact O-N 3.06Å
61	E	80.3	Confident	85.8	Confident	202 Å²	202	83.5 Å²	83.5	94%	0.944	42%	0.417	S	S	*	.	S	Bend	trans	-67.6	-26.9	178.3	-70.7	-175.1	170.6	0	0	113
62	E	85	Confident	86	Confident	162 Å²	162	81.1 Å²	81.1	76%	0.757	42%	0.417	S	S	*	.	S	Bend	trans	-110.5	121.5	-175.7	-66.6	-169.7	163.4	0	0	112.3	N57 A60	N57-E62 PolarHBondContact ND2-O 2.71Å; A60-E62 VanDerWaalsContact C-N 3.27Å; A60-E62 PolarHBondContact O-N 3.06Å
63	P	89.8	Confident	86	Confident	56 Å²	56	84.7 Å²	84.7	36%	0.364	43%	0.43	S	S	.	.			trans	-70.2	154	171.4	29.3	-33.3	0	0	0	110.8	Y74 T76	P63-Y74 HydrophobicContact CB-CD1 4.44Å; P63-Y74 HydrophobicContact CG-CD1 3.73Å; P63-Y74 HydrophobicContact CG-CG 4.12Å; P63-T76 HydrophobicContact CB-CG2 3.95Å
64	Y	91.3	Very high	86.1	Confident	68 Å²	68	89.1 Å²	89.1	27%	0.267	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	139.6	173.5	-67.3	-53	0	0	0	110.5	P54 D55 N57 Y74 Y75 V77	P54-Y64 HydrophobicContact CB-CD2 4.45Å; P54-Y64 HydrophobicContact CB-CE1 4.13Å; P54-Y64 HydrophobicContact CB-CE2 3.81Å; P54-Y64 HydrophobicContact CG-CD2 3.96Å; P54-Y64 HydrophobicContact CG-CE2 3.71Å; P54-Y64 HydrophobicContact CG-CG 4.49Å; D55-Y64 WeakPolarHBondContact O-CE2 3.3Å; D55-Y64 PolarHBondContact O-OH 3.25Å; N57-Y64 HydrophobicContact CB-CD2 4.34Å; N57-Y64 HydrophobicContact CB-CE2 3.66Å; N57-Y64 WeakPolarHBondContact ND2-CD2 3.22Å; N57-Y64 PolarHBondContact ND2-N 2.88Å; Y64-Y74 CarbonylContact O-C 3.58Å; Y64-Y74 VanDerWaalsContact O-CA 3.27Å; Y64-Y74 WeakPolarHBondContact O-CA 3.38Å; Y64-Y75 VanDerWaalsContact CB-CZ 3.46Å; Y64-Y75 WeakPolarHBondContact CB-O 3.35Å; Y64-Y75 HydrophobicContact CD2-CE1 4.45Å; Y64-Y75 AromaticContact CD2-CE2 3.93Å; Y64-Y75 HydrophobicContact CD2-CE2 3.93Å; Y64-Y75 AromaticContact CD2-CZ 3.88Å; Y64-Y75 HydrophobicContact CG-CE1 4.17Å; Y64-Y75 HydrophobicContact CG-CE2 4.45Å; Y64-Y75 AromaticContact CG-CZ 3.97Å; Y64-Y75 PolarHBondContact N-O 2.54Å; Y64-Y75 WeakPolarHBondContact O-CD1 3.22Å; Y64-Y75 PolarHBondContact O-N 2.78Å; Y64-V77 HydrophobicContact CD2-CG2 4.16Å; Y64-V77 HydrophobicContact CE2-CG2 4.13Å
65	L	90.4	Very high	86.2	Confident	67 Å²	67	89.3 Å²	89.3	35%	0.351	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.6	179.7	180	65.2	0	0	0	110.2	Y67 T72 Y74	L65-Y67 HydrophobicContact CD2-CE1 4.21Å; L65-Y67 HydrophobicContact CD2-CE2 4.07Å; L65-Y67 WeakPolarHBondContact CD2-OH 3.41Å; L65-Y67 HydrophobicContact CG-CE2 4.12Å; L65-T72 HydrophobicContact CD1-CG2 3.83Å; L65-T72 HydrophobicContact CG-CG2 4.47Å; L65-Y74 HydrophobicContact CB-CD1 4.38Å; L65-Y74 HydrophobicContact CB-CE1 4.37Å; L65-Y74 HydrophobicContact CD1-CD1 3.88Å; L65-Y74 HydrophobicContact CD1-CE1 3.61Å; L65-Y74 HydrophobicContact CD1-CE2 4.44Å; L65-Y74 HydrophobicContact CD1-CG 4.46Å; L65-Y74 HydrophobicContact CG-CE1 4.43Å
66	I	90	Very high	86.3	Confident	19 Å²	19	88.6 Å²	88.6	10%	0.097	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.7	173.1	55	-177.5	0	0	0	110.8	L23 I37 L39 T72 Y73 Y75	L23-I66 HydrophobicContact CD1-CD1 3.48Å; L23-I66 VanDerWaalsContact CD1-CD1 3.48Å; L23-I66 HydrophobicContact CD1-CG1 3.96Å; I37-I66 HydrophobicContact CG2-CG2 4.26Å; L39-I66 HydrophobicContact CD2-CD1 3.42Å; L39-I66 VanDerWaalsContact CD2-CD1 3.42Å; I66-T72 WeakPolarHBondContact O-CA 3.37Å; I66-Y73 WeakPolarHBondContact CG1-O 3.47Å; I66-Y73 PolarHBondContact N-O 2.81Å; I66-Y73 PolarHBondContact O-N 2.76Å; I66-Y75 HydrophobicContact CB-CE1 4.44Å; I66-Y75 HydrophobicContact CD1-CD1 3.96Å; I66-Y75 HydrophobicContact CD1-CE1 4.37Å; I66-Y75 HydrophobicContact CG1-CD1 4.1Å; I66-Y75 HydrophobicContact CG1-CE1 4.43Å; I66-Y75 HydrophobicContact CG2-CD1 3.97Å; I66-Y75 HydrophobicContact CG2-CE1 3.41Å; I66-Y75 VanDerWaalsContact CG2-CE1 3.41Å
67	Y	86	Confident	86.3	Confident	172 Å²	172	85.9 Å²	85.9	68%	0.675	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	103.4	-179	-60.2	-89.7	0	0	0	108.6	L65 T72	L65-Y67 HydrophobicContact CD2-CE1 4.21Å; L65-Y67 HydrophobicContact CD2-CE2 4.07Å; L65-Y67 WeakPolarHBondContact CD2-OH 3.41Å; L65-Y67 HydrophobicContact CG-CE2 4.12Å; Y67-T72 HydrophobicContact CD1-CG2 3.18Å; Y67-T72 HydrophobicContact CE1-CG2 3.33Å; Y67-T72 HydrophobicContact CG-CG2 4.06Å
68	G	83.2	Confident	86.3	Confident	15 Å²	15	91 Å²	91	16%	0.155	45%	0.448	C	S	.	.			trans	-87.3	165.4	167.3	0	0	0	0	0	110.9	T70 G71	G68-T70 VanDerWaalsContact C-N 3.25Å; G68-T70 PolarHBondContact O-N 2.91Å; G68-G71 CarbonylContact C-O 3.56Å; G68-G71 WeakPolarHBondContact CA-O 3.3Å; G68-G71 PolarHBondContact N-O 2.82Å; G68-G71 PolarHBondContact O-N 3.03Å; G68-G71 VanDerWaalsContact O-O 3.09Å
69	R	80.6	Confident	86.7	Confident	154 Å²	154	92 Å²	92	58%	0.581	45%	0.454	S	S	*	.	S	Bend	trans	-68.2	-27.7	173.5	-174.9	169	56.4	159.1	-1.6	112.7	D32 D35	D32-R69 IonicContact OD2-CZ 3.63Å; D32-R69 IonicContact OD2-NH1 3.25Å; D32-R69 PolarHBondContact OD2-NH1 3.2Å; D32-R69 IonicContact OD2-NH2 2.71Å; D32-R69 PolarHBondContact OD2-NH2 2.71Å; D35-R69 VanDerWaalsContact CG-NH2 3.34Å; D35-R69 WeakPolarHBondContact OD1-CB 3.26Å; D35-R69 IonicContact OD1-CZ 3.38Å; D35-R69 IonicContact OD1-NE 2.92Å; D35-R69 PolarHBondContact OD1-NE 3.33Å; D35-R69 IonicContact OD1-NH2 2.88Å; D35-R69 PolarHBondContact OD1-NH2 3.21Å; D35-R69 IonicContact OD2-CZ 2.89Å; D35-R69 IonicContact OD2-NE 3.77Å; D35-R69 IonicContact OD2-NH2 3.42Å; D35-R69 PolarHBondContact OD2-NH2 3Å
70	T	80.3	Confident	86.8	Confident	65 Å²	65	89 Å²	89	40%	0.399	45%	0.448	S	S	.	.	S	Bend	trans	-83.3	-18.1	179	53	0	0	0	0	113.3	L23 D25 G68 Y73	L23-T70 WeakPolarHBondContact O-CG2 3.27Å; L23-T70 PolarHBondContact O-OG1 3.09Å; D25-T70 HydrophobicContact CB-CG2 4.26Å; G68-T70 VanDerWaalsContact C-N 3.25Å; G68-T70 PolarHBondContact O-N 2.91Å; T70-Y73 PolarHBondContact OG1-OH 2.8Å
71	G	85.8	Confident	86.7	Confident	32 Å²	32	89.9 Å²	89.9	33%	0.33	45%	0.45	S	S	.	.			trans	159.6	178.5	-176.6	0	0	0	0	0	112.9	G68 Y73	G68-G71 CarbonylContact C-O 3.56Å; G68-G71 WeakPolarHBondContact CA-O 3.3Å; G68-G71 PolarHBondContact N-O 2.82Å; G68-G71 PolarHBondContact O-N 3.03Å; G68-G71 VanDerWaalsContact O-O 3.09Å; G71-Y73 WeakPolarHBondContact O-CD2 3.39Å; G71-Y73 VanDerWaalsContact O-CE2 3.3Å; G71-Y73 WeakPolarHBondContact O-CE2 3.48Å
72	T	90.3	Very high	86.3	Confident	82 Å²	82	88.9 Å²	88.9	50%	0.503	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.2	172.5	16.1	0	0	0	0	110.8	L65 I66 Y67	L65-T72 HydrophobicContact CD1-CG2 3.83Å; L65-T72 HydrophobicContact CG-CG2 4.47Å; I66-T72 WeakPolarHBondContact O-CA 3.37Å; Y67-T72 HydrophobicContact CD1-CG2 3.18Å; Y67-T72 HydrophobicContact CE1-CG2 3.33Å; Y67-T72 HydrophobicContact CG-CG2 4.06Å
73	Y	90.5	Very high	85.4	Confident	90 Å²	90	87.2 Å²	87.2	35%	0.353	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.8	179.7	-58.7	-94.6	0	0	0	110.4	L23 I66 T70 G71	L23-Y73 HydrophobicContact CB-CD2 4.41Å; L23-Y73 HydrophobicContact CB-CE2 3.99Å; L23-Y73 HydrophobicContact CD1-CD2 3.54Å; L23-Y73 HydrophobicContact CD1-CE2 3.99Å; L23-Y73 HydrophobicContact CD1-CG 4.17Å; L23-Y73 HydrophobicContact CD2-CD1 4.47Å; L23-Y73 HydrophobicContact CD2-CD2 4.13Å; L23-Y73 HydrophobicContact CD2-CE2 4.2Å; L23-Y73 HydrophobicContact CD2-CG 4.26Å; L23-Y73 HydrophobicContact CG-CD2 4.23Å; L23-Y73 HydrophobicContact CG-CE2 4.28Å; I66-Y73 WeakPolarHBondContact CG1-O 3.47Å; I66-Y73 PolarHBondContact N-O 2.81Å; I66-Y73 PolarHBondContact O-N 2.76Å; T70-Y73 PolarHBondContact OG1-OH 2.8Å; G71-Y73 WeakPolarHBondContact O-CD2 3.39Å; G71-Y73 VanDerWaalsContact O-CE2 3.3Å; G71-Y73 WeakPolarHBondContact O-CE2 3.48Å
74	Y	91	Very high	83.8	Confident	164 Å²	164	91.5 Å²	91.5	64%	0.643	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.6	171.7	-62.9	-81.1	0	0	0	109.4	P63 Y64 L65	P63-Y74 HydrophobicContact CB-CD1 4.44Å; P63-Y74 HydrophobicContact CG-CD1 3.73Å; P63-Y74 HydrophobicContact CG-CG 4.12Å; Y64-Y74 CarbonylContact O-C 3.58Å; Y64-Y74 VanDerWaalsContact O-CA 3.27Å; Y64-Y74 WeakPolarHBondContact O-CA 3.38Å; L65-Y74 HydrophobicContact CB-CD1 4.38Å; L65-Y74 HydrophobicContact CB-CE1 4.37Å; L65-Y74 HydrophobicContact CD1-CD1 3.88Å; L65-Y74 HydrophobicContact CD1-CE1 3.61Å; L65-Y74 HydrophobicContact CD1-CE2 4.44Å; L65-Y74 HydrophobicContact CD1-CG 4.46Å; L65-Y74 HydrophobicContact CG-CE1 4.43Å
75	Y	91.6	Very high	81.9	Confident	40 Å²	40	96.6 Å²	96.6	16%	0.157	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	158.3	176.1	78.3	-75.2	0	0	0	111.8	L39 P54 Y64 I66 V77	L39-Y75 HydrophobicContact CB-CD2 4.27Å; L39-Y75 HydrophobicContact CB-CE2 3.96Å; L39-Y75 HydrophobicContact CD2-CD1 4.28Å; L39-Y75 HydrophobicContact CD2-CD2 4.15Å; L39-Y75 HydrophobicContact CD2-CE1 4.4Å; L39-Y75 HydrophobicContact CD2-CE2 4.26Å; L39-Y75 HydrophobicContact CD2-CG 4.15Å; L39-Y75 PolarHBondContact O-OH 3.21Å; P54-Y75 WeakPolarHBondContact CG-OH 3.44Å; Y64-Y75 VanDerWaalsContact CB-CZ 3.46Å; Y64-Y75 WeakPolarHBondContact CB-O 3.35Å; Y64-Y75 HydrophobicContact CD2-CE1 4.45Å; Y64-Y75 AromaticContact CD2-CE2 3.93Å; Y64-Y75 HydrophobicContact CD2-CE2 3.93Å; Y64-Y75 AromaticContact CD2-CZ 3.88Å; Y64-Y75 HydrophobicContact CG-CE1 4.17Å; Y64-Y75 HydrophobicContact CG-CE2 4.45Å; Y64-Y75 AromaticContact CG-CZ 3.97Å; Y64-Y75 PolarHBondContact N-O 2.54Å; Y64-Y75 WeakPolarHBondContact O-CD1 3.22Å; Y64-Y75 PolarHBondContact O-N 2.78Å; I66-Y75 HydrophobicContact CB-CE1 4.44Å; I66-Y75 HydrophobicContact CD1-CD1 3.96Å; I66-Y75 HydrophobicContact CD1-CE1 4.37Å; I66-Y75 HydrophobicContact CG1-CD1 4.1Å; I66-Y75 HydrophobicContact CG1-CE1 4.43Å; I66-Y75 HydrophobicContact CG2-CD1 3.97Å; I66-Y75 HydrophobicContact CG2-CE1 3.41Å; I66-Y75 VanDerWaalsContact CG2-CE1 3.41Å; Y75-V77 HydrophobicContact CD2-CG2 4.11Å; Y75-V77 HydrophobicContact CE2-CG2 3.69Å
76	T	90.7	Very high	79.8	Confident	88 Å²	88	101.1 Å²	101.1	54%	0.54	51%	0.508	S	S	.	.			trans	-126	151.1	175.3	54	0	0	0	0	110.1	N57 P63	N57-T76 WeakPolarHBondContact OD1-CA 3.48Å; N57-T76 WeakPolarHBondContact OD1-CB 3.37Å; P63-T76 HydrophobicContact CB-CG2 3.95Å
77	V	90.6	Very high	77.5	Confident	17 Å²	17	108.6 Å²	108.6	10%	0.103	54%	0.542	C	S	.	.			trans	-116.4	121	175.3	-172.8	0	0	0	0	106.8	C40 V52 F56 N57 D58 Y64 Y75	C40-V77 HydrophobicContact CB-CG1 4.44Å; C40-V77 HydrophobicContact CB-CG2 4.25Å; V52-V77 HydrophobicContact CG1-CG1 4.35Å; F56-V77 CarbonylContact C-O 3.52Å; F56-V77 VanDerWaalsContact CA-O 3.29Å; F56-V77 WeakPolarHBondContact CA-O 3.2Å; F56-V77 HydrophobicContact CD1-CG1 3.82Å; F56-V77 HydrophobicContact CE1-CG1 4.18Å; N57-V77 PolarHBondContact N-O 3.37Å; N57-V77 PolarHBondContact OD1-N 3.22Å; D58-V77 PolarHBondContact N-O 2.88Å; Y64-V77 HydrophobicContact CD2-CG2 4.16Å; Y64-V77 HydrophobicContact CE2-CG2 4.13Å; Y75-V77 HydrophobicContact CD2-CG2 4.11Å; Y75-V77 HydrophobicContact CE2-CG2 3.69Å
78	Q	87.7	Confident	75.1	Confident	113 Å²	113	107.1 Å²	107.1	53%	0.528	55%	0.546	S	S	.	.			trans	-124.2	138.2	-177.5	-177.5	164.9	34.8	0	0	110.4	F56 D58 V80	F56-Q78 VanDerWaalsContact CD1-C 3.46Å; D58-Q78 HydrophobicContact CB-CB 3.77Å; D58-Q78 HydrophobicContact CB-CG 3.73Å; D58-Q78 WeakPolarHBondContact OD2-CG 3.39Å; D58-Q78 PolarHBondContact OD2-NE2 2.98Å; Q78-V80 HydrophobicContact CG-CG1 4.01Å
79	D	85.8	Confident	73.1	Confident	86 Å²	86	113.8 Å²	113.8	46%	0.46	57%	0.573	S	S	.	*			trans	-82.2	118	165.2	-172.5	0.3	0	0	0	109	F56 S81	F56-D79 HydrophobicContact CD1-CB 3.92Å; F56-D79 HydrophobicContact CD2-CB 4.35Å; F56-D79 HydrophobicContact CE1-CB 3.66Å; F56-D79 HydrophobicContact CE2-CB 4.11Å; F56-D79 HydrophobicContact CG-CB 4.24Å; F56-D79 HydrophobicContact CZ-CB 3.75Å; D79-S81 VanDerWaalsContact CG-OG 3.28Å; D79-S81 WeakPolarHBondContact OD1-CB 3.11Å; D79-S81 PolarHBondContact OD1-N 3.01Å; D79-S81 PolarHBondContact OD1-OG 3.07Å; D79-S81 PolarHBondContact OD2-OG 3.25Å
80	V	82.5	Confident	71.2	Confident	120 Å²	120	111 Å²	111	73%	0.727	58%	0.577	S	S	*	*			trans	-110.6	16.2	178.1	-63.7	0	0	0	0	112.1	Q78	Q78-V80 HydrophobicContact CG-CG1 4.01Å
81	S	76.8	Confident	69.1	Low	75 Å²	75	117.8 Å²	117.8	52%	0.524	60%	0.601	S	S	.	*			trans	-62.9	140.9	176.9	60.8	0	0	0	0	111.5	D79 V83	D79-S81 VanDerWaalsContact CG-OG 3.28Å; D79-S81 WeakPolarHBondContact OD1-CB 3.11Å; D79-S81 PolarHBondContact OD1-N 3.01Å; D79-S81 PolarHBondContact OD1-OG 3.07Å; D79-S81 PolarHBondContact OD2-OG 3.25Å; S81-V83 PolarHBondContact O-N 2.86Å
82	E	72.1	Confident	66.5	Low	181 Å²	181	119.7 Å²	119.7	85%	0.846	62%	0.621	S	S	*	*			trans	-69	117.7	172.5	-65.9	-176.5	173.9	0	0	108.8	I84	E82-I84 PolarHBondContact O-N 2.86Å
83	V	67.1	Low	64.2	Low	127 Å²	127	121 Å²	121	77%	0.77	64%	0.641	S	S	*	*			trans	-68.6	102.1	172.1	-177.8	0	0	0	0	107.5	S81 E85	S81-V83 PolarHBondContact O-N 2.86Å; V83-E85 VanDerWaalsContact C-N 3.34Å; V83-E85 PolarHBondContact O-N 2.93Å
84	I	55.7	Low	61.8	Low	147 Å²	147	126.6 Å²	126.6	75%	0.754	67%	0.667	S	S	*	*			trans	-65.7	100	168.2	-56	172.6	0	0	0	106.2	E82 K86	E82-I84 PolarHBondContact O-N 2.86Å; I84-K86 PolarHBondContact O-N 3.23Å
85	E	50.6	Low	59.2	Low	175 Å²	175	121.9 Å²	121.9	82%	0.818	66%	0.661	S	S	*	*			trans	-55.7	111	173	-73.3	-173.7	165.1	0	0	108.3	V83 Q87	V83-E85 VanDerWaalsContact C-N 3.34Å; V83-E85 PolarHBondContact O-N 2.93Å; E85-Q87 PolarHBondContact O-N 2.81Å
86	K	47.9	Very low	56.6	Low	161 Å²	161	129.1 Å²	129.1	70%	0.7	69%	0.694	S	S	*	*			trans	-64.9	87.6	169.5	-74.3	-173.4	172.3	-167.5	0	108.4	I84 D88 E89	I84-K86 PolarHBondContact O-N 3.23Å; K86-D88 PolarHBondContact O-N 2.81Å; K86-E89 IonicContact NZ-OE1 3.67Å; K86-E89 PolarHBondContact NZ-OE1 2.97Å
87	Q	39.9	Very low	54.3	Low	177 Å²	177	130.1 Å²	130.1	83%	0.827	70%	0.699	S	S	*	*			trans	-61.4	119.9	163.5	-125.8	176.9	3.4	0	0	107.6	E85	E85-Q87 PolarHBondContact O-N 2.81Å
88	D	36.5	Very low	51.6	Low	141 Å²	141	135.1 Å²	135.1	75%	0.754	73%	0.725	S	S	*	*			trans	72.2	70.4	168.1	-59.2	-26.1	0	0	0	119.3	K86	K86-D88 PolarHBondContact O-N 2.81Å
89	E	40.6	Very low	49.6	Very low	154 Å²	154	135.8 Å²	135.8	72%	0.72	73%	0.732	S	S	*	*			trans	-104	55.1	147.8	-83.7	-173.7	-150.5	0	0	111.1	K86	K86-E89 IonicContact NZ-OE1 3.67Å; K86-E89 PolarHBondContact NZ-OE1 2.97Å
90	S	40.8	Very low	47.4	Very low	96 Å²	96	135.9 Å²	135.9	67%	0.671	74%	0.74	S	S	*	*			trans	-104	62	158.7	73.3	0	0	0	0	110.2
91	K	36.7	Very low	45.2	Very low	207 Å²	207	139.2 Å²	139.2	90%	0.9	74%	0.739	S	S	*	*	S	Bend	trans	-174.3	100.3	156.1	-101.7	155.7	-162	-175.8	0	111.3
92	G	31.3	Very low	43.6	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	74%	0.735	S	S	*	*			trans	98.2	98.3	144.5	0	0	0	0	0	115.5	K94	G92-K94 PolarHBondContact O-N 2.99Å
93	A	42.8	Very low	42.1	Very low	111 Å²	111	133.9 Å²	133.9	92%	0.917	72%	0.722	S	S	*	*	S	Bend	trans	-60	44.8	162.7	0	0	0	0	0	114.6
94	K	38.7	Very low	40.8	Very low	207 Å²	207	135 Å²	135	90%	0.9	72%	0.719	S	S	*	*			trans	-144.7	55.1	176.8	-73.2	-169.5	178.5	175.8	0	112.4	G92	G92-K94 PolarHBondContact O-N 2.99Å
95	A	37	Very low	40.1	Very low	64 Å²	64	134.7 Å²	134.7	53%	0.529	72%	0.718	S	S	.	*			trans	-143.3	109.5	145.2	0	0	0	0	0	102.7	V97	A95-V97 HydrophobicContact CB-CG2 4.07Å; A95-V97 PolarHBondContact O-N 3.12Å; A95-V97 VanDerWaalsContact O-N 3.09Å
96	K	37.5	Very low	39.6	Very low	193 Å²	193	136.7 Å²	136.7	84%	0.839	72%	0.718	S	S	*	*				10.4	58.1	72.5	-78.6	-170.8	175.9	-176.8	0	110.4	D98	K96-D98 VanDerWaalsContact C-N 3.31Å; K96-D98 PolarHBondContact O-N 3.15Å
97	V	42	Very low	39.4	Very low	108 Å²	108	135.1 Å²	135.1	66%	0.655	72%	0.717	S	S	*	*			trans	-58	106.2	170.9	174.5	0	0	0	0	104	A95 L99	A95-V97 HydrophobicContact CB-CG2 4.07Å; A95-V97 PolarHBondContact O-N 3.12Å; A95-V97 VanDerWaalsContact O-N 3.09Å; V97-L99 VanDerWaalsContact C-N 3.34Å; V97-L99 PolarHBondContact O-N 3.09Å
98	D	34.2	Very low	39.4	Very low	122 Å²	122	131.8 Å²	131.8	65%	0.652	71%	0.712	S	S	*	*			trans	-49.5	102	171.3	-89.2	-37.7	0	0	0	107.7	K96 S100 R101	K96-D98 VanDerWaalsContact C-N 3.31Å; K96-D98 PolarHBondContact O-N 3.15Å; D98-S100 PolarHBondContact O-N 2.93Å; D98-R101 PolarHBondContact O-N 2.78Å
99	L	45	Very low	39.7	Very low	128 Å²	128	131.7 Å²	131.7	67%	0.67	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-59.1	6.2	169.4	-92.2	115.4	0	0	0	112.4	V97 R101 S102	V97-L99 VanDerWaalsContact C-N 3.34Å; V97-L99 PolarHBondContact O-N 3.09Å; L99-R101 VanDerWaalsContact C-N 3.32Å; L99-S102 PolarHBondContact O-OG 3.42Å
100	S	39.8	Very low	40.2	Very low	88 Å²	88	132 Å²	132	62%	0.615	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-78.1	-13.7	170.8	55.3	0	0	0	0	113.4	D98	D98-S100 PolarHBondContact O-N 2.93Å
101	R	36.8	Very low	40.7	Very low	189 Å²	189	135.1 Å²	135.1	71%	0.713	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-92.2	-0.4	171.7	-59.1	-174.8	88	163.9	4.5	113.8	D98 L99 S103 E104	D98-R101 PolarHBondContact O-N 2.78Å; L99-R101 VanDerWaalsContact C-N 3.32Å; R101-S103 PolarHBondContact O-N 2.89Å; R101-E104 PolarHBondContact O-N 2.89Å
102	S	42.7	Very low	42	Very low	63 Å²	63	130.7 Å²	130.7	44%	0.441	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-73.1	-5.1	176	65.3	0	0	0	0	113.9	L99 E104 L105	L99-S102 PolarHBondContact O-OG 3.42Å; S102-E104 PolarHBondContact O-N 3.07Å; S102-L105 PolarHBondContact O-N 2.84Å
103	S	40.4	Very low	43.9	Very low	81 Å²	81	133 Å²	133	57%	0.566	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-63.4	-19	171.6	50.3	0	0	0	0	113.5	R101	R101-S103 PolarHBondContact O-N 2.89Å
104	E	39.4	Very low	45.4	Very low	151 Å²	151	130.1 Å²	130.1	71%	0.706	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-90.5	-20	178.9	-67.6	171.8	-175	0	0	113	R101 S102 R106	R101-E104 PolarHBondContact O-N 2.89Å; S102-E104 PolarHBondContact O-N 3.07Å; E104-R106 PolarHBondContact O-N 3.19Å
105	L	40.7	Very low	47.1	Very low	141 Å²	141	123.5 Å²	123.5	74%	0.738	65%	0.647	S	S	*	*			trans	-87.6	34.6	172.5	-71.1	170.2	0	0	0	111.5	S102 L107	S102-L105 PolarHBondContact O-N 2.84Å; L105-L107 PolarHBondContact O-N 3.28Å
106	R	41.7	Very low	49	Very low	216 Å²	216	128.5 Å²	128.5	82%	0.815	66%	0.659	S	S	*	*			trans	-62.6	94.5	160	-80.6	-178.9	151.5	175	-5.5	106.1	E104 S108	E104-R106 PolarHBondContact O-N 3.19Å; R106-S108 PolarHBondContact O-N 3.24Å
107	L	42.4	Very low	50.9	Low	129 Å²	129	120.6 Å²	120.6	68%	0.675	63%	0.633	S	S	*	*			trans	-36.8	105.6	168.2	-75.9	146	0	0	0	107.5	L105 Y109	L105-L107 PolarHBondContact O-N 3.28Å; L107-Y109 HydrophobicContact CB-CD2 3.74Å; L107-Y109 HydrophobicContact CB-CE2 3.47Å; L107-Y109 VanDerWaalsContact CB-CE2 3.47Å; L107-Y109 HydrophobicContact CD1-CE2 4.03Å; L107-Y109 HydrophobicContact CD2-CE2 4.39Å; L107-Y109 HydrophobicContact CG-CE2 4.16Å; L107-Y109 PolarHBondContact O-N 3.27Å
108	S	40	Very low	52.8	Low	106 Å²	106	117.2 Å²	117.2	74%	0.741	61%	0.613	S	S	*	*			trans	-71	72.9	175.2	174.4	0	0	0	0	106.8	R106 D110	R106-S108 PolarHBondContact O-N 3.24Å; S108-D110 PolarHBondContact O-N 3.47Å
109	Y	43.9	Very low	55.2	Low	140 Å²	140	114.5 Å²	114.5	55%	0.549	60%	0.599	S	S	.	*			trans	-68.6	115.7	162.8	-70.6	-69	0	0	0	106.3	L107 F111	L107-Y109 HydrophobicContact CB-CD2 3.74Å; L107-Y109 HydrophobicContact CB-CE2 3.47Å; L107-Y109 VanDerWaalsContact CB-CE2 3.47Å; L107-Y109 HydrophobicContact CD1-CE2 4.03Å; L107-Y109 HydrophobicContact CD2-CE2 4.39Å; L107-Y109 HydrophobicContact CG-CE2 4.16Å; L107-Y109 PolarHBondContact O-N 3.27Å; Y109-F111 AromaticContact CD1-CD2 3.9Å; Y109-F111 HydrophobicContact CD1-CD2 3.9Å; Y109-F111 HydrophobicContact CD1-CE2 4.31Å; Y109-F111 HydrophobicContact CG-CD2 4.38Å; Y109-F111 PolarHBondContact O-N 3.3Å; Y109-F111 VanDerWaalsContact O-N 3.08Å
110	D	50.5	Low	57.1	Low	160 Å²	160	110 Å²	110	86%	0.856	57%	0.573	S	S	*	*			trans	-63.9	0.3	164.5	-78.1	-23.8	0	0	0	112.1	S108 D112	S108-D110 PolarHBondContact O-N 3.47Å; D110-D112 PolarHBondContact O-N 3.08Å
111	F	50.7	Low	59.4	Low	161 Å²	161	107.2 Å²	107.2	71%	0.706	55%	0.551	S	S	*	*	S	Bend	trans	-70.5	119.1	173.7	-67.3	-74.2	0	0	0	109.9	Y109 I113	Y109-F111 AromaticContact CD1-CD2 3.9Å; Y109-F111 HydrophobicContact CD1-CD2 3.9Å; Y109-F111 HydrophobicContact CD1-CE2 4.31Å; Y109-F111 HydrophobicContact CG-CD2 4.38Å; Y109-F111 PolarHBondContact O-N 3.3Å; Y109-F111 VanDerWaalsContact O-N 3.08Å; F111-I113 VanDerWaalsContact C-N 3.32Å; F111-I113 HydrophobicContact CB-CG1 4.4Å; F111-I113 PolarHBondContact O-N 2.89Å
112	D	65.4	Low	61.8	Low	114 Å²	114	104.2 Å²	104.2	61%	0.61	54%	0.543	S	S	*	.			trans	-70.7	85	176.4	-175.3	3.9	0	0	0	110.6	D110 R120	D110-D112 PolarHBondContact O-N 3.08Å; D112-R120 PolarHBondContact O-NH1 2.87Å; D112-R120 VanDerWaalsContact O-NH1 3.15Å; D112-R120 IonicContact OD1-CZ 3.77Å; D112-R120 IonicContact OD1-NH1 3.03Å; D112-R120 PolarHBondContact OD1-NH1 2.82Å; D112-R120 IonicContact OD2-CZ 3.21Å; D112-R120 VanDerWaalsContact OD2-CZ 3.25Å; D112-R120 IonicContact OD2-NH1 3.25Å; D112-R120 PolarHBondContact OD2-NH1 3.46Å; D112-R120 IonicContact OD2-NH2 3Å; D112-R120 PolarHBondContact OD2-NH2 3.41Å
113	I	70.7	Confident	64.1	Low	122 Å²	122	102.6 Å²	102.6	63%	0.626	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-86.2	133.4	178.6	-60	167.1	0	0	0	108.8	F111	F111-I113 VanDerWaalsContact C-N 3.32Å; F111-I113 HydrophobicContact CB-CG1 4.4Å; F111-I113 PolarHBondContact O-N 2.89Å
114	P	73.6	Confident	66.4	Low	49 Å²	49	105.6 Å²	105.6	32%	0.318	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-62.1	149.1	175.3	26.6	-34.5	0	0	0	112	C118 R120	P114-C118 HydrophobicContact CB-CB 4.44Å; P114-R120 HydrophobicContact CB-CB 3.83Å; P114-R120 HydrophobicContact CG-CB 4.07Å
115	A	74.8	Confident	68.8	Low	69 Å²	69	99.9 Å²	99.9	57%	0.57	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-57.3	149.1	177.1	0	0	0	0	0	112.3	G117 C118	A115-G117 PolarHBondContact O-N 2.79Å; A115-C118 VanDerWaalsContact O-CB 3.24Å; A115-C118 WeakPolarHBondContact O-CB 3.3Å; A115-C118 PolarHBondContact O-N 2.86Å
116	E	76	Confident	71.3	Confident	168 Å²	168	98.8 Å²	98.8	79%	0.785	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	127.3	-178	-166.2	-175.2	-175.5	0	0	112.1	K191	E116-K191 PolarHBondContact O-NZ 3.43Å; E116-K191 VanDerWaalsContact O-NZ 3.12Å
117	G	78	Confident	73.7	Confident	27 Å²	27	89.2 Å²	89.2	28%	0.278	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	13	-174	0	0	0	0	0	114.2	A115 L190	A115-G117 PolarHBondContact O-N 2.79Å; G117-L190 WeakPolarHBondContact O-CA 2.95Å; G117-L190 WeakPolarHBondContact O-CB 3.39Å; G117-L190 WeakPolarHBondContact O-CG 3.11Å; G117-L190 PolarHBondContact O-N 3.09Å
118	C	82	Confident	76.1	Confident	37 Å²	37	87.8 Å²	87.8	25%	0.25	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142	170.7	-60	0	0	0	0	111	P114 A115 L188	P114-C118 HydrophobicContact CB-CB 4.44Å; A115-C118 VanDerWaalsContact O-CB 3.24Å; A115-C118 WeakPolarHBondContact O-CB 3.3Å; A115-C118 PolarHBondContact O-N 2.86Å; C118-L188 CarbonylContact C-O 3.56Å; C118-L188 VanDerWaalsContact CA-O 3.29Å; C118-L188 WeakPolarHBondContact CA-O 3.37Å
119	L	83.8	Confident	78.7	Confident	65 Å²	65	85 Å²	85	34%	0.34	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.9	166.7	169.8	69.1	0	0	0	108.1	I121 W150 M187 L188 L190 W202	L119-I121 HydrophobicContact CD2-CD1 4.46Å; L119-I121 HydrophobicContact CG-CG1 4.33Å; L119-W150 HydrophobicContact CD2-CH2 4.23Å; L119-M187 CarbonylContact O-C 3.49Å; L119-M187 WeakPolarHBondContact O-CA 3.4Å; L119-L188 HydrophobicContact CB-CB 4.19Å; L119-L188 HydrophobicContact CD2-CD2 4.23Å; L119-L188 PolarHBondContact N-O 3.36Å; L119-L188 PolarHBondContact O-N 3.11Å; L119-L190 HydrophobicContact CB-CD1 4.42Å; L119-L190 HydrophobicContact CB-CD2 4.25Å; L119-L190 HydrophobicContact CB-CG 4.39Å; L119-W202 HydrophobicContact CD2-CH2 4.39Å
120	R	86.5	Confident	81	Confident	35 Å²	35	78.6 Å²	78.6	13%	0.132	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.4	174.5	-174	179.8	-171.6	177.9	5.2	109.8	D112 P114 F122 E185 L186 M187	D112-R120 PolarHBondContact O-NH1 2.87Å; D112-R120 VanDerWaalsContact O-NH1 3.15Å; D112-R120 IonicContact OD1-CZ 3.77Å; D112-R120 IonicContact OD1-NH1 3.03Å; D112-R120 PolarHBondContact OD1-NH1 2.82Å; D112-R120 IonicContact OD2-CZ 3.21Å; D112-R120 VanDerWaalsContact OD2-CZ 3.25Å; D112-R120 IonicContact OD2-NH1 3.25Å; D112-R120 PolarHBondContact OD2-NH1 3.46Å; D112-R120 IonicContact OD2-NH2 3Å; D112-R120 PolarHBondContact OD2-NH2 3.41Å; P114-R120 HydrophobicContact CB-CB 3.83Å; P114-R120 HydrophobicContact CG-CB 4.07Å; R120-F122 HydrophobicContact CG-CD2 4.32Å; R120-F122 HydrophobicContact CG-CE2 3.96Å; R120-F122 HydrophobicContact CG-CZ 4.44Å; R120-F122 VanDerWaalsContact NE-CE2 3.29Å; R120-F122 VanDerWaalsContact NH2-CZ 3.32Å; R120-E185 IonicContact CZ-OE1 3.83Å; R120-E185 IonicContact NE-OE1 3.08Å; R120-E185 PolarHBondContact NE-OE1 2.9Å; R120-E185 IonicContact NH2-OE1 2.78Å; R120-E185 PolarHBondContact NH2-OE1 2.73Å; R120-L186 CarbonylContact C-O 3.6Å; R120-L186 WeakPolarHBondContact CA-O 3.46Å; R120-M187 HydrophobicContact CB-CG 4.33Å; R120-M187 HydrophobicContact CG-CG 4.1Å
121	I	87	Confident	83	Confident	29 Å²	29	73.9 Å²	73.9	15%	0.149	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123	177.2	-59.8	-174.4	0	0	0	108	L119 W150 E185 L186 W202	L119-I121 HydrophobicContact CD2-CD1 4.46Å; L119-I121 HydrophobicContact CG-CG1 4.33Å; I121-W150 HydrophobicContact CD1-CH2 3.48Å; I121-W150 VanDerWaalsContact CD1-CH2 3.48Å; I121-W150 HydrophobicContact CD1-CZ3 3.65Å; I121-W150 HydrophobicContact CG1-CH2 4.37Å; I121-W150 HydrophobicContact CG1-CZ3 4.15Å; I121-E185 WeakPolarHBondContact O-CA 3.47Å; I121-L186 HydrophobicContact CB-CB 4.37Å; I121-L186 PolarHBondContact N-O 2.63Å; I121-L186 PolarHBondContact O-N 3.32Å; I121-W202 HydrophobicContact CD1-CH2 3.78Å; I121-W202 HydrophobicContact CD1-CZ2 3.71Å
122	F	88	Confident	84.8	Confident	125 Å²	125	71.2 Å²	71.2	55%	0.548	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	119.4	164.3	-68.5	-82	0	0	0	108.5	R120 E185	R120-F122 HydrophobicContact CG-CD2 4.32Å; R120-F122 HydrophobicContact CG-CE2 3.96Å; R120-F122 HydrophobicContact CG-CZ 4.44Å; R120-F122 VanDerWaalsContact NE-CE2 3.29Å; R120-F122 VanDerWaalsContact NH2-CZ 3.32Å; F122-E185 HydrophobicContact CD1-CB 4.25Å; F122-E185 HydrophobicContact CD1-CG 3.75Å; F122-E185 HydrophobicContact CE1-CB 4.4Å; F122-E185 HydrophobicContact CE1-CG 3.61Å; F122-E185 HydrophobicContact CZ-CG 4.38Å
123	L	89.4	Confident	85.8	Confident	30 Å²	30	66.9 Å²	66.9	16%	0.157	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.7	173.2	-170	141.9	0	0	0	109.2	E183 F184 L228	L123-E183 WeakPolarHBondContact O-CA 3.49Å; L123-F184 HydrophobicContact CB-CB 4.34Å; L123-F184 HydrophobicContact CD2-CD2 3.96Å; L123-F184 PolarHBondContact N-O 2.89Å; L123-F184 PolarHBondContact O-N 2.84Å; L123-L228 HydrophobicContact CD1-CB 4.25Å; L123-L228 HydrophobicContact CD1-CD1 4.02Å; L123-L228 HydrophobicContact CD1-CD2 3.65Å; L123-L228 HydrophobicContact CD1-CG 4.17Å
124	L	89.8	Confident	86.3	Confident	143 Å²	143	66.8 Å²	66.8	75%	0.749	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.5	169.7	-58	175.5	0	0	0	106.6	L182 E183	L124-L182 WeakPolarHBondContact CA-O 3.46Å; L124-E183 HydrophobicContact CD2-CB 4.42Å; L124-E183 HydrophobicContact CD2-CG 3.91Å
125	G	90.2	Very high	86.7	Confident	31 Å²	31	68.4 Å²	68.4	32%	0.32	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	178.5	-177.3	0	0	0	0	0	112.3	P181 L182	G125-P181 CarbonylContact O-C 3.56Å; G125-P181 WeakPolarHBondContact O-CA 3.02Å; G125-L182 PolarHBondContact N-O 2.77Å; G125-L182 PolarHBondContact O-N 3.36Å
126	E	92.3	Very high	87.3	Confident	118 Å²	118	67.9 Å²	67.9	55%	0.551	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	133.7	179.8	-174.4	-178.6	162.9	0	0	109.9	E128 G179 M180	E126-E128 HydrophobicContact CG-CG 4.49Å; E126-E128 PolarHBondContact O-N 2.9Å; E126-G179 WeakPolarHBondContact OE1-CA 3.42Å; E126-M180 CarbonylContact C-O 3.41Å; E126-M180 WeakPolarHBondContact CA-O 3.48Å
127	I	93.4	Very high	88	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.077	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	95.7	164.8	-56.2	178.5	0	0	0	107	I140 Y142 T161 F178 G179 M180 L182	I127-I140 HydrophobicContact CD1-CG2 4.24Å; I127-I140 HydrophobicContact CG2-CD1 3.6Å; I127-Y142 HydrophobicContact CD1-CD1 3.69Å; I127-Y142 HydrophobicContact CD1-CE1 4.25Å; I127-Y142 HydrophobicContact CD1-CG 4.14Å; I127-T161 HydrophobicContact CD1-CG2 4.13Å; I127-F178 HydrophobicContact CG2-CD2 4.18Å; I127-G179 WeakPolarHBondContact O-CA 3.27Å; I127-G179 PolarHBondContact O-N 2.81Å; I127-M180 HydrophobicContact CB-CB 4.3Å; I127-M180 PolarHBondContact N-O 2.81Å; I127-M180 PolarHBondContact O-N 2.75Å; I127-L182 HydrophobicContact CD1-CD1 4.29Å; I127-L182 HydrophobicContact CD1-CD2 4.08Å; I127-L182 HydrophobicContact CD1-CG 4.44Å; I127-L182 HydrophobicContact CG1-CD1 3.8Å; I127-L182 HydrophobicContact CG1-CD2 4.25Å; I127-L182 HydrophobicContact CG1-CG 4.05Å
128	E	92.7	Very high	88.6	Confident	100 Å²	100	61.4 Å²	61.4	47%	0.467	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-62.8	-174.4	-66.3	-174.3	167.1	0	0	112.3	E126 F178 G179	E126-E128 HydrophobicContact CG-CG 4.49Å; E126-E128 PolarHBondContact O-N 2.9Å; E128-F178 PolarHBondContact O-N 3.12Å; E128-G179 PolarHBondContact O-N 2.84Å
129	S	93.3	Very high	88.9	Confident	46 Å²	46	60.2 Å²	60.2	32%	0.322	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	161.6	-170.1	64.7	0	0	0	0	114.5	A176	S129-A176 CarbonylContact C-O 3.58Å; S129-A176 WeakPolarHBondContact CA-O 3.35Å; S129-A176 VanDerWaalsContact CB-O 3.22Å; S129-A176 WeakPolarHBondContact CB-O 3.2Å
130	A	92.8	Very high	89.1	Confident	7 Å²	7	57.3 Å²	57.3	6%	0.058	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.3	169.6	0	0	0	0	0	109.4	F133 L138 V175 A176 F178	A130-F133 HydrophobicContact CB-CD2 3.78Å; A130-F133 HydrophobicContact CB-CE2 3.66Å; A130-L138 HydrophobicContact CB-CD1 4.09Å; A130-V175 WeakPolarHBondContact O-CA 3.41Å; A130-A176 PolarHBondContact N-O 2.91Å; A130-A176 PolarHBondContact O-N 3.33Å; A130-F178 HydrophobicContact CB-CE2 3.59Å; A130-F178 HydrophobicContact CB-CZ 4.01Å
131	V	91.6	Very high	89.1	Confident	61 Å²	61	59.9 Å²	59.9	37%	0.37	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.2	-170.5	-176.1	0	0	0	0	111	A172 M174 V175	V131-A172 WeakPolarHBondContact CG1-O 3.4Å; V131-M174 CarbonylContact C-O 3.55Å; V131-M174 WeakPolarHBondContact CA-O 3.49Å; V131-V175 HydrophobicContact CG1-CG2 4.28Å; V131-V175 HydrophobicContact CG2-CG1 4.16Å; V131-V175 HydrophobicContact CG2-CG2 4.15Å
132	N	89.6	Confident	89	Confident	104 Å²	104	60.2 Å²	60.2	56%	0.556	31%	0.31	S	S	*	.	S	Bend	trans	59	41.6	173.9	-62.9	-32.9	0	0	0	115.3	A172 G173 M174	N132-A172 PolarHBondContact ND2-O 3.35Å; N132-G173 WeakPolarHBondContact OD1-CA 3.14Å; N132-M174 PolarHBondContact N-O 2.72Å; N132-M174 PolarHBondContact OD1-N 2.68Å
133	F	86.8	Confident	88.9	Confident	24 Å²	24	55.6 Å²	55.6	11%	0.105	29%	0.293	C	S	.	.			trans	-84.4	150.7	165	-70.9	-84.4	0	0	0	111.2	A130 Y135 L138 V209 E221 I241	A130-F133 HydrophobicContact CB-CD2 3.78Å; A130-F133 HydrophobicContact CB-CE2 3.66Å; F133-Y135 PolarHBondContact O-N 2.66Å; F133-L138 HydrophobicContact CB-CD1 3.76Å; F133-L138 HydrophobicContact CB-CD2 4.35Å; F133-L138 HydrophobicContact CD2-CD1 4.01Å; F133-L138 HydrophobicContact CG-CD1 4.09Å; F133-V209 HydrophobicContact CD1-CG1 4.05Å; F133-V209 HydrophobicContact CD2-CG1 4.25Å; F133-V209 HydrophobicContact CE1-CB 3.96Å; F133-V209 HydrophobicContact CE1-CG1 3.89Å; F133-V209 HydrophobicContact CE1-CG2 4.15Å; F133-V209 HydrophobicContact CE2-CG1 4.12Å; F133-V209 HydrophobicContact CE2-CG2 4.22Å; F133-V209 HydrophobicContact CG-CG1 4.2Å; F133-V209 HydrophobicContact CZ-CB 3.99Å; F133-V209 HydrophobicContact CZ-CG1 3.93Å; F133-V209 HydrophobicContact CZ-CG2 3.67Å; F133-E221 HydrophobicContact CD1-CB 3.64Å; F133-E221 HydrophobicContact CD1-CG 4.45Å; F133-E221 HydrophobicContact CE1-CB 4.07Å; F133-I241 HydrophobicContact CE1-CG2 4.19Å; F133-I241 HydrophobicContact CZ-CB 4.13Å; F133-I241 HydrophobicContact CZ-CD1 4.28Å; F133-I241 HydrophobicContact CZ-CG2 4.22Å
134	E	80.4	Confident	88.7	Confident	119 Å²	119	54.3 Å²	54.3	56%	0.556	29%	0.286	S	S	*	.	S	Bend	trans	-65.3	-37.1	-172.4	-176	-177.2	151.6	0	0	112.5	H243	E134-H243 WeakPolarHBondContact CB-NE2 3.44Å; E134-H243 IonicContact OE2-CE1 3.7Å; E134-H243 PolarHBondContact OE2-CE1 3.15Å; E134-H243 VanDerWaalsContact OE2-CE1 3.28Å; E134-H243 IonicContact OE2-NE2 3.52Å
135	Y	82.5	Confident	88.4	Confident	83 Å²	83	49.1 Å²	49.1	33%	0.325	26%	0.258	S	S	.	.	S	Bend	trans	-108.5	158.6	-174.7	-64.6	-81.1	0	0	0	113.4	F133 L138 R219 E221	F133-Y135 PolarHBondContact O-N 2.66Å; Y135-L138 WeakPolarHBondContact O-CD2 3.35Å; Y135-R219 VanDerWaalsContact CE1-NH1 3.26Å; Y135-R219 PolarHBondContact OH-NH1 3.44Å; Y135-E221 WeakPolarHBondContact CD2-OE1 3.24Å
136	S	87.6	Confident	88.1	Confident	59 Å²	59	48.9 Å²	48.9	41%	0.413	25%	0.249	S	C	.	.	S	Bend	trans	-90.9	175.9	171.9	68	0	0	0	0	112.4	T166	S136-T166 WeakPolarHBondContact CA-OG1 3.41Å
137	N	89.2	Confident	87.5	Confident	57 Å²	57	43.9 Å²	43.9	31%	0.305	23%	0.227	S	C	.	.	S	Bend	trans	60	56.3	-179.3	-52.4	-32.4	0	0	0	110.8	L163 S164 M212	N137-L163 HydrophobicContact CB-CD2 4.39Å; N137-L163 WeakPolarHBondContact O-CD2 3.39Å; N137-S164 CarbonylContact C-O 3.56Å; N137-S164 WeakPolarHBondContact CA-O 3.42Å; N137-S164 PolarHBondContact N-O 2.85Å; N137-M212 VanDerWaalsContact CB-O 3.29Å; N137-M212 WeakPolarHBondContact CB-O 3.24Å; N137-M212 PolarHBondContact ND2-O 3.45Å; N137-M212 PolarHBondContact O-N 3.15Å
138	L	90.6	Very high	86.6	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	149.4	-179.9	-58.5	-179.6	0	0	0	109.9	A130 F133 Y135 L163 S164 A176 F178 V209 M210 E221	A130-L138 HydrophobicContact CB-CD1 4.09Å; F133-L138 HydrophobicContact CB-CD1 3.76Å; F133-L138 HydrophobicContact CB-CD2 4.35Å; F133-L138 HydrophobicContact CD2-CD1 4.01Å; F133-L138 HydrophobicContact CG-CD1 4.09Å; Y135-L138 WeakPolarHBondContact O-CD2 3.35Å; L138-L163 CarbonylContact O-C 3.46Å; L138-L163 WeakPolarHBondContact O-CA 3.31Å; L138-S164 PolarHBondContact N-O 2.82Å; L138-S164 PolarHBondContact O-N 2.79Å; L138-A176 HydrophobicContact CB-CB 4.15Å; L138-A176 HydrophobicContact CD1-CB 3.83Å; L138-A176 HydrophobicContact CG-CB 4.29Å; L138-F178 HydrophobicContact CB-CE1 4.28Å; L138-F178 HydrophobicContact CB-CZ 3.92Å; L138-F178 WeakPolarHBondContact O-CE1 3.35Å; L138-V209 HydrophobicContact CD1-CG1 4.43Å; L138-V209 HydrophobicContact CD2-CG1 4.36Å; L138-M210 CarbonylContact C-O 3.55Å; L138-M210 WeakPolarHBondContact CA-O 3.36Å; L138-E221 HydrophobicContact CD2-CG 4.06Å
139	F	88.4	Confident	85.9	Confident	12 Å²	12	47.4 Å²	47.4	5%	0.053	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155	163.8	68.1	-82	0	0	0	108.2	E141 V160 T161 L163 M210 M212 Y218	F139-E141 HydrophobicContact CD2-CG 4.29Å; F139-E141 HydrophobicContact CE2-CG 3.89Å; F139-V160 HydrophobicContact CD2-CG1 3.48Å; F139-V160 VanDerWaalsContact CD2-CG1 3.48Å; F139-V160 HydrophobicContact CE2-CG1 4.02Å; F139-V160 HydrophobicContact CG-CG1 4.48Å; F139-T161 WeakPolarHBondContact CA-OG1 3.4Å; F139-L163 HydrophobicContact CB-CD2 4.08Å; F139-L163 HydrophobicContact CB-CG 4.34Å; F139-L163 HydrophobicContact CD1-CD2 3.59Å; F139-L163 HydrophobicContact CD1-CG 4.48Å; F139-L163 HydrophobicContact CE1-CD2 4.47Å; F139-L163 HydrophobicContact CG-CD2 4.21Å; F139-M210 HydrophobicContact CD1-CB 3.77Å; F139-M210 HydrophobicContact CD2-CB 3.94Å; F139-M210 HydrophobicContact CD2-CG 4.39Å; F139-M210 HydrophobicContact CE1-CB 3.28Å; F139-M210 HydrophobicContact CE1-CG 4.34Å; F139-M210 HydrophobicContact CE2-CB 3.5Å; F139-M210 HydrophobicContact CE2-CG 3.74Å; F139-M210 HydrophobicContact CG-CB 4.09Å; F139-M210 HydrophobicContact CZ-CB 3.16Å; F139-M210 HydrophobicContact CZ-CE 4.42Å; F139-M210 HydrophobicContact CZ-CG 3.72Å; F139-M210 PolarHBondContact N-O 3.46Å; F139-M210 WeakPolarHBondContact O-CA 3.2Å; F139-M210 PolarHBondContact O-N 3.03Å; F139-M210 VanDerWaalsContact O-O 3.09Å; F139-M212 HydrophobicContact CE1-CB 4.39Å; F139-Y218 AromaticContact CE1-CD1 3.59Å; F139-Y218 HydrophobicContact CE1-CD1 3.59Å; F139-Y218 HydrophobicContact CE1-CE1 4.04Å; F139-Y218 AromaticContact CZ-CD1 3.5Å; F139-Y218 HydrophobicContact CZ-CD1 3.5Å; F139-Y218 AromaticContact CZ-CE1 3.98Å; F139-Y218 HydrophobicContact CZ-CE1 3.98Å
140	I	88.6	Confident	85.4	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.8	-175.5	-65.9	176.1	0	0	0	108.7	I127 V160 T161 F178 I207 A208 V209	I127-I140 HydrophobicContact CD1-CG2 4.24Å; I127-I140 HydrophobicContact CG2-CD1 3.6Å; I140-V160 CarbonylContact O-C 3.38Å; I140-V160 VanDerWaalsContact O-CA 3.31Å; I140-V160 WeakPolarHBondContact O-CA 3.47Å; I140-T161 HydrophobicContact CB-CG2 3.77Å; I140-T161 PolarHBondContact N-OG1 3.27Å; I140-T161 PolarHBondContact O-N 3.18Å; I140-F178 HydrophobicContact CD1-CD2 3.72Å; I140-F178 HydrophobicContact CD1-CE2 3.3Å; I140-F178 HydrophobicContact CD1-CG 4.49Å; I140-F178 HydrophobicContact CD1-CZ 3.77Å; I140-F178 HydrophobicContact CG1-CE1 4.37Å; I140-F178 HydrophobicContact CG1-CE2 3.93Å; I140-F178 HydrophobicContact CG1-CZ 3.85Å; I140-I207 HydrophobicContact CG2-CG2 3.58Å; I140-A208 CarbonylContact C-O 3.32Å; I140-A208 WeakPolarHBondContact CA-O 3.37Å; I140-V209 HydrophobicContact CG1-CG2 4.21Å
141	E	86.5	Confident	85	Confident	89 Å²	89	48.2 Å²	48.2	42%	0.416	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.9	165.6	-59.3	-175	166.3	0	0	108.2	F139 V160 A208 M210	F139-E141 HydrophobicContact CD2-CG 4.29Å; F139-E141 HydrophobicContact CE2-CG 3.89Å; E141-V160 HydrophobicContact CG-CG1 4.25Å; E141-V160 HydrophobicContact CG-CG2 4.18Å; E141-A208 HydrophobicContact CB-CB 4.41Å; E141-A208 PolarHBondContact N-O 2.79Å; E141-A208 PolarHBondContact O-N 2.8Å; E141-M210 HydrophobicContact CG-CG 4.22Å
142	Y	84.8	Confident	84.5	Confident	36 Å²	36	46.3 Å²	46.3	14%	0.141	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.8	177.9	66.6	-91.3	0	0	0	111.8	I127 F158 G159 M180 L182 F184 L205 F206	I127-Y142 HydrophobicContact CD1-CD1 3.69Å; I127-Y142 HydrophobicContact CD1-CE1 4.25Å; I127-Y142 HydrophobicContact CD1-CG 4.14Å; Y142-F158 WeakPolarHBondContact O-CA 3.41Å; Y142-G159 WeakPolarHBondContact CD1-O 3.43Å; Y142-G159 VanDerWaalsContact CE1-C 3.4Å; Y142-G159 VanDerWaalsContact CZ-CA 3.48Å; Y142-G159 PolarHBondContact N-O 2.83Å; Y142-G159 PolarHBondContact O-N 2.92Å; Y142-M180 HydrophobicContact CE1-CG 4.41Å; Y142-L182 HydrophobicContact CD1-CD2 4.29Å; Y142-L182 HydrophobicContact CD2-CD2 3.79Å; Y142-L182 HydrophobicContact CE1-CD2 3.98Å; Y142-L182 HydrophobicContact CE2-CD2 3.43Å; Y142-L182 VanDerWaalsContact CE2-CD2 3.43Å; Y142-L182 HydrophobicContact CG-CD2 4.2Å; Y142-F184 HydrophobicContact CD2-CZ 4.16Å; Y142-F184 AromaticContact CE2-CZ 3.97Å; Y142-F184 HydrophobicContact CE2-CZ 3.97Å; Y142-L205 HydrophobicContact CD2-CD1 4.25Å; Y142-F206 CarbonylContact C-O 3.53Å; Y142-F206 WeakPolarHBondContact CA-O 3.5Å
143	C	86.8	Confident	83.8	Confident	27 Å²	27	45.6 Å²	45.6	18%	0.182	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	119.8	-178	163.2	0	0	0	0	109.8	R157 F158 F206	C143-R157 CarbonylContact C-O 3.55Å; C143-R157 WeakPolarHBondContact CA-O 3.35Å; C143-F158 HydrophobicContact CB-CD1 3.51Å; C143-F158 HydrophobicContact CB-CE1 3.58Å; C143-F158 HydrophobicContact CB-CG 4.48Å; C143-F158 WeakPolarHBondContact SG-CE1 3.34Å; C143-F158 VanDerWaalsContact SG-CZ 3.54Å; C143-F206 HydrophobicContact CB-CB 4.23Å; C143-F206 PolarHBondContact N-O 2.92Å; C143-F206 PolarHBondContact O-N 2.81Å
144	L	85.8	Confident	83.1	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113.8	169.1	-177	69.6	0	0	0	110.2	I146 R157 F184 L186 P203 L205 L228	L144-I146 HydrophobicContact CD2-CD1 4.26Å; L144-I146 HydrophobicContact CD2-CG1 4.13Å; L144-I146 HydrophobicContact CG-CG1 4.09Å; L144-R157 PolarHBondContact N-O 3.31Å; L144-F184 HydrophobicContact CB-CD1 4.34Å; L144-F184 HydrophobicContact CB-CE1 3.96Å; L144-F184 HydrophobicContact CB-CE2 4.37Å; L144-F184 HydrophobicContact CB-CZ 3.98Å; L144-F184 HydrophobicContact CD2-CB 3.82Å; L144-F184 HydrophobicContact CD2-CD1 3.59Å; L144-F184 HydrophobicContact CD2-CD2 3.95Å; L144-F184 HydrophobicContact CD2-CE1 4.07Å; L144-F184 HydrophobicContact CD2-CE2 4.4Å; L144-F184 HydrophobicContact CD2-CG 3.52Å; L144-F184 HydrophobicContact CD2-CZ 4.45Å; L144-L186 HydrophobicContact CD2-CD1 4.22Å; L144-L186 HydrophobicContact CD2-CD2 3.91Å; L144-L186 HydrophobicContact CD2-CG 4.43Å; L144-P203 HydrophobicContact CD1-CB 4.35Å; L144-L205 HydrophobicContact CB-CD1 4.49Å; L144-L228 HydrophobicContact CD1-CD1 3.97Å; L144-L228 HydrophobicContact CD1-CD2 4.08Å; L144-L228 HydrophobicContact CD1-CG 4.17Å
145	E	82	Confident	82.5	Confident	34 Å²	34	48 Å²	48	16%	0.159	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	126.5	170.7	-169.9	166.3	168.6	0	0	110.8	P203 L204 F206 F349	E145-P203 WeakPolarHBondContact O-CA 3.23Å; E145-L204 PolarHBondContact N-O 2.82Å; E145-L204 PolarHBondContact O-N 2.84Å; E145-F206 HydrophobicContact CB-CD2 4.1Å; E145-F206 HydrophobicContact CB-CE2 3.76Å; E145-F206 VanDerWaalsContact OE2-CE2 3.31Å; E145-F206 WeakPolarHBondContact OE2-CE2 3.15Å; E145-F349 VanDerWaalsContact CD-CE2 3.47Å; E145-F349 WeakPolarHBondContact OE1-CE2 3.35Å; E145-F349 WeakPolarHBondContact OE2-CE2 3.42Å; E145-F349 VanDerWaalsContact OE2-CZ 3.26Å; E145-F349 WeakPolarHBondContact OE2-CZ 3.49Å
146	I	83.8	Confident	82.1	Confident	26 Å²	26	52.4 Å²	52.4	13%	0.133	28%	0.281	C	S	.	.			trans	-109.5	120.9	-174.9	-63.1	172.2	0	0	0	107.8	L144 W150 S152 R157 L186	L144-I146 HydrophobicContact CD2-CD1 4.26Å; L144-I146 HydrophobicContact CD2-CG1 4.13Å; L144-I146 HydrophobicContact CG-CG1 4.09Å; I146-W150 HydrophobicContact CG2-CB 3.12Å; I146-W150 HydrophobicContact CG2-CG 4.09Å; I146-S152 WeakPolarHBondContact CD1-OG 3.46Å; I146-R157 HydrophobicContact CD1-CG 4.31Å; I146-L186 HydrophobicContact CD1-CD2 3.35Å; I146-L186 HydrophobicContact CG1-CD2 3.77Å
147	P	80.7	Confident	81.7	Confident	14 Å²	14	54.2 Å²	54.2	9%	0.091	28%	0.278	C	S	.	.			trans	-68.7	173.8	-177.9	-19.5	30.2	0	0	0	114.3	G149 W150 E201 W202	P147-G149 PolarHBondContact O-N 2.9Å; P147-W150 WeakPolarHBondContact O-CB 3.41Å; P147-W150 PolarHBondContact O-N 2.94Å; P147-E201 HydrophobicContact CB-CB 3.37Å; P147-E201 HydrophobicContact CB-CG 4.44Å; P147-E201 HydrophobicContact CG-CB 3.86Å; P147-E201 WeakPolarHBondContact CG-O 3.22Å; P147-W202 WeakPolarHBondContact CG-O 3.14Å
148	K	74.3	Confident	81.4	Confident	145 Å²	145	58.4 Å²	58.4	63%	0.63	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	137	176.4	-72	-178.3	171.8	-179.3	0	110.9	W150 E201 R352	K148-W150 VanDerWaalsContact C-N 3.3Å; K148-E201 PolarHBondContact N-OE2 2.75Å; K148-R352 VanDerWaalsContact CE-NH2 3.31Å
149	G	76.8	Confident	80.9	Confident	44 Å²	44	59.2 Å²	59.2	45%	0.454	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	92	-14.3	-178.2	0	0	0	0	0	114	P147 L188	P147-G149 PolarHBondContact O-N 2.9Å; G149-L188 WeakPolarHBondContact O-CD1 3.41Å
150	W	84	Confident	80.7	Confident	21 Å²	21	62.4 Å²	62.4	8%	0.08	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	144.3	170.9	-66.2	82.9	0	0	0	110.9	L119 I121 I146 P147 K148 L186 M187 L188 E201 W202 P203	L119-W150 HydrophobicContact CD2-CH2 4.23Å; I121-W150 HydrophobicContact CD1-CH2 3.48Å; I121-W150 VanDerWaalsContact CD1-CH2 3.48Å; I121-W150 HydrophobicContact CD1-CZ3 3.65Å; I121-W150 HydrophobicContact CG1-CH2 4.37Å; I121-W150 HydrophobicContact CG1-CZ3 4.15Å; I146-W150 HydrophobicContact CG2-CB 3.12Å; I146-W150 HydrophobicContact CG2-CG 4.09Å; P147-W150 WeakPolarHBondContact O-CB 3.41Å; P147-W150 PolarHBondContact O-N 2.94Å; K148-W150 VanDerWaalsContact C-N 3.3Å; W150-L186 HydrophobicContact CE3-CB 3.89Å; W150-L186 HydrophobicContact CE3-CD1 4.47Å; W150-L186 HydrophobicContact CZ3-CB 4.03Å; W150-M187 CarbonylContact C-O 3.54Å; W150-M187 VanDerWaalsContact CA-O 3.31Å; W150-M187 WeakPolarHBondContact CA-O 3.31Å; W150-L188 HydrophobicContact CD2-CB 3.89Å; W150-L188 HydrophobicContact CD2-CD1 3.97Å; W150-L188 HydrophobicContact CD2-CG 4.37Å; W150-L188 HydrophobicContact CE3-CB 3.76Å; W150-L188 HydrophobicContact CG-CD1 3.92Å; W150-L188 HydrophobicContact CH2-CB 4.11Å; W150-L188 HydrophobicContact CH2-CD2 4.18Å; W150-L188 HydrophobicContact CZ2-CB 4.25Å; W150-L188 HydrophobicContact CZ2-CD2 3.77Å; W150-L188 HydrophobicContact CZ2-CG 4.41Å; W150-L188 HydrophobicContact CZ3-CB 3.87Å; W150-E201 PolarHBondContact NE1-O 2.84Å; W150-W202 HydrophobicContact CH2-CE3 4.23Å; W150-W202 AromaticContact CH2-CH2 3.93Å; W150-W202 HydrophobicContact CH2-CH2 3.93Å; W150-W202 HydrophobicContact CH2-CZ2 4.4Å; W150-W202 AromaticContact CH2-CZ3 3.83Å; W150-W202 HydrophobicContact CH2-CZ3 3.83Å; W150-W202 HydrophobicContact CZ2-CD2 4.26Å; W150-W202 AromaticContact CZ2-CE3 3.67Å; W150-W202 HydrophobicContact CZ2-CE3 3.67Å; W150-W202 HydrophobicContact CZ2-CH2 4.2Å; W150-W202 AromaticContact CZ2-CZ3 3.64Å; W150-W202 HydrophobicContact CZ2-CZ3 3.64Å; W150-P203 HydrophobicContact CD2-CG 3.9Å; W150-P203 HydrophobicContact CE3-CG 4.04Å; W150-P203 HydrophobicContact CH2-CG 4.13Å; W150-P203 HydrophobicContact CZ2-CG 3.98Å; W150-P203 HydrophobicContact CZ3-CG 4.15Å
151	A	83.3	Confident	80.7	Confident	49 Å²	49	62.6 Å²	62.6	41%	0.405	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.3	171.2	0	0	0	0	0	109.2	L186 M187	A151-L186 CarbonylContact O-C 3.54Å; A151-L186 WeakPolarHBondContact O-CA 3.29Å; A151-M187 PolarHBondContact N-O 2.88Å; A151-M187 PolarHBondContact O-N 3.44Å
152	S	81.5	Confident	80.8	Confident	20 Å²	20	62.7 Å²	62.7	14%	0.14	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.9	169.7	-155.8	0	0	0	0	107.9	I146 T154 R157	I146-S152 WeakPolarHBondContact CD1-OG 3.46Å; S152-T154 WeakPolarHBondContact CB-O 3.15Å; S152-T154 PolarHBondContact OG-O 3.29Å; S152-T154 PolarHBondContact OG-OG1 3.02Å; S152-R157 VanDerWaalsContact CB-CZ 3.43Å; S152-R157 PolarHBondContact OG-NE 2.94Å
153	Q	75	Confident	80.9	Confident	89 Å²	89	65 Å²	65	42%	0.416	34%	0.34	S	S	.	.	S	Bend	trans	-81.3	-28.4	166.5	-57.6	-141.6	55.6	0	0	111	E185 M187	Q153-E185 HydrophobicContact CB-CB 4.11Å; Q153-E185 HydrophobicContact CB-CG 3.99Å; Q153-E185 HydrophobicContact CG-CG 4.07Å; Q153-E185 PolarHBondContact N-O 3.31Å; Q153-E185 PolarHBondContact NE2-OE1 2.81Å; Q153-M187 HydrophobicContact CG-CE 3.79Å; Q153-M187 HydrophobicContact CG-CG 4.26Å; Q153-M187 PolarHBondContact NE2-SD 2.93Å
154	T	72.4	Confident	81.1	Confident	35 Å²	35	64.6 Å²	64.6	22%	0.215	34%	0.336	C	S	.	.			trans	-83.5	130.2	176.2	50.4	0	0	0	0	111.8	S152 K156 E185	S152-T154 WeakPolarHBondContact CB-O 3.15Å; S152-T154 PolarHBondContact OG-O 3.29Å; S152-T154 PolarHBondContact OG-OG1 3.02Å; T154-K156 VanDerWaalsContact C-N 3.34Å; T154-E185 HydrophobicContact CG2-CB 3.99Å
155	D	67.9	Low	81.4	Confident	160 Å²	160	67.8 Å²	67.8	86%	0.856	36%	0.359	S	S	*	.	S	Bend	trans	-71.2	-28.4	174.4	-80	-27.6	0	0	0	112.8	R157	D155-R157 PolarHBondContact O-N 3.12Å; D155-R157 VanDerWaalsContact O-N 3.15Å
156	K	73.7	Confident	81.9	Confident	175 Å²	175	67.4 Å²	67.4	76%	0.761	36%	0.359	S	S	*	.			trans	-85.5	88.7	-177.1	-64.5	-175.9	-176.2	173.3	0	111.4	T154	T154-K156 VanDerWaalsContact C-N 3.34Å
157	R	79.5	Confident	82.2	Confident	96 Å²	96	69.7 Å²	69.7	36%	0.362	38%	0.375	S	S	.	.			trans	-94.9	-10.7	173.1	-58.6	177.5	-161.9	172.8	6.3	113.5	C143 L144 I146 S152 D155	C143-R157 CarbonylContact C-O 3.55Å; C143-R157 WeakPolarHBondContact CA-O 3.35Å; L144-R157 PolarHBondContact N-O 3.31Å; I146-R157 HydrophobicContact CD1-CG 4.31Å; S152-R157 VanDerWaalsContact CB-CZ 3.43Å; S152-R157 PolarHBondContact OG-NE 2.94Å; D155-R157 PolarHBondContact O-N 3.12Å; D155-R157 VanDerWaalsContact O-N 3.15Å
158	F	83.6	Confident	82.8	Confident	145 Å²	145	76.3 Å²	76.3	64%	0.636	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.4	-177.7	-59.9	-98.9	0	0	0	108.6	Y142 C143	Y142-F158 WeakPolarHBondContact O-CA 3.41Å; C143-F158 HydrophobicContact CB-CD1 3.51Å; C143-F158 HydrophobicContact CB-CE1 3.58Å; C143-F158 HydrophobicContact CB-CG 4.48Å; C143-F158 WeakPolarHBondContact SG-CE1 3.34Å; C143-F158 VanDerWaalsContact SG-CZ 3.54Å
159	G	78.8	Confident	83.6	Confident	18 Å²	18	71.6 Å²	71.6	19%	0.186	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	170.3	175.7	0	0	0	0	0	112.3	Y142	Y142-G159 WeakPolarHBondContact CD1-O 3.43Å; Y142-G159 VanDerWaalsContact CE1-C 3.4Å; Y142-G159 VanDerWaalsContact CZ-CA 3.48Å; Y142-G159 PolarHBondContact N-O 2.83Å; Y142-G159 PolarHBondContact O-N 2.92Å
160	V	86	Confident	83.9	Confident	79 Å²	79	74.8 Å²	74.8	48%	0.479	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.8	-180	-170	0	0	0	0	107.9	F139 I140 E141	F139-V160 HydrophobicContact CD2-CG1 3.48Å; F139-V160 VanDerWaalsContact CD2-CG1 3.48Å; F139-V160 HydrophobicContact CE2-CG1 4.02Å; F139-V160 HydrophobicContact CG-CG1 4.48Å; I140-V160 CarbonylContact O-C 3.38Å; I140-V160 VanDerWaalsContact O-CA 3.31Å; I140-V160 WeakPolarHBondContact O-CA 3.47Å; E141-V160 HydrophobicContact CG-CG1 4.25Å; E141-V160 HydrophobicContact CG-CG2 4.18Å
161	T	87.7	Confident	83.9	Confident	9 Å²	9	83.8 Å²	83.8	6%	0.055	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-73.8	166.5	174.3	71	0	0	0	0	111.5	I127 F139 I140 F178 M180	I127-T161 HydrophobicContact CD1-CG2 4.13Å; F139-T161 WeakPolarHBondContact CA-OG1 3.4Å; I140-T161 HydrophobicContact CB-CG2 3.77Å; I140-T161 PolarHBondContact N-OG1 3.27Å; I140-T161 PolarHBondContact O-N 3.18Å; T161-F178 HydrophobicContact CG2-CB 4.31Å; T161-F178 HydrophobicContact CG2-CD1 4.41Å; T161-F178 HydrophobicContact CG2-CG 4.38Å; T161-F178 WeakPolarHBondContact OG1-CD1 3.26Å; T161-M180 HydrophobicContact CG2-CB 3.75Å; T161-M180 HydrophobicContact CG2-CG 4.03Å
162	Q	88.1	Confident	84	Confident	92 Å²	92	83.5 Å²	83.5	43%	0.43	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-63.1	161.2	163.4	73.5	-84.2	35.3	0	0	111.4	F178	Q162-F178 PolarHBondContact NE2-O 2.89Å
163	L	88	Confident	84.3	Confident	85 Å²	85	83.2 Å²	83.2	45%	0.445	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-74.1	122.6	169.6	-76.6	153.4	0	0	0	109.8	N137 L138 F139 M212	N137-L163 HydrophobicContact CB-CD2 4.39Å; N137-L163 WeakPolarHBondContact O-CD2 3.39Å; L138-L163 CarbonylContact O-C 3.46Å; L138-L163 WeakPolarHBondContact O-CA 3.31Å; F139-L163 HydrophobicContact CB-CD2 4.08Å; F139-L163 HydrophobicContact CB-CG 4.34Å; F139-L163 HydrophobicContact CD1-CD2 3.59Å; F139-L163 HydrophobicContact CD1-CG 4.48Å; F139-L163 HydrophobicContact CE1-CD2 4.47Å; F139-L163 HydrophobicContact CG-CD2 4.21Å; L163-M212 HydrophobicContact CD1-CE 3.25Å; L163-M212 HydrophobicContact CD1-SD 4.23Å; L163-M212 HydrophobicContact CD2-CB 3.86Å; L163-M212 HydrophobicContact CD2-CE 4.04Å; L163-M212 HydrophobicContact CG-CE 4.29Å
164	S	90.1	Very high	85.1	Confident	17 Å²	17	83.1 Å²	83.1	12%	0.119	43%	0.433	C	S	.	.	B	Isolated β-bridge	trans	-110.6	129.4	173.4	178.9	0	0	0	0	110.5	N137 L138 Y177	N137-S164 CarbonylContact C-O 3.56Å; N137-S164 WeakPolarHBondContact CA-O 3.42Å; N137-S164 PolarHBondContact N-O 2.85Å; L138-S164 PolarHBondContact N-O 2.82Å; L138-S164 PolarHBondContact O-N 2.79Å; S164-Y177 VanDerWaalsContact CB-O 3.24Å; S164-Y177 WeakPolarHBondContact CB-O 3.43Å; S164-Y177 PolarHBondContact OG-N 2.93Å; S164-Y177 VanDerWaalsContact OG-N 3.12Å; S164-Y177 PolarHBondContact OG-O 3.27Å
165	S	91.3	Very high	86.2	Confident	71 Å²	71	81.5 Å²	81.5	50%	0.497	42%	0.423	S	S	.	.			trans	-67.1	153.2	164.4	-159.6	0	0	0	0	110.1
166	T	92.8	Very high	87.4	Confident	26 Å²	26	73.9 Å²	73.9	16%	0.16	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128	-178.8	-53.9	0	0	0	0	109	S136 M174 V175	S136-T166 WeakPolarHBondContact CA-OG1 3.41Å; T166-M174 HydrophobicContact CG2-CB 3.62Å; T166-M174 HydrophobicContact CG2-CG 4.47Å; T166-M174 HydrophobicContact CG2-SD 4.4Å; T166-V175 CarbonylContact C-O 3.56Å; T166-V175 WeakPolarHBondContact CA-O 3.29Å
167	T	91.4	Very high	88.4	Confident	74 Å²	74	71.5 Å²	71.5	45%	0.454	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.5	-179.8	52.3	0	0	0	0	110.7	V175	T167-V175 PolarHBondContact N-O 2.88Å; T167-V175 PolarHBondContact O-N 2.87Å; T167-V175 PolarHBondContact OG1-O 2.9Å
168	Y	92.2	Very high	89.1	Confident	153 Å²	153	67.4 Å²	67.4	60%	0.6	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.1	177.7	-178.7	-103.9	0	0	0	111.1	M174	Y168-M174 HydrophobicContact CD2-CE 3.92Å; Y168-M174 HydrophobicContact CD2-SD 4.02Å; Y168-M174 HydrophobicContact CG-CE 4.34Å; Y168-M174 HydrophobicContact CG-SD 4.4Å
169	V	91.1	Very high	89.4	Confident	46 Å²	46	62 Å²	62	28%	0.279	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123	175.4	-179.9	0	0	0	0	108.8	K171 A172 G173 V175	V169-K171 PolarHBondContact O-N 2.84Å; V169-A172 HydrophobicContact CB-CB 4.17Å; V169-A172 HydrophobicContact CG1-CB 4.23Å; V169-A172 PolarHBondContact O-N 2.75Å; V169-G173 PolarHBondContact N-O 3.45Å; V169-G173 PolarHBondContact O-N 3.29Å; V169-V175 HydrophobicContact CB-CG2 4.37Å; V169-V175 HydrophobicContact CG2-CB 4.47Å; V169-V175 HydrophobicContact CG2-CG2 4.2Å
170	P	82.5	Confident	90	Very high	110 Å²	110	63.1 Å²	63.1	71%	0.714	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-22	-170.6	-29.7	34.3	0	0	0	117.3
171	K	85.6	Confident	90.3	Very high	211 Å²	211	63.1 Å²	63.1	92%	0.917	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-22.4	179.1	-67.5	-176.1	178.5	179.8	0	114.7	V169	V169-K171 PolarHBondContact O-N 2.84Å
172	A	83.9	Confident	90.4	Very high	42 Å²	42	63.2 Å²	63.2	35%	0.347	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-23.7	-174.4	0	0	0	0	0	112.5	V131 N132 V169 V175	V131-A172 WeakPolarHBondContact CG1-O 3.4Å; N132-A172 PolarHBondContact ND2-O 3.35Å; V169-A172 HydrophobicContact CB-CB 4.17Å; V169-A172 HydrophobicContact CG1-CB 4.23Å; V169-A172 PolarHBondContact O-N 2.75Å; A172-V175 HydrophobicContact CB-CG2 3.63Å
173	G	89.5	Confident	90.5	Very high	14 Å²	14	65.2 Å²	65.2	14%	0.144	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93	-143.5	-174.3	0	0	0	0	0	111.7	N132 V169 V175	N132-G173 WeakPolarHBondContact OD1-CA 3.14Å; V169-G173 PolarHBondContact N-O 3.45Å; V169-G173 PolarHBondContact O-N 3.29Å; G173-V175 PolarHBondContact O-N 3.21Å
174	M	91.8	Very high	90.6	Very high	88 Å²	88	61.5 Å²	61.5	43%	0.433	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	111.3	-180	-72.5	-61.3	-178.9	0	0	109.8	V131 N132 T166 Y168	V131-M174 CarbonylContact C-O 3.55Å; V131-M174 WeakPolarHBondContact CA-O 3.49Å; N132-M174 PolarHBondContact N-O 2.72Å; N132-M174 PolarHBondContact OD1-N 2.68Å; T166-M174 HydrophobicContact CG2-CB 3.62Å; T166-M174 HydrophobicContact CG2-CG 4.47Å; T166-M174 HydrophobicContact CG2-SD 4.4Å; Y168-M174 HydrophobicContact CD2-CE 3.92Å; Y168-M174 HydrophobicContact CD2-SD 4.02Å; Y168-M174 HydrophobicContact CG-CE 4.34Å; Y168-M174 HydrophobicContact CG-SD 4.4Å
175	V	94.5	Very high	90.6	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.2	-173.4	-171.3	0	0	0	0	111.3	A130 V131 T166 T167 V169 A172 G173 Y177	A130-V175 WeakPolarHBondContact O-CA 3.41Å; V131-V175 HydrophobicContact CG1-CG2 4.28Å; V131-V175 HydrophobicContact CG2-CG1 4.16Å; V131-V175 HydrophobicContact CG2-CG2 4.15Å; T166-V175 CarbonylContact C-O 3.56Å; T166-V175 WeakPolarHBondContact CA-O 3.29Å; T167-V175 PolarHBondContact N-O 2.88Å; T167-V175 PolarHBondContact O-N 2.87Å; T167-V175 PolarHBondContact OG1-O 2.9Å; V169-V175 HydrophobicContact CB-CG2 4.37Å; V169-V175 HydrophobicContact CG2-CB 4.47Å; V169-V175 HydrophobicContact CG2-CG2 4.2Å; A172-V175 HydrophobicContact CB-CG2 3.63Å; G173-V175 PolarHBondContact O-N 3.21Å; V175-Y177 HydrophobicContact CB-CE2 4Å; V175-Y177 HydrophobicContact CG1-CD1 4.19Å; V175-Y177 HydrophobicContact CG1-CD2 4.06Å; V175-Y177 HydrophobicContact CG1-CE1 3.78Å; V175-Y177 HydrophobicContact CG1-CE2 3.64Å; V175-Y177 HydrophobicContact CG1-CG 4.33Å; V175-Y177 VanDerWaalsContact CG1-CZ 3.49Å
176	A	93.3	Very high	90.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.9	167	0	0	0	0	0	108.9	S129 A130 L138 F178	S129-A176 CarbonylContact C-O 3.58Å; S129-A176 WeakPolarHBondContact CA-O 3.35Å; S129-A176 VanDerWaalsContact CB-O 3.22Å; S129-A176 WeakPolarHBondContact CB-O 3.2Å; A130-A176 PolarHBondContact N-O 2.91Å; A130-A176 PolarHBondContact O-N 3.33Å; L138-A176 HydrophobicContact CB-CB 4.15Å; L138-A176 HydrophobicContact CD1-CB 3.83Å; L138-A176 HydrophobicContact CG-CB 4.29Å; A176-F178 HydrophobicContact CB-CE2 4.44Å; A176-F178 HydrophobicContact CB-CZ 4.06Å
177	Y	94.8	Very high	90.3	Very high	124 Å²	124	60.3 Å²	60.3	49%	0.486	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.3	-177.2	-67.5	-80	0	0	0	110	S164 V175	S164-Y177 VanDerWaalsContact CB-O 3.24Å; S164-Y177 WeakPolarHBondContact CB-O 3.43Å; S164-Y177 PolarHBondContact OG-N 2.93Å; S164-Y177 VanDerWaalsContact OG-N 3.12Å; S164-Y177 PolarHBondContact OG-O 3.27Å; V175-Y177 HydrophobicContact CB-CE2 4Å; V175-Y177 HydrophobicContact CG1-CD1 4.19Å; V175-Y177 HydrophobicContact CG1-CD2 4.06Å; V175-Y177 HydrophobicContact CG1-CE1 3.78Å; V175-Y177 HydrophobicContact CG1-CE2 3.64Å; V175-Y177 HydrophobicContact CG1-CG 4.33Å; V175-Y177 VanDerWaalsContact CG1-CZ 3.49Å
178	F	94.3	Very high	90	Very high	10 Å²	10	57 Å²	57	4%	0.044	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-53.5	178.7	-49.4	-79.7	0	0	0	110.4	I127 E128 A130 L138 I140 T161 Q162 A176 M180	I127-F178 HydrophobicContact CG2-CD2 4.18Å; E128-F178 PolarHBondContact O-N 3.12Å; A130-F178 HydrophobicContact CB-CE2 3.59Å; A130-F178 HydrophobicContact CB-CZ 4.01Å; L138-F178 HydrophobicContact CB-CE1 4.28Å; L138-F178 HydrophobicContact CB-CZ 3.92Å; L138-F178 WeakPolarHBondContact O-CE1 3.35Å; I140-F178 HydrophobicContact CD1-CD2 3.72Å; I140-F178 HydrophobicContact CD1-CE2 3.3Å; I140-F178 HydrophobicContact CD1-CG 4.49Å; I140-F178 HydrophobicContact CD1-CZ 3.77Å; I140-F178 HydrophobicContact CG1-CE1 4.37Å; I140-F178 HydrophobicContact CG1-CE2 3.93Å; I140-F178 HydrophobicContact CG1-CZ 3.85Å; T161-F178 HydrophobicContact CG2-CB 4.31Å; T161-F178 HydrophobicContact CG2-CD1 4.41Å; T161-F178 HydrophobicContact CG2-CG 4.38Å; T161-F178 WeakPolarHBondContact OG1-CD1 3.26Å; Q162-F178 PolarHBondContact NE2-O 2.89Å; A176-F178 HydrophobicContact CB-CE2 4.44Å; A176-F178 HydrophobicContact CB-CZ 4.06Å; F178-M180 VanDerWaalsContact C-N 3.28Å; F178-M180 PolarHBondContact O-N 3.35Å
179	G	90.3	Very high	89.4	Confident	31 Å²	31	52.1 Å²	52.1	32%	0.32	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.1	44.5	-171	0	0	0	0	0	113.3	E126 I127 E128 P181	E126-G179 WeakPolarHBondContact OE1-CA 3.42Å; I127-G179 WeakPolarHBondContact O-CA 3.27Å; I127-G179 PolarHBondContact O-N 2.81Å; E128-G179 PolarHBondContact O-N 2.84Å; G179-P181 WeakPolarHBondContact O-CD 3.2Å
180	M	91.3	Very high	88.8	Confident	43 Å²	43	54.4 Å²	54.4	21%	0.212	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.4	179.8	178.2	61.1	73.6	0	0	109.9	E126 I127 Y142 T161 F178	E126-M180 CarbonylContact C-O 3.41Å; E126-M180 WeakPolarHBondContact CA-O 3.48Å; I127-M180 HydrophobicContact CB-CB 4.3Å; I127-M180 PolarHBondContact N-O 2.81Å; I127-M180 PolarHBondContact O-N 2.75Å; Y142-M180 HydrophobicContact CE1-CG 4.41Å; T161-M180 HydrophobicContact CG2-CB 3.75Å; T161-M180 HydrophobicContact CG2-CG 4.03Å; F178-M180 VanDerWaalsContact C-N 3.28Å; F178-M180 PolarHBondContact O-N 3.35Å
181	P	91.5	Very high	88.3	Confident	79 Å²	79	56.3 Å²	56.3	51%	0.513	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	142.6	176.6	27.9	-34.6	0	0	0	111.9	G125 G179	G125-P181 CarbonylContact O-C 3.56Å; G125-P181 WeakPolarHBondContact O-CA 3.02Å; G179-P181 WeakPolarHBondContact O-CD 3.2Å
182	L	90.6	Very high	87.3	Confident	11 Å²	11	53.4 Å²	53.4	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.4	173.8	-63.3	178.9	0	0	0	108.6	L124 G125 I127 Y142 F184 L205	L124-L182 WeakPolarHBondContact CA-O 3.46Å; G125-L182 PolarHBondContact N-O 2.77Å; G125-L182 PolarHBondContact O-N 3.36Å; I127-L182 HydrophobicContact CD1-CD1 4.29Å; I127-L182 HydrophobicContact CD1-CD2 4.08Å; I127-L182 HydrophobicContact CD1-CG 4.44Å; I127-L182 HydrophobicContact CG1-CD1 3.8Å; I127-L182 HydrophobicContact CG1-CD2 4.25Å; I127-L182 HydrophobicContact CG1-CG 4.05Å; Y142-L182 HydrophobicContact CD1-CD2 4.29Å; Y142-L182 HydrophobicContact CD2-CD2 3.79Å; Y142-L182 HydrophobicContact CE1-CD2 3.98Å; Y142-L182 HydrophobicContact CE2-CD2 3.43Å; Y142-L182 VanDerWaalsContact CE2-CD2 3.43Å; Y142-L182 HydrophobicContact CG-CD2 4.2Å; L182-F184 HydrophobicContact CB-CE2 4.03Å; L182-F184 HydrophobicContact CD1-CE2 4.34Å; L182-F184 HydrophobicContact CD2-CE2 4.3Å; L182-F184 HydrophobicContact CD2-CZ 4.17Å; L182-F184 HydrophobicContact CG-CE2 4.47Å; L182-L205 HydrophobicContact CD1-CD2 3.8Å
183	E	89.5	Confident	86.4	Confident	134 Å²	134	53.4 Å²	53.4	63%	0.626	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	112.2	176.8	-63.8	179.4	178.7	0	0	108.2	L123 L124	L123-E183 WeakPolarHBondContact O-CA 3.49Å; L124-E183 HydrophobicContact CD2-CB 4.42Å; L124-E183 HydrophobicContact CD2-CG 3.91Å
184	F	90.7	Very high	84.8	Confident	7 Å²	7	61.9 Å²	61.9	3%	0.031	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.8	176.6	-57.2	-58.8	0	0	0	110.5	L123 Y142 L144 L182 L205	L123-F184 HydrophobicContact CB-CB 4.34Å; L123-F184 HydrophobicContact CD2-CD2 3.96Å; L123-F184 PolarHBondContact N-O 2.89Å; L123-F184 PolarHBondContact O-N 2.84Å; Y142-F184 HydrophobicContact CD2-CZ 4.16Å; Y142-F184 AromaticContact CE2-CZ 3.97Å; Y142-F184 HydrophobicContact CE2-CZ 3.97Å; L144-F184 HydrophobicContact CB-CD1 4.34Å; L144-F184 HydrophobicContact CB-CE1 3.96Å; L144-F184 HydrophobicContact CB-CE2 4.37Å; L144-F184 HydrophobicContact CB-CZ 3.98Å; L144-F184 HydrophobicContact CD2-CB 3.82Å; L144-F184 HydrophobicContact CD2-CD1 3.59Å; L144-F184 HydrophobicContact CD2-CD2 3.95Å; L144-F184 HydrophobicContact CD2-CE1 4.07Å; L144-F184 HydrophobicContact CD2-CE2 4.4Å; L144-F184 HydrophobicContact CD2-CG 3.52Å; L144-F184 HydrophobicContact CD2-CZ 4.45Å; L182-F184 HydrophobicContact CB-CE2 4.03Å; L182-F184 HydrophobicContact CD1-CE2 4.34Å; L182-F184 HydrophobicContact CD2-CE2 4.3Å; L182-F184 HydrophobicContact CD2-CZ 4.17Å; L182-F184 HydrophobicContact CG-CE2 4.47Å; F184-L205 HydrophobicContact CE2-CD1 4.04Å; F184-L205 HydrophobicContact CZ-CD1 4.16Å
185	E	89.8	Confident	83	Confident	31 Å²	31	62 Å²	62	15%	0.145	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.6	174.6	-171.5	-174.2	169.1	0	0	109.9	R120 I121 F122 Q153 T154	R120-E185 IonicContact CZ-OE1 3.83Å; R120-E185 IonicContact NE-OE1 3.08Å; R120-E185 PolarHBondContact NE-OE1 2.9Å; R120-E185 IonicContact NH2-OE1 2.78Å; R120-E185 PolarHBondContact NH2-OE1 2.73Å; I121-E185 WeakPolarHBondContact O-CA 3.47Å; F122-E185 HydrophobicContact CD1-CB 4.25Å; F122-E185 HydrophobicContact CD1-CG 3.75Å; F122-E185 HydrophobicContact CE1-CB 4.4Å; F122-E185 HydrophobicContact CE1-CG 3.61Å; F122-E185 HydrophobicContact CZ-CG 4.38Å; Q153-E185 HydrophobicContact CB-CB 4.11Å; Q153-E185 HydrophobicContact CB-CG 3.99Å; Q153-E185 HydrophobicContact CG-CG 4.07Å; Q153-E185 PolarHBondContact N-O 3.31Å; Q153-E185 PolarHBondContact NE2-OE1 2.81Å; T154-E185 HydrophobicContact CG2-CB 3.99Å
186	L	89.8	Confident	81	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.2	-173.9	-55.7	178.9	0	0	0	110.3	R120 I121 L144 I146 W150 A151 P203 L228	R120-L186 CarbonylContact C-O 3.6Å; R120-L186 WeakPolarHBondContact CA-O 3.46Å; I121-L186 HydrophobicContact CB-CB 4.37Å; I121-L186 PolarHBondContact N-O 2.63Å; I121-L186 PolarHBondContact O-N 3.32Å; L144-L186 HydrophobicContact CD2-CD1 4.22Å; L144-L186 HydrophobicContact CD2-CD2 3.91Å; L144-L186 HydrophobicContact CD2-CG 4.43Å; I146-L186 HydrophobicContact CD1-CD2 3.35Å; I146-L186 HydrophobicContact CG1-CD2 3.77Å; W150-L186 HydrophobicContact CE3-CB 3.89Å; W150-L186 HydrophobicContact CE3-CD1 4.47Å; W150-L186 HydrophobicContact CZ3-CB 4.03Å; A151-L186 CarbonylContact O-C 3.54Å; A151-L186 WeakPolarHBondContact O-CA 3.29Å; L186-P203 HydrophobicContact CD1-CB 3.85Å; L186-P203 HydrophobicContact CD1-CG 3.68Å; L186-L228 HydrophobicContact CD1-CD1 3.64Å
187	M	87.3	Confident	78.9	Confident	56 Å²	56	73.1 Å²	73.1	28%	0.276	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.1	171.2	-72.1	-162.8	-66.1	0	0	110.2	L119 R120 W150 A151 Q153	L119-M187 CarbonylContact O-C 3.49Å; L119-M187 WeakPolarHBondContact O-CA 3.4Å; R120-M187 HydrophobicContact CB-CG 4.33Å; R120-M187 HydrophobicContact CG-CG 4.1Å; W150-M187 CarbonylContact C-O 3.54Å; W150-M187 VanDerWaalsContact CA-O 3.31Å; W150-M187 WeakPolarHBondContact CA-O 3.31Å; A151-M187 PolarHBondContact N-O 2.88Å; A151-M187 PolarHBondContact O-N 3.44Å; Q153-M187 HydrophobicContact CG-CE 3.79Å; Q153-M187 HydrophobicContact CG-CG 4.26Å; Q153-M187 PolarHBondContact NE2-SD 2.93Å
188	L	85.9	Confident	76.5	Confident	6 Å²	6	75.1 Å²	75.1	3%	0.031	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.9	173.5	176.2	64.4	0	0	0	108.8	C118 L119 G149 W150 L190 Y193	C118-L188 CarbonylContact C-O 3.56Å; C118-L188 VanDerWaalsContact CA-O 3.29Å; C118-L188 WeakPolarHBondContact CA-O 3.37Å; L119-L188 HydrophobicContact CB-CB 4.19Å; L119-L188 HydrophobicContact CD2-CD2 4.23Å; L119-L188 PolarHBondContact N-O 3.36Å; L119-L188 PolarHBondContact O-N 3.11Å; G149-L188 WeakPolarHBondContact O-CD1 3.41Å; W150-L188 HydrophobicContact CD2-CB 3.89Å; W150-L188 HydrophobicContact CD2-CD1 3.97Å; W150-L188 HydrophobicContact CD2-CG 4.37Å; W150-L188 HydrophobicContact CE3-CB 3.76Å; W150-L188 HydrophobicContact CG-CD1 3.92Å; W150-L188 HydrophobicContact CH2-CB 4.11Å; W150-L188 HydrophobicContact CH2-CD2 4.18Å; W150-L188 HydrophobicContact CZ2-CB 4.25Å; W150-L188 HydrophobicContact CZ2-CD2 3.77Å; W150-L188 HydrophobicContact CZ2-CG 4.41Å; W150-L188 HydrophobicContact CZ3-CB 3.87Å; L188-L190 HydrophobicContact CD2-CD2 3.91Å; L188-L190 HydrophobicContact CG-CD2 4.28Å; L188-L190 PolarHBondContact O-N 3.14Å; L188-Y193 HydrophobicContact CD1-CD2 3.51Å; L188-Y193 HydrophobicContact CD1-CE2 3.96Å; L188-Y193 HydrophobicContact CD1-CG 4.02Å; L188-Y193 HydrophobicContact CD2-CD2 4.46Å; L188-Y193 HydrophobicContact CD2-CG 4.4Å; L188-Y193 HydrophobicContact CG-CD2 4.45Å
189	D	80.4	Confident	74.1	Confident	50 Å²	50	81.8 Å²	81.8	27%	0.267	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	106.6	171.4	-176.1	-9.8	0	0	0	109.9	K191 H192 Y193	D189-K191 PolarHBondContact O-N 3.16Å; D189-K191 VanDerWaalsContact OD1-CB 3.3Å; D189-K191 WeakPolarHBondContact OD1-CB 3.41Å; D189-K191 PolarHBondContact OD1-N 3.19Å; D189-H192 PolarHBondContact O-N 2.78Å; D189-H192 IonicContact OD1-ND1 2.9Å; D189-H192 IonicContact OD2-CE1 2.63Å; D189-H192 IonicContact OD2-CG 3.35Å; D189-H192 IonicContact OD2-ND1 2.84Å; D189-H192 PolarHBondContact OD2-ND1 3.35Å; D189-Y193 WeakPolarHBondContact O-CB 3.49Å; D189-Y193 PolarHBondContact O-N 2.79Å; D189-Y193 VanDerWaalsContact O-N 3.12Å
190	L	77.5	Confident	72.4	Confident	93 Å²	93	82.9 Å²	82.9	49%	0.487	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.9	-178.6	-56.5	168.5	0	0	0	112.3	G117 L119 L188	G117-L190 WeakPolarHBondContact O-CA 2.95Å; G117-L190 WeakPolarHBondContact O-CB 3.39Å; G117-L190 WeakPolarHBondContact O-CG 3.11Å; G117-L190 PolarHBondContact O-N 3.09Å; L119-L190 HydrophobicContact CB-CD1 4.42Å; L119-L190 HydrophobicContact CB-CD2 4.25Å; L119-L190 HydrophobicContact CB-CG 4.39Å; L188-L190 HydrophobicContact CD2-CD2 3.91Å; L188-L190 HydrophobicContact CG-CD2 4.28Å; L188-L190 PolarHBondContact O-N 3.14Å
191	K	72.4	Confident	71.5	Confident	150 Å²	150	85.3 Å²	85.3	65%	0.652	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-34.3	178.8	-63.7	172.8	176.6	160.8	0	111.8	E116 D189	E116-K191 PolarHBondContact O-NZ 3.43Å; E116-K191 VanDerWaalsContact O-NZ 3.12Å; D189-K191 PolarHBondContact O-N 3.16Å; D189-K191 VanDerWaalsContact OD1-CB 3.3Å; D189-K191 WeakPolarHBondContact OD1-CB 3.41Å; D189-K191 PolarHBondContact OD1-N 3.19Å
192	H	65.3	Low	71.1	Confident	150 Å²	150	83.7 Å²	83.7	69%	0.694	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-8.6	-180	-66.6	95.7	0	0	0	113.6	D189 K194	D189-H192 PolarHBondContact O-N 2.78Å; D189-H192 IonicContact OD1-ND1 2.9Å; D189-H192 IonicContact OD2-CE1 2.63Å; D189-H192 IonicContact OD2-CG 3.35Å; D189-H192 IonicContact OD2-ND1 2.84Å; D189-H192 PolarHBondContact OD2-ND1 3.35Å; H192-K194 PolarHBondContact O-N 3.15Å; H192-K194 VanDerWaalsContact O-N 3.15Å
193	Y	64.1	Low	71	Confident	43 Å²	43	83.2 Å²	83.2	17%	0.169	41%	0.408	C	S	.	.			trans	-72.8	106.3	179.8	-166.4	-111.4	0	0	0	111.6	L188 D189 V195 P200 E201	L188-Y193 HydrophobicContact CD1-CD2 3.51Å; L188-Y193 HydrophobicContact CD1-CE2 3.96Å; L188-Y193 HydrophobicContact CD1-CG 4.02Å; L188-Y193 HydrophobicContact CD2-CD2 4.46Å; L188-Y193 HydrophobicContact CD2-CG 4.4Å; L188-Y193 HydrophobicContact CG-CD2 4.45Å; D189-Y193 WeakPolarHBondContact O-CB 3.49Å; D189-Y193 PolarHBondContact O-N 2.79Å; D189-Y193 VanDerWaalsContact O-N 3.12Å; Y193-V195 HydrophobicContact CD1-CG2 3.93Å; Y193-V195 HydrophobicContact CE1-CG2 3.92Å; Y193-V195 PolarHBondContact O-N 3.04Å; Y193-P200 HydrophobicContact CE1-CB 3.87Å; Y193-P200 VanDerWaalsContact OH-C 3.26Å; Y193-P200 WeakPolarHBondContact OH-CA 3.46Å; Y193-P200 WeakPolarHBondContact OH-CB 3.3Å; Y193-E201 PolarHBondContact OH-N 3.36Å; Y193-E201 VanDerWaalsContact OH-N 3.16Å; Y193-E201 PolarHBondContact OH-O 2.89Å; Y193-E201 VanDerWaalsContact OH-O 3.09Å
194	K	56.5	Low	70.9	Confident	192 Å²	192	78.5 Å²	78.5	84%	0.835	39%	0.387	S	S	*	.			trans	-86.3	107	168.7	-69.2	-173.3	177.4	-176	0	108.7	H192 S196	H192-K194 PolarHBondContact O-N 3.15Å; H192-K194 VanDerWaalsContact O-N 3.15Å; K194-S196 PolarHBondContact O-N 2.95Å; K194-S196 VanDerWaalsContact O-N 3.16Å
195	V	54.4	Low	70.7	Confident	89 Å²	89	78.7 Å²	78.7	54%	0.539	39%	0.388	S	S	.	.			trans	-61.2	115.8	167.8	-178.4	0	0	0	0	107.1	Y193	Y193-V195 HydrophobicContact CD1-CG2 3.93Å; Y193-V195 HydrophobicContact CE1-CG2 3.92Å; Y193-V195 PolarHBondContact O-N 3.04Å
196	S	52.3	Low	70.6	Confident	68 Å²	68	79.4 Å²	79.4	48%	0.476	39%	0.391	S	S	.	.			trans	-68.9	127.7	159.8	179.6	0	0	0	0	106.9	K194 E198 H199	K194-S196 PolarHBondContact O-N 2.95Å; K194-S196 VanDerWaalsContact O-N 3.16Å; S196-E198 PolarHBondContact O-N 2.79Å; S196-E198 PolarHBondContact OG-N 3.28Å; S196-H199 CarbonylContact O-C 3.59Å; S196-H199 PolarHBondContact O-N 2.7Å
197	D	47.8	Very low	70.3	Confident	168 Å²	168	80.5 Å²	80.5	90%	0.898	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.1	174.5	-70.3	-37.4	0	0	0	111.8
198	E	45.6	Very low	70.1	Confident	166 Å²	166	78.8 Å²	78.8	78%	0.776	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	24.5	178.1	-62.2	-172.6	179.6	0	0	114.4	S196	S196-E198 PolarHBondContact O-N 2.79Å; S196-E198 PolarHBondContact OG-N 3.28Å
199	H	43.8	Very low	70.1	Confident	150 Å²	150	78.6 Å²	78.6	69%	0.694	39%	0.39	S	S	*	.			trans	123.2	122.7	168	-66.9	47.8	0	0	0	111.5	S196 E201	S196-H199 CarbonylContact O-C 3.59Å; S196-H199 PolarHBondContact O-N 2.7Å; H199-E201 PolarHBondContact O-N 3.05Å
200	P	53.3	Low	70.2	Confident	53 Å²	53	77.5 Å²	77.5	34%	0.344	38%	0.384	S	S	.	.			trans	-63.4	120.8	166.4	24	-29.5	0	0	0	109.5	Y193 W202	Y193-P200 HydrophobicContact CE1-CB 3.87Å; Y193-P200 VanDerWaalsContact OH-C 3.26Å; Y193-P200 WeakPolarHBondContact OH-CA 3.46Å; Y193-P200 WeakPolarHBondContact OH-CB 3.3Å; P200-W202 PolarHBondContact O-N 2.85Å; P200-W202 VanDerWaalsContact O-N 3.14Å
201	E	73.6	Confident	70.3	Confident	94 Å²	94	73.1 Å²	73.1	44%	0.439	36%	0.361	S	S	.	.			trans	-62.1	116.8	175.9	-58.2	-177.1	161.9	0	0	108.6	P147 K148 W150 Y193 H199	P147-E201 HydrophobicContact CB-CB 3.37Å; P147-E201 HydrophobicContact CB-CG 4.44Å; P147-E201 HydrophobicContact CG-CB 3.86Å; P147-E201 WeakPolarHBondContact CG-O 3.22Å; K148-E201 PolarHBondContact N-OE2 2.75Å; W150-E201 PolarHBondContact NE1-O 2.84Å; Y193-E201 PolarHBondContact OH-N 3.36Å; Y193-E201 VanDerWaalsContact OH-N 3.16Å; Y193-E201 PolarHBondContact OH-O 2.89Å; Y193-E201 VanDerWaalsContact OH-O 3.09Å; H199-E201 PolarHBondContact O-N 3.05Å
202	W	83.3	Confident	70.5	Confident	46 Å²	46	67.8 Å²	67.8	17%	0.174	34%	0.339	C	S	.	.			trans	-107.5	149.6	-179.6	-165.7	-102.4	0	0	0	110.8	L119 I121 P147 W150 P200 L228 R230	L119-W202 HydrophobicContact CD2-CH2 4.39Å; I121-W202 HydrophobicContact CD1-CH2 3.78Å; I121-W202 HydrophobicContact CD1-CZ2 3.71Å; P147-W202 WeakPolarHBondContact CG-O 3.14Å; W150-W202 HydrophobicContact CH2-CE3 4.23Å; W150-W202 AromaticContact CH2-CH2 3.93Å; W150-W202 HydrophobicContact CH2-CH2 3.93Å; W150-W202 HydrophobicContact CH2-CZ2 4.4Å; W150-W202 AromaticContact CH2-CZ3 3.83Å; W150-W202 HydrophobicContact CH2-CZ3 3.83Å; W150-W202 HydrophobicContact CZ2-CD2 4.26Å; W150-W202 AromaticContact CZ2-CE3 3.67Å; W150-W202 HydrophobicContact CZ2-CE3 3.67Å; W150-W202 HydrophobicContact CZ2-CH2 4.2Å; W150-W202 AromaticContact CZ2-CZ3 3.64Å; W150-W202 HydrophobicContact CZ2-CZ3 3.64Å; P200-W202 PolarHBondContact O-N 2.85Å; P200-W202 VanDerWaalsContact O-N 3.14Å; W202-L228 PolarHBondContact NE1-O 3.44Å; W202-R230 HydrophobicContact CD2-CG 4.28Å; W202-R230 HydrophobicContact CZ2-CB 4.33Å; W202-R230 HydrophobicContact CZ2-CG 4.06Å
203	P	88.7	Confident	71	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.			trans	-60.8	138.1	-178.6	-22.5	33	0	0	0	114.1	L144 E145 W150 L186 L228	L144-P203 HydrophobicContact CD1-CB 4.35Å; E145-P203 WeakPolarHBondContact O-CA 3.23Å; W150-P203 HydrophobicContact CD2-CG 3.9Å; W150-P203 HydrophobicContact CE3-CG 4.04Å; W150-P203 HydrophobicContact CH2-CG 4.13Å; W150-P203 HydrophobicContact CZ2-CG 3.98Å; W150-P203 HydrophobicContact CZ3-CG 4.15Å; L186-P203 HydrophobicContact CD1-CB 3.85Å; L186-P203 HydrophobicContact CD1-CG 3.68Å; P203-L228 HydrophobicContact CB-CD1 3.76Å; P203-L228 HydrophobicContact CB-CG 4Å; P203-L228 HydrophobicContact CG-CD1 4.42Å; P203-L228 PolarHBondContact O-N 2.89Å; P203-L228 VanDerWaalsContact O-N 3.11Å
204	L	86.3	Confident	71.4	Confident	35 Å²	35	65.5 Å²	65.5	18%	0.183	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130	-176.5	-64.9	-180	0	0	0	110.8	E145 F206 Y225 V226 E227	E145-L204 PolarHBondContact N-O 2.82Å; E145-L204 PolarHBondContact O-N 2.84Å; L204-F206 HydrophobicContact CB-CD2 4.42Å; L204-F206 HydrophobicContact CB-CE2 3.79Å; L204-F206 HydrophobicContact CB-CZ 4.23Å; L204-F206 HydrophobicContact CD1-CE2 4.28Å; L204-F206 HydrophobicContact CD1-CZ 4Å; L204-Y225 HydrophobicContact CD1-CD2 4.48Å; L204-Y225 HydrophobicContact CD2-CD2 4.14Å; L204-V226 WeakPolarHBondContact CA-O 3.04Å; L204-E227 HydrophobicContact CD2-CB 4.25Å; L204-E227 HydrophobicContact CD2-CG 3.39Å
205	L	87.2	Confident	71.9	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.063	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.3	170.6	-179.5	66.1	0	0	0	109.3	Y142 L144 L182 F184 I207 Y225 V226 L228	Y142-L205 HydrophobicContact CD2-CD1 4.25Å; L144-L205 HydrophobicContact CB-CD1 4.49Å; L182-L205 HydrophobicContact CD1-CD2 3.8Å; F184-L205 HydrophobicContact CE2-CD1 4.04Å; F184-L205 HydrophobicContact CZ-CD1 4.16Å; L205-I207 HydrophobicContact CD2-CD1 4.25Å; L205-I207 HydrophobicContact CD2-CG1 4.5Å; L205-I207 HydrophobicContact CG-CD1 4.46Å; L205-I207 HydrophobicContact CG-CG1 4.21Å; L205-Y225 CarbonylContact O-C 3.55Å; L205-Y225 VanDerWaalsContact O-CA 3.27Å; L205-Y225 WeakPolarHBondContact O-CA 3.41Å; L205-V226 HydrophobicContact CB-CG1 3.93Å; L205-V226 HydrophobicContact CD2-CG1 4.3Å; L205-V226 HydrophobicContact CG-CG1 4.48Å; L205-V226 PolarHBondContact N-O 2.88Å; L205-V226 PolarHBondContact O-N 3.08Å; L205-L228 HydrophobicContact CB-CD2 4.22Å
206	F	86.2	Confident	72.6	Confident	46 Å²	46	61.6 Å²	61.6	20%	0.202	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	139.9	171.9	-69.1	-86	0	0	0	110.4	Y142 C143 E145 L204 Y225 F349	Y142-F206 CarbonylContact C-O 3.53Å; Y142-F206 WeakPolarHBondContact CA-O 3.5Å; C143-F206 HydrophobicContact CB-CB 4.23Å; C143-F206 PolarHBondContact N-O 2.92Å; C143-F206 PolarHBondContact O-N 2.81Å; E145-F206 HydrophobicContact CB-CD2 4.1Å; E145-F206 HydrophobicContact CB-CE2 3.76Å; E145-F206 VanDerWaalsContact OE2-CE2 3.31Å; E145-F206 WeakPolarHBondContact OE2-CE2 3.15Å; L204-F206 HydrophobicContact CB-CD2 4.42Å; L204-F206 HydrophobicContact CB-CE2 3.79Å; L204-F206 HydrophobicContact CB-CZ 4.23Å; L204-F206 HydrophobicContact CD1-CE2 4.28Å; L204-F206 HydrophobicContact CD1-CZ 4Å; F206-Y225 HydrophobicContact CE1-CD1 4.26Å; F206-Y225 HydrophobicContact CE1-CG 4.05Å; F206-F349 HydrophobicContact CE1-CE1 4.3Å; F206-F349 AromaticContact CE1-CZ 3.89Å; F206-F349 HydrophobicContact CE1-CZ 3.89Å; F206-F349 HydrophobicContact CE2-CE2 4.26Å; F206-F349 AromaticContact CE2-CZ 3.83Å; F206-F349 HydrophobicContact CE2-CZ 3.83Å; F206-F349 HydrophobicContact CZ-CE1 4.02Å; F206-F349 AromaticContact CZ-CE2 3.85Å; F206-F349 HydrophobicContact CZ-CE2 3.85Å; F206-F349 AromaticContact CZ-CZ 3.21Å; F206-F349 HydrophobicContact CZ-CZ 3.21Å
207	I	85.3	Confident	73	Confident	24 Å²	24	64 Å²	64	12%	0.123	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	125.6	-177.4	-62.7	-176.5	0	0	0	108	I140 L205 Y223 G224 L239 I241	I140-I207 HydrophobicContact CG2-CG2 3.58Å; L205-I207 HydrophobicContact CD2-CD1 4.25Å; L205-I207 HydrophobicContact CD2-CG1 4.5Å; L205-I207 HydrophobicContact CG-CD1 4.46Å; L205-I207 HydrophobicContact CG-CG1 4.21Å; I207-Y223 CarbonylContact O-C 3.54Å; I207-Y223 WeakPolarHBondContact O-CA 3.48Å; I207-Y223 WeakPolarHBondContact O-CB 3.06Å; I207-G224 PolarHBondContact N-O 2.95Å; I207-G224 PolarHBondContact O-N 3.34Å; I207-L239 HydrophobicContact CB-CD2 4.02Å; I207-L239 HydrophobicContact CD1-CD2 4.03Å; I207-L239 HydrophobicContact CG1-CD2 4.37Å; I207-I241 HydrophobicContact CG2-CD1 4.21Å
208	A	83.2	Confident	74.1	Confident	20 Å²	20	62.2 Å²	62.2	17%	0.165	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.9	171.8	0	0	0	0	0	109.6	I140 E141 L220	I140-A208 CarbonylContact C-O 3.32Å; I140-A208 WeakPolarHBondContact CA-O 3.37Å; E141-A208 HydrophobicContact CB-CB 4.41Å; E141-A208 PolarHBondContact N-O 2.79Å; E141-A208 PolarHBondContact O-N 2.8Å; A208-L220 HydrophobicContact CB-CD1 4.14Å
209	V	85.4	Confident	75.3	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.9	177.7	-177	0	0	0	0	108.3	F133 L138 I140 E221 G222 I241	F133-V209 HydrophobicContact CD1-CG1 4.05Å; F133-V209 HydrophobicContact CD2-CG1 4.25Å; F133-V209 HydrophobicContact CE1-CB 3.96Å; F133-V209 HydrophobicContact CE1-CG1 3.89Å; F133-V209 HydrophobicContact CE1-CG2 4.15Å; F133-V209 HydrophobicContact CE2-CG1 4.12Å; F133-V209 HydrophobicContact CE2-CG2 4.22Å; F133-V209 HydrophobicContact CG-CG1 4.2Å; F133-V209 HydrophobicContact CZ-CB 3.99Å; F133-V209 HydrophobicContact CZ-CG1 3.93Å; F133-V209 HydrophobicContact CZ-CG2 3.67Å; L138-V209 HydrophobicContact CD1-CG1 4.43Å; L138-V209 HydrophobicContact CD2-CG1 4.36Å; I140-V209 HydrophobicContact CG1-CG2 4.21Å; V209-E221 HydrophobicContact CB-CB 4.29Å; V209-E221 HydrophobicContact CG1-CB 4.07Å; V209-E221 HydrophobicContact CG1-CG 4.42Å; V209-E221 WeakPolarHBondContact O-CB 3.19Å; V209-E221 PolarHBondContact O-N 3.3Å; V209-G222 PolarHBondContact N-O 3.03Å; V209-G222 PolarHBondContact O-N 3.42Å; V209-I241 HydrophobicContact CG2-CD1 3.47Å; V209-I241 VanDerWaalsContact CG2-CD1 3.47Å
210	M	81.4	Confident	76.9	Confident	26 Å²	26	51.4 Å²	51.4	13%	0.128	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148	-176.9	-59.5	-66	-69.7	0	0	110.2	L138 F139 E141 R219 L220	L138-M210 CarbonylContact C-O 3.55Å; L138-M210 WeakPolarHBondContact CA-O 3.36Å; F139-M210 HydrophobicContact CD1-CB 3.77Å; F139-M210 HydrophobicContact CD2-CB 3.94Å; F139-M210 HydrophobicContact CD2-CG 4.39Å; F139-M210 HydrophobicContact CE1-CB 3.28Å; F139-M210 HydrophobicContact CE1-CG 4.34Å; F139-M210 HydrophobicContact CE2-CB 3.5Å; F139-M210 HydrophobicContact CE2-CG 3.74Å; F139-M210 HydrophobicContact CG-CB 4.09Å; F139-M210 HydrophobicContact CZ-CB 3.16Å; F139-M210 HydrophobicContact CZ-CE 4.42Å; F139-M210 HydrophobicContact CZ-CG 3.72Å; F139-M210 PolarHBondContact N-O 3.46Å; F139-M210 WeakPolarHBondContact O-CA 3.2Å; F139-M210 PolarHBondContact O-N 3.03Å; F139-M210 VanDerWaalsContact O-O 3.09Å; E141-M210 HydrophobicContact CG-CG 4.22Å; M210-R219 CarbonylContact C-O 3.57Å; M210-R219 WeakPolarHBondContact CA-O 3.39Å; M210-L220 VanDerWaalsContact SD-CA 3.57Å; M210-L220 HydrophobicContact SD-CB 3.89Å; M210-L220 HydrophobicContact SD-CD1 3.64Å; M210-L220 HydrophobicContact SD-CG 4.39Å
211	S	80	Confident	78	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.014	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	149.9	170.5	71	0	0	0	0	111.1	Y218 R219 E221	S211-Y218 CarbonylContact O-C 3.56Å; S211-Y218 WeakPolarHBondContact O-CA 3.49Å; S211-R219 PolarHBondContact N-O 3.12Å; S211-R219 PolarHBondContact O-N 2.94Å; S211-R219 WeakPolarHBondContact OG-CB 3.39Å; S211-E221 VanDerWaalsContact CB-OE1 3.23Å; S211-E221 WeakPolarHBondContact CB-OE1 3.38Å; S211-E221 PolarHBondContact OG-OE1 3.05Å
212	M	76	Confident	78.1	Confident	37 Å²	37	44.7 Å²	44.7	18%	0.182	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.1	175.3	-169.1	178.2	70.8	0	0	111.2	N137 F139 L163 R217 Y218	N137-M212 VanDerWaalsContact CB-O 3.29Å; N137-M212 WeakPolarHBondContact CB-O 3.24Å; N137-M212 PolarHBondContact ND2-O 3.45Å; N137-M212 PolarHBondContact O-N 3.15Å; F139-M212 HydrophobicContact CE1-CB 4.39Å; L163-M212 HydrophobicContact CD1-CE 3.25Å; L163-M212 HydrophobicContact CD1-SD 4.23Å; L163-M212 HydrophobicContact CD2-CB 3.86Å; L163-M212 HydrophobicContact CD2-CE 4.04Å; L163-M212 HydrophobicContact CG-CE 4.29Å; M212-R217 WeakPolarHBondContact CA-O 3.44Å; M212-Y218 HydrophobicContact CB-CD1 4.41Å; M212-Y218 HydrophobicContact CG-CD1 4.26Å; M212-Y218 HydrophobicContact CG-CE1 4.1Å; M212-Y218 HydrophobicContact SD-CD1 4.36Å; M212-Y218 HydrophobicContact SD-CE1 3.62Å
213	D	76.4	Confident	77.9	Confident	28 Å²	28	48 Å²	48	15%	0.15	24%	0.242	C	C	.	.			trans	-86.4	172.9	175.9	67.5	25.5	0	0	0	113.4	L215 S216 R217 R219	D213-L215 PolarHBondContact O-N 2.84Å; D213-L215 WeakPolarHBondContact OD1-CA 3.43Å; D213-L215 PolarHBondContact OD1-N 2.92Å; D213-L215 VanDerWaalsContact OD1-N 3.08Å; D213-S216 WeakPolarHBondContact O-CA 3.47Å; D213-S216 PolarHBondContact O-N 3.16Å; D213-S216 PolarHBondContact OD1-N 3.48Å; D213-R217 PolarHBondContact N-O 3.28Å; D213-R217 VanDerWaalsContact OD1-CB 3.31Å; D213-R217 WeakPolarHBondContact OD1-CB 3.19Å; D213-R217 PolarHBondContact OD1-N 3.42Å; D213-R217 IonicContact OD1-NE 3.83Å; D213-R217 PolarHBondContact OD1-NE 2.56Å; D213-R217 IonicContact OD2-CZ 2.68Å; D213-R217 IonicContact OD2-NE 3.68Å; D213-R217 PolarHBondContact OD2-NE 2.81Å; D213-R217 IonicContact OD2-NH2 2.65Å; D213-R217 PolarHBondContact OD2-NH2 3.4Å; D213-R219 IonicContact OD2-CZ 2.95Å; D213-R219 IonicContact OD2-NE 3.4Å; D213-R219 IonicContact OD2-NH2 2.57Å; D213-R219 PolarHBondContact OD2-NH2 2.84Å
214	S	72.3	Confident	77.3	Confident	117 Å²	117	48.5 Å²	48.5	82%	0.818	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-11.7	179.7	53.2	0	0	0	0	114.4	S216	S214-S216 VanDerWaalsContact C-N 3.33Å
215	L	67.5	Low	77.2	Confident	121 Å²	121	53.6 Å²	53.6	63%	0.634	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	13.5	172.9	-76.8	80.2	0	0	0	111.8	D213 R217	D213-L215 PolarHBondContact O-N 2.84Å; D213-L215 WeakPolarHBondContact OD1-CA 3.43Å; D213-L215 PolarHBondContact OD1-N 2.92Å; D213-L215 VanDerWaalsContact OD1-N 3.08Å; L215-R217 HydrophobicContact CB-CG 4.17Å; L215-R217 PolarHBondContact O-N 3.26Å
216	S	69.4	Low	77.1	Confident	79 Å²	79	54.5 Å²	54.5	55%	0.552	27%	0.27	S	S	*	.			trans	56.5	33.8	-177.3	-46.9	0	0	0	0	112.7	D213 S214	D213-S216 WeakPolarHBondContact O-CA 3.47Å; D213-S216 PolarHBondContact O-N 3.16Å; D213-S216 PolarHBondContact OD1-N 3.48Å; S214-S216 VanDerWaalsContact C-N 3.33Å
217	R	61	Low	77.1	Confident	118 Å²	118	56.4 Å²	56.4	45%	0.445	28%	0.28	S	S	.	.			trans	-91.5	124.5	172.9	-55.7	-179.6	-64.8	-178.9	-2	109.1	M212 D213 L215	M212-R217 WeakPolarHBondContact CA-O 3.44Å; D213-R217 PolarHBondContact N-O 3.28Å; D213-R217 VanDerWaalsContact OD1-CB 3.31Å; D213-R217 WeakPolarHBondContact OD1-CB 3.19Å; D213-R217 PolarHBondContact OD1-N 3.42Å; D213-R217 IonicContact OD1-NE 3.83Å; D213-R217 PolarHBondContact OD1-NE 2.56Å; D213-R217 IonicContact OD2-CZ 2.68Å; D213-R217 IonicContact OD2-NE 3.68Å; D213-R217 PolarHBondContact OD2-NE 2.81Å; D213-R217 IonicContact OD2-NH2 2.65Å; D213-R217 PolarHBondContact OD2-NH2 3.4Å; L215-R217 HydrophobicContact CB-CG 4.17Å; L215-R217 PolarHBondContact O-N 3.26Å
218	Y	70	Confident	77.2	Confident	131 Å²	131	55.5 Å²	55.5	51%	0.514	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138.7	175.6	-57	-81.6	0	0	0	110.6	F139 S211 M212	F139-Y218 AromaticContact CE1-CD1 3.59Å; F139-Y218 HydrophobicContact CE1-CD1 3.59Å; F139-Y218 HydrophobicContact CE1-CE1 4.04Å; F139-Y218 AromaticContact CZ-CD1 3.5Å; F139-Y218 HydrophobicContact CZ-CD1 3.5Å; F139-Y218 AromaticContact CZ-CE1 3.98Å; F139-Y218 HydrophobicContact CZ-CE1 3.98Å; S211-Y218 CarbonylContact O-C 3.56Å; S211-Y218 WeakPolarHBondContact O-CA 3.49Å; M212-Y218 HydrophobicContact CB-CD1 4.41Å; M212-Y218 HydrophobicContact CG-CD1 4.26Å; M212-Y218 HydrophobicContact CG-CE1 4.1Å; M212-Y218 HydrophobicContact SD-CD1 4.36Å; M212-Y218 HydrophobicContact SD-CE1 3.62Å
219	R	71.4	Confident	77.3	Confident	40 Å²	40	56.7 Å²	56.7	15%	0.151	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.4	175.7	-44.4	-171.3	178.2	170.5	8.7	109.7	Y135 M210 S211 D213 R269	Y135-R219 VanDerWaalsContact CE1-NH1 3.26Å; Y135-R219 PolarHBondContact OH-NH1 3.44Å; M210-R219 CarbonylContact C-O 3.57Å; M210-R219 WeakPolarHBondContact CA-O 3.39Å; S211-R219 PolarHBondContact N-O 3.12Å; S211-R219 PolarHBondContact O-N 2.94Å; S211-R219 WeakPolarHBondContact OG-CB 3.39Å; D213-R219 IonicContact OD2-CZ 2.95Å; D213-R219 IonicContact OD2-NE 3.4Å; D213-R219 IonicContact OD2-NH2 2.57Å; D213-R219 PolarHBondContact OD2-NH2 2.84Å; R219-R269 VanDerWaalsContact CB-NH1 3.31Å; R219-R269 VanDerWaalsContact CG-NH1 3.26Å
220	L	76.5	Confident	77.2	Confident	48 Å²	48	63.6 Å²	63.6	25%	0.251	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116.6	169.5	178.2	66.8	0	0	0	109	A208 M210 G222 Y223 L272	A208-L220 HydrophobicContact CB-CD1 4.14Å; M210-L220 VanDerWaalsContact SD-CA 3.57Å; M210-L220 HydrophobicContact SD-CB 3.89Å; M210-L220 HydrophobicContact SD-CD1 3.64Å; M210-L220 HydrophobicContact SD-CG 4.39Å; L220-G222 WeakPolarHBondContact CD1-O 3.31Å; L220-Y223 HydrophobicContact CD2-CD1 4.08Å; L220-L272 HydrophobicContact CD2-CD2 4.4Å
221	E	77.3	Confident	77	Confident	7 Å²	7	65.2 Å²	65.2	3%	0.033	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-34.4	176.6	-60.7	-63.1	138.2	0	0	111.1	F133 Y135 L138 V209 S211 H243 M244	F133-E221 HydrophobicContact CD1-CB 3.64Å; F133-E221 HydrophobicContact CD1-CG 4.45Å; F133-E221 HydrophobicContact CE1-CB 4.07Å; Y135-E221 WeakPolarHBondContact CD2-OE1 3.24Å; L138-E221 HydrophobicContact CD2-CG 4.06Å; V209-E221 HydrophobicContact CB-CB 4.29Å; V209-E221 HydrophobicContact CG1-CB 4.07Å; V209-E221 HydrophobicContact CG1-CG 4.42Å; V209-E221 WeakPolarHBondContact O-CB 3.19Å; V209-E221 PolarHBondContact O-N 3.3Å; S211-E221 VanDerWaalsContact CB-OE1 3.23Å; S211-E221 WeakPolarHBondContact CB-OE1 3.38Å; S211-E221 PolarHBondContact OG-OE1 3.05Å; E221-H243 IonicContact OE2-NE2 3.46Å; E221-M244 PolarHBondContact O-N 2.89Å
222	G	74.3	Confident	77	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.4	171.9	172.4	0	0	0	0	0	112.2	V209 L220 I241	V209-G222 PolarHBondContact N-O 3.03Å; V209-G222 PolarHBondContact O-N 3.42Å; L220-G222 WeakPolarHBondContact CD1-O 3.31Å; G222-I241 VanDerWaalsContact C-CG2 3.42Å
223	Y	80.8	Confident	77	Confident	116 Å²	116	71.4 Å²	71.4	46%	0.455	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160.7	174.2	62.6	-94.6	0	0	0	111.2	I207 L220 M244 L272	I207-Y223 CarbonylContact O-C 3.54Å; I207-Y223 WeakPolarHBondContact O-CA 3.48Å; I207-Y223 WeakPolarHBondContact O-CB 3.06Å; L220-Y223 HydrophobicContact CD2-CD1 4.08Å; Y223-M244 HydrophobicContact CD1-CE 4Å; Y223-M244 HydrophobicContact CE1-CE 3.26Å; Y223-L272 HydrophobicContact CE1-CD1 4.19Å
224	G	74.7	Confident	77.1	Confident	10 Å²	10	75.9 Å²	75.9	10%	0.103	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	-176	174	0	0	0	0	0	110.8	I207	I207-G224 PolarHBondContact N-O 2.95Å; I207-G224 PolarHBondContact O-N 3.34Å
225	Y	84	Confident	77.6	Confident	142 Å²	142	73.9 Å²	73.9	56%	0.557	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.7	174.5	66.8	-89.3	0	0	0	109.6	L204 L205 F206 L239	L204-Y225 HydrophobicContact CD1-CD2 4.48Å; L204-Y225 HydrophobicContact CD2-CD2 4.14Å; L205-Y225 CarbonylContact O-C 3.55Å; L205-Y225 VanDerWaalsContact O-CA 3.27Å; L205-Y225 WeakPolarHBondContact O-CA 3.41Å; F206-Y225 HydrophobicContact CE1-CD1 4.26Å; F206-Y225 HydrophobicContact CE1-CG 4.05Å; Y225-L239 VanDerWaalsContact O-CD1 3.26Å; Y225-L239 WeakPolarHBondContact O-CD1 3.48Å
226	V	85.7	Confident	78.5	Confident	31 Å²	31	71.8 Å²	71.8	19%	0.188	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.7	174.9	70.8	0	0	0	0	110.2	L204 L205	L204-V226 WeakPolarHBondContact CA-O 3.04Å; L205-V226 HydrophobicContact CB-CG1 3.93Å; L205-V226 HydrophobicContact CD2-CG1 4.3Å; L205-V226 HydrophobicContact CG-CG1 4.48Å; L205-V226 PolarHBondContact N-O 2.88Å; L205-V226 PolarHBondContact O-N 3.08Å
227	E	87.1	Confident	79.2	Confident	85 Å²	85	72.3 Å²	72.3	40%	0.397	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	139.4	171.3	-76.3	-179.5	-156.3	0	0	109.9	L204 R230	L204-E227 HydrophobicContact CD2-CB 4.25Å; L204-E227 HydrophobicContact CD2-CG 3.39Å; E227-R230 IonicContact OE1-NH2 2.68Å; E227-R230 IonicContact OE2-CZ 2.73Å; E227-R230 IonicContact OE2-NE 3.9Å; E227-R230 PolarHBondContact OE2-NE 2.93Å; E227-R230 IonicContact OE2-NH2 2.72Å; E227-R230 PolarHBondContact OE2-NH2 3.07Å
228	L	87.3	Confident	80.4	Confident	6 Å²	6	74.1 Å²	74.1	3%	0.031	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-60.1	142.4	169.7	-63.4	-165.8	0	0	0	110.1	L123 L144 L186 W202 P203 L205 R230	L123-L228 HydrophobicContact CD1-CB 4.25Å; L123-L228 HydrophobicContact CD1-CD1 4.02Å; L123-L228 HydrophobicContact CD1-CD2 3.65Å; L123-L228 HydrophobicContact CD1-CG 4.17Å; L144-L228 HydrophobicContact CD1-CD1 3.97Å; L144-L228 HydrophobicContact CD1-CD2 4.08Å; L144-L228 HydrophobicContact CD1-CG 4.17Å; L186-L228 HydrophobicContact CD1-CD1 3.64Å; W202-L228 PolarHBondContact NE1-O 3.44Å; P203-L228 HydrophobicContact CB-CD1 3.76Å; P203-L228 HydrophobicContact CB-CG 4Å; P203-L228 HydrophobicContact CG-CD1 4.42Å; P203-L228 PolarHBondContact O-N 2.89Å; P203-L228 VanDerWaalsContact O-N 3.11Å; L205-L228 HydrophobicContact CB-CD2 4.22Å; L228-R230 PolarHBondContact O-N 3.2Å
229	P	85.2	Confident	81	Confident	44 Å²	44	70.7 Å²	70.7	29%	0.286	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-52.8	130.3	176.6	-25.3	33.7	0	0	0	111.7	V235	P229-V235 HydrophobicContact CB-CG2 4.31Å; P229-V235 HydrophobicContact CG-CB 4.36Å; P229-V235 HydrophobicContact CG-CG2 4.48Å
230	R	82.8	Confident	81.4	Confident	148 Å²	148	80 Å²	80	56%	0.558	41%	0.409	S	S	*	.	S	Bend	trans	-84.1	-21	178.6	-60.5	-175	-173.1	-160.5	2.4	113	W202 E227 L228	W202-R230 HydrophobicContact CD2-CG 4.28Å; W202-R230 HydrophobicContact CZ2-CB 4.33Å; W202-R230 HydrophobicContact CZ2-CG 4.06Å; E227-R230 IonicContact OE1-NH2 2.68Å; E227-R230 IonicContact OE2-CZ 2.73Å; E227-R230 IonicContact OE2-NE 3.9Å; E227-R230 PolarHBondContact OE2-NE 2.93Å; E227-R230 IonicContact OE2-NH2 2.72Å; E227-R230 PolarHBondContact OE2-NH2 3.07Å; L228-R230 PolarHBondContact O-N 3.2Å
231	A	77.8	Confident	81.3	Confident	59 Å²	59	79.3 Å²	79.3	49%	0.488	41%	0.405	S	S	.	.	S	Bend	trans	-102.7	141.7	176.3	0	0	0	0	0	109.5
232	P	78.8	Confident	80.8	Confident	111 Å²	111	83.5 Å²	83.5	72%	0.721	43%	0.433	S	S	*	.	S	Bend	trans	-65.2	153.5	170.2	30.3	-34.7	0	0	0	110.3
233	G	77	Confident	79.8	Confident	58 Å²	58	86.9 Å²	86.9	60%	0.598	45%	0.448	S	S	*	.	S	Bend	trans	127.3	-173.2	178	0	0	0	0	0	113.1
234	F	78	Confident	78.1	Confident	123 Å²	123	83.5 Å²	83.5	54%	0.539	44%	0.437	S	S	.	.			trans	-92.2	124.4	177.4	180	-94.8	0	0	0	110.3	T236	F234-T236 VanDerWaalsContact CE1-OG1 3.3Å; F234-T236 WeakPolarHBondContact CE1-OG1 3.48Å
235	V	83.5	Confident	76.4	Confident	74 Å²	74	86 Å²	86	45%	0.448	46%	0.457	S	S	.	.			trans	-134.4	121.9	179.3	-172.3	0	0	0	0	109.7	P229 Q237	P229-V235 HydrophobicContact CB-CG2 4.31Å; P229-V235 HydrophobicContact CG-CB 4.36Å; P229-V235 HydrophobicContact CG-CG2 4.48Å; V235-Q237 HydrophobicContact CG1-CG 3.81Å
236	T	85.2	Confident	74	Confident	77 Å²	77	82 Å²	82	47%	0.472	46%	0.459	S	S	.	.			trans	-93.5	124.2	168.3	-53.8	0	0	0	0	109.4	F234	F234-T236 VanDerWaalsContact CE1-OG1 3.3Å; F234-T236 WeakPolarHBondContact CE1-OG1 3.48Å
237	Q	84	Confident	71.3	Confident	90 Å²	90	88 Å²	88	42%	0.421	50%	0.496	S	S	.	.			trans	-119	121.7	-179.3	-66.7	179.7	-17.1	0	0	111.1	V235	V235-Q237 HydrophobicContact CG1-CG 3.81Å
238	N	86.4	Confident	68.4	Low	157 Å²	157	86.5 Å²	86.5	84%	0.84	50%	0.504	S	S	*	.			trans	-91.5	105.9	172.9	-70.9	-40.2	0	0	0	109.9	R240	N238-R240 PolarHBondContact O-N 2.68Å
239	L	82.5	Confident	65.4	Low	59 Å²	59	90.6 Å²	90.6	31%	0.309	54%	0.538	S	S	.	.			trans	-80.3	116.7	176.5	-177.2	60.5	0	0	0	110.4	I207 Y225 I241	I207-L239 HydrophobicContact CB-CD2 4.02Å; I207-L239 HydrophobicContact CD1-CD2 4.03Å; I207-L239 HydrophobicContact CG1-CD2 4.37Å; Y225-L239 VanDerWaalsContact O-CD1 3.26Å; Y225-L239 WeakPolarHBondContact O-CD1 3.48Å; L239-I241 HydrophobicContact CD2-CD1 4.17Å; L239-I241 HydrophobicContact CD2-CG1 4.01Å; L239-I241 HydrophobicContact CG-CD1 4.48Å; L239-I241 HydrophobicContact CG-CG1 3.89Å; L239-I241 PolarHBondContact O-N 2.72Å
240	R	80.2	Confident	62.8	Low	236 Å²	236	94.4 Å²	94.4	89%	0.891	55%	0.55	S	S	*	*			trans	-75.4	107.1	169.7	-74.5	-174.8	-178.3	165.7	1.6	109.4	N238 P242	N238-R240 PolarHBondContact O-N 2.68Å; R240-P242 WeakPolarHBondContact O-CD 3.31Å
241	I	74.7	Confident	60.1	Low	32 Å²	32	91 Å²	91	16%	0.164	55%	0.547	C	S	.	.			trans	-96.3	111.6	175.7	-62.4	-178.3	0	0	0	107.8	F133 I207 V209 G222 L239 H243	F133-I241 HydrophobicContact CE1-CG2 4.19Å; F133-I241 HydrophobicContact CZ-CB 4.13Å; F133-I241 HydrophobicContact CZ-CD1 4.28Å; F133-I241 HydrophobicContact CZ-CG2 4.22Å; I207-I241 HydrophobicContact CG2-CD1 4.21Å; V209-I241 HydrophobicContact CG2-CD1 3.47Å; V209-I241 VanDerWaalsContact CG2-CD1 3.47Å; G222-I241 VanDerWaalsContact C-CG2 3.42Å; L239-I241 HydrophobicContact CD2-CD1 4.17Å; L239-I241 HydrophobicContact CD2-CG1 4.01Å; L239-I241 HydrophobicContact CG-CD1 4.48Å; L239-I241 HydrophobicContact CG-CG1 3.89Å; L239-I241 PolarHBondContact O-N 2.72Å; I241-H243 PolarHBondContact O-N 2.98Å
242	P	67.4	Low	57.5	Low	95 Å²	95	99.7 Å²	99.7	62%	0.617	57%	0.567	S	S	*	*			trans	-63.4	122	176.8	24.5	-30.6	0	0	0	109.3	R240 M244	R240-P242 WeakPolarHBondContact O-CD 3.31Å; P242-M244 PolarHBondContact O-N 3.39Å
243	H	52.1	Low	55.1	Low	71 Å²	71	100.9 Å²	100.9	33%	0.329	56%	0.558	S	S	.	*			trans	-62.8	131.8	175.5	-170.1	-90.5	0	0	0	109.7	E134 E221 I241 A245	E134-H243 WeakPolarHBondContact CB-NE2 3.44Å; E134-H243 IonicContact OE2-CE1 3.7Å; E134-H243 PolarHBondContact OE2-CE1 3.15Å; E134-H243 VanDerWaalsContact OE2-CE1 3.28Å; E134-H243 IonicContact OE2-NE2 3.52Å; E221-H243 IonicContact OE2-NE2 3.46Å; I241-H243 PolarHBondContact O-N 2.98Å; H243-A245 WeakPolarHBondContact ND1-CA 3.37Å; H243-A245 WeakPolarHBondContact ND1-CB 3.26Å; H243-A245 PolarHBondContact ND1-N 3.46Å; H243-A245 PolarHBondContact O-N 2.87Å
244	M	45.7	Very low	52.5	Low	45 Å²	45	103.1 Å²	103.1	22%	0.222	56%	0.562	C	S	.	*			trans	-80.4	49.7	172.2	-70.3	-132	177.5	0	0	112	E221 Y223 P242 G246 L272 Y334	E221-M244 PolarHBondContact O-N 2.89Å; Y223-M244 HydrophobicContact CD1-CE 4Å; Y223-M244 HydrophobicContact CE1-CE 3.26Å; P242-M244 PolarHBondContact O-N 3.39Å; M244-G246 VanDerWaalsContact C-N 3.33Å; M244-G246 PolarHBondContact O-N 3.43Å; M244-G246 VanDerWaalsContact O-N 3.07Å; M244-L272 HydrophobicContact CE-CD1 4.02Å; M244-L272 HydrophobicContact CE-CD2 3.92Å; M244-L272 HydrophobicContact SD-CD2 3.88Å; M244-Y334 HydrophobicContact CE-CE1 4.21Å; M244-Y334 WeakPolarHBondContact CE-OH 3.03Å; M244-Y334 HydrophobicContact SD-CE1 4.06Å; M244-Y334 PolarHBondContact SD-OH 3.49Å
245	A	38.6	Very low	49.9	Very low	64 Å²	64	109.4 Å²	109.4	53%	0.529	58%	0.582	S	S	.	*			trans	-80.4	89	167.8	0	0	0	0	0	107.3	H243 T247	H243-A245 WeakPolarHBondContact ND1-CA 3.37Å; H243-A245 WeakPolarHBondContact ND1-CB 3.26Å; H243-A245 PolarHBondContact ND1-N 3.46Å; H243-A245 PolarHBondContact O-N 2.87Å; A245-T247 PolarHBondContact O-N 2.94Å
246	G	34	Very low	47.1	Very low	58 Å²	58	110.9 Å²	110.9	60%	0.598	59%	0.592	S	S	*	*			trans	-59.5	126.4	149.8	0	0	0	0	0	107.2	M244 G248	M244-G246 VanDerWaalsContact C-N 3.33Å; M244-G246 PolarHBondContact O-N 3.43Å; M244-G246 VanDerWaalsContact O-N 3.07Å; G246-G248 CarbonylContact O-C 3.47Å; G246-G248 PolarHBondContact O-N 3.05Å
247	T	29.2	Very low	44.3	Very low	156 Å²	156	114.4 Å²	114.4	96%	0.957	61%	0.607	S	S	*	*	S	Bend	trans	-58.4	-6.1	167.8	41	0	0	0	0	113	A245 A249	A245-T247 PolarHBondContact O-N 2.94Å; T247-A249 PolarHBondContact O-N 3.07Å
248	G	26.3	Very low	41.6	Very low	54 Å²	54	116 Å²	116	56%	0.557	63%	0.625	S	S	*	*	S	Bend	trans	-82.1	105.2	164.3	0	0	0	0	0	110.3	G246 F250	G246-G248 CarbonylContact O-C 3.47Å; G246-G248 PolarHBondContact O-N 3.05Å; G248-F250 PolarHBondContact O-N 2.96Å
249	A	24.9	Very low	39.1	Very low	91 Å²	91	111.3 Å²	111.3	75%	0.752	60%	0.6	S	S	*	*			trans	-35.5	119.1	158.4	0	0	0	0	0	108.9	T247 P251	T247-A249 PolarHBondContact O-N 3.07Å; A249-P251 VanDerWaalsContact O-CD 3.32Å; A249-P251 WeakPolarHBondContact O-CD 3.39Å
250	F	30.5	Very low	36.6	Very low	125 Å²	125	112.1 Å²	112.1	55%	0.548	61%	0.608	S	S	.	*			trans	-47.1	118.8	170.5	-81	-93	0	0	0	106.5	G248 R252	G248-F250 PolarHBondContact O-N 2.96Å; F250-R252 PolarHBondContact O-N 3.3Å
251	P	25.2	Very low	34.5	Very low	75 Å²	75	109.2 Å²	109.2	49%	0.487	60%	0.602	S	S	.	*			trans	-57.9	114.2	177.2	19.4	-27.7	0	0	0	105.4	A249 Y253	A249-P251 VanDerWaalsContact O-CD 3.32Å; A249-P251 WeakPolarHBondContact O-CD 3.39Å; P251-Y253 PolarHBondContact O-N 3.14Å
252	R	23.8	Very low	32.7	Very low	242 Å²	242	112.4 Å²	112.4	91%	0.913	63%	0.627	S	S	*	*			trans	-55	101.8	169	-74.3	-175.9	-177.9	-175.3	1.4	104.3	F250 P254	F250-R252 PolarHBondContact O-N 3.3Å; R252-P254 WeakPolarHBondContact O-CD 3.17Å; R252-P254 VanDerWaalsContact O-N 3.12Å
253	Y	27.1	Very low	31.2	Very low	136 Å²	136	111 Å²	111	53%	0.533	61%	0.612	S	S	.	*			trans	-53.5	125.8	170.9	-67	-80.6	0	0	0	105.7	P251 R255	P251-Y253 PolarHBondContact O-N 3.14Å; Y253-R255 PolarHBondContact O-N 3.27Å
254	P	23.5	Very low	30.5	Very low	105 Å²	105	114.5 Å²	114.5	68%	0.682	62%	0.622	S	S	*	*			trans	-51.8	136.1	172.3	20	-28.9	0	0	0	107	R252 V256	R252-P254 WeakPolarHBondContact O-CD 3.17Å; R252-P254 VanDerWaalsContact O-N 3.12Å; P254-V256 WeakPolarHBondContact O-CG2 3.11Å; P254-V256 PolarHBondContact O-N 3.21Å
255	R	22.6	Very low	30.1	Very low	255 Å²	255	115.2 Å²	115.2	96%	0.962	63%	0.631	S	S	*	*			trans	-64.2	81.1	-176.2	-150.6	-171.4	-67.8	-174.1	-0.7	107.5	Y253	Y253-R255 PolarHBondContact O-N 3.27Å
256	V	25.6	Very low	30.1	Very low	106 Å²	106	116.8 Å²	116.8	64%	0.642	63%	0.629	S	S	*	*			trans	-69.1	137.3	173.5	-177.3	0	0	0	0	106.6	P254	P254-V256 WeakPolarHBondContact O-CG2 3.11Å; P254-V256 PolarHBondContact O-N 3.21Å
257	L	25.6	Very low	30.3	Very low	151 Å²	151	119 Å²	119	79%	0.791	63%	0.627	S	S	*	*			trans	-40.9	142	-179	-81.4	147.9	0	0	0	111.8	L259	L257-L259 PolarHBondContact O-N 2.95Å
258	P	27.9	Very low	30.8	Very low	123 Å²	123	112.3 Å²	112.3	80%	0.799	59%	0.585	S	S	*	*			trans	-61.6	107.2	-172.4	24	-31.7	0	0	0	110.8
259	L	33	Very low	31.6	Very low	59 Å²	59	113.2 Å²	113.2	31%	0.309	57%	0.572	S	S	.	*			trans	-63.5	145.7	168.2	-71.4	167.9	0	0	0	109.9	L257	L257-L259 PolarHBondContact O-N 2.95Å
260	P	30.9	Very low	32.6	Very low	76 Å²	76	111.8 Å²	111.8	49%	0.494	55%	0.552	S	S	.	*			trans	-52.4	146.3	172.9	-23.4	31.9	0	0	0	111.8	S262 Q263 R264	P260-S262 PolarHBondContact O-N 3.07Å; P260-Q263 PolarHBondContact O-N 3.08Å; P260-R264 PolarHBondContact O-N 3.43Å
261	K	36.1	Very low	33.5	Very low	175 Å²	175	106.2 Å²	106.2	76%	0.761	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-33.5	-178.3	-95.2	-175.1	176.3	179.4	0	113.8	Q263	K261-Q263 VanDerWaalsContact C-N 3.34Å
262	S	35.9	Very low	34.6	Very low	98 Å²	98	104 Å²	104	69%	0.685	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-19.9	179.8	52.1	0	0	0	0	114.7	P260	P260-S262 PolarHBondContact O-N 3.07Å
263	Q	36.5	Very low	36	Very low	65 Å²	65	93.2 Å²	93.2	30%	0.304	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	3.5	-176.9	-68.8	-173.8	-8.2	0	0	113.2	P260 K261 P265	P260-Q263 PolarHBondContact O-N 3.08Å; K261-Q263 VanDerWaalsContact C-N 3.34Å; Q263-P265 VanDerWaalsContact O-CD 3.29Å; Q263-P265 WeakPolarHBondContact O-CD 3.48Å; Q263-P265 VanDerWaalsContact O-N 3.14Å
264	R	38.3	Very low	37.1	Very low	145 Å²	145	87.4 Å²	87.4	55%	0.547	45%	0.451	S	S	.	.	S	Bend	trans	-60.6	121.3	170.6	-63.9	-175.7	-162.9	-177.2	4.3	106.7	P260 I266	P260-R264 PolarHBondContact O-N 3.43Å; R264-I266 PolarHBondContact O-N 2.94Å
265	P	36.3	Very low	38.5	Very low	61 Å²	61	84.1 Å²	84.1	40%	0.396	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-54.5	123.7	165	22.6	-29.9	0	0	0	105.7	Q263 D267	Q263-P265 VanDerWaalsContact O-CD 3.29Å; Q263-P265 WeakPolarHBondContact O-CD 3.48Å; Q263-P265 VanDerWaalsContact O-N 3.14Å; P265-D267 PolarHBondContact O-N 2.92Å
266	I	38.7	Very low	39.8	Very low	96 Å²	96	73.9 Å²	73.9	49%	0.492	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-52.3	117.7	170	-55.3	169.4	0	0	0	103.8	R264 L268 P361	R264-I266 PolarHBondContact O-N 2.94Å; I266-L268 HydrophobicContact CB-CD1 4.23Å; I266-L268 HydrophobicContact CB-CD2 4.4Å; I266-L268 HydrophobicContact CB-CG 3.86Å; I266-L268 HydrophobicContact CG2-CD1 4.37Å; I266-L268 HydrophobicContact CG2-CD2 3.65Å; I266-L268 HydrophobicContact CG2-CG 3.58Å; I266-L268 PolarHBondContact O-N 2.96Å; I266-P361 HydrophobicContact CD1-CG 4.31Å
267	D	38.1	Very low	41.1	Very low	105 Å²	105	72.9 Å²	72.9	56%	0.561	38%	0.377	S	S	*	.			trans	-66.8	76.5	174.3	-169.2	17.3	0	0	0	106	P265 R269	P265-D267 PolarHBondContact O-N 2.92Å; D267-R269 PolarHBondContact O-N 3.39Å; D267-R269 IonicContact OD2-CZ 2.72Å; D267-R269 IonicContact OD2-NE 2.78Å; D267-R269 PolarHBondContact OD2-NE 3.05Å; D267-R269 IonicContact OD2-NH2 3.5Å
268	L	39.2	Very low	42.2	Very low	15 Å²	15	67.8 Å²	67.8	8%	0.079	35%	0.349	C	S	.	.			trans	-77.8	71.2	-179.1	-73	164.1	0	0	0	107.1	I266 D270 F271 R360 P361	I266-L268 HydrophobicContact CB-CD1 4.23Å; I266-L268 HydrophobicContact CB-CD2 4.4Å; I266-L268 HydrophobicContact CB-CG 3.86Å; I266-L268 HydrophobicContact CG2-CD1 4.37Å; I266-L268 HydrophobicContact CG2-CD2 3.65Å; I266-L268 HydrophobicContact CG2-CG 3.58Å; I266-L268 PolarHBondContact O-N 2.96Å; L268-D270 WeakPolarHBondContact CD2-OD2 3.37Å; L268-D270 PolarHBondContact O-N 2.97Å; L268-D270 VanDerWaalsContact O-N 3.08Å; L268-F271 HydrophobicContact CB-CD2 3.9Å; L268-F271 HydrophobicContact CB-CE2 4.13Å; L268-F271 HydrophobicContact CD1-CE2 4.19Å; L268-F271 PolarHBondContact O-N 2.84Å; L268-R360 HydrophobicContact CD1-CB 4.26Å; L268-R360 HydrophobicContact CD2-CB 4.34Å; L268-P361 WeakPolarHBondContact CD1-O 3.17Å
269	R	43.9	Very low	43.2	Very low	74 Å²	74	65.2 Å²	65.2	28%	0.279	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-13.4	165.9	-67	-177	179.9	-137.5	4.9	112	R219 D267 F271	R219-R269 VanDerWaalsContact CB-NH1 3.31Å; R219-R269 VanDerWaalsContact CG-NH1 3.26Å; D267-R269 PolarHBondContact O-N 3.39Å; D267-R269 IonicContact OD2-CZ 2.72Å; D267-R269 IonicContact OD2-NE 2.78Å; D267-R269 PolarHBondContact OD2-NE 3.05Å; D267-R269 IonicContact OD2-NH2 3.5Å; R269-F271 PolarHBondContact O-N 3.27Å; R269-F271 VanDerWaalsContact O-N 3.07Å
270	D	45.3	Very low	43.8	Very low	60 Å²	60	63.7 Å²	63.7	32%	0.321	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-20.5	172.5	-54.5	-9.4	0	0	0	114.6	L268 R360 P376 P377	L268-D270 WeakPolarHBondContact CD2-OD2 3.37Å; L268-D270 PolarHBondContact O-N 2.97Å; L268-D270 VanDerWaalsContact O-N 3.08Å; D270-R360 WeakPolarHBondContact OD2-CD 3.33Å; D270-R360 IonicContact OD2-CZ 3.57Å; D270-R360 IonicContact OD2-NE 3.88Å; D270-R360 IonicContact OD2-NH1 2.7Å; D270-R360 PolarHBondContact OD2-NH1 2.05Å; D270-P376 HydrophobicContact CB-CB 4.02Å; D270-P377 WeakPolarHBondContact O-CA 3.48Å
271	F	50.8	Low	44.7	Very low	8 Å²	8	64.9 Å²	64.9	4%	0.035	33%	0.331	C	S	.	.			trans	-109.1	82.4	-176.5	-62.6	-84.1	0	0	0	112.4	L268 R269 M273 S274 R360 L362 C374 P376 P377	L268-F271 HydrophobicContact CB-CD2 3.9Å; L268-F271 HydrophobicContact CB-CE2 4.13Å; L268-F271 HydrophobicContact CD1-CE2 4.19Å; L268-F271 PolarHBondContact O-N 2.84Å; R269-F271 PolarHBondContact O-N 3.27Å; R269-F271 VanDerWaalsContact O-N 3.07Å; F271-M273 PolarHBondContact O-N 2.78Å; F271-S274 WeakPolarHBondContact CB-OG 3.08Å; F271-S274 PolarHBondContact O-N 3.47Å; F271-S274 VanDerWaalsContact O-N 3.13Å; F271-S274 PolarHBondContact O-OG 3.22Å; F271-R360 HydrophobicContact CE2-CB 4.25Å; F271-R360 HydrophobicContact CZ-CB 4.24Å; F271-L362 HydrophobicContact CB-CD2 4.02Å; F271-L362 HydrophobicContact CD1-CD2 3.84Å; F271-L362 HydrophobicContact CD2-CD2 3.17Å; F271-L362 HydrophobicContact CD2-CG 4.19Å; F271-L362 HydrophobicContact CE1-CD2 4.04Å; F271-L362 HydrophobicContact CE2-CD2 3.41Å; F271-L362 VanDerWaalsContact CE2-CD2 3.41Å; F271-L362 HydrophobicContact CE2-CG 3.94Å; F271-L362 HydrophobicContact CG-CD2 3.39Å; F271-L362 HydrophobicContact CZ-CD1 4.43Å; F271-L362 HydrophobicContact CZ-CD2 3.83Å; F271-L362 HydrophobicContact CZ-CG 4.22Å; F271-C374 HydrophobicContact CD1-CB 4.34Å; F271-C374 HydrophobicContact CE1-CB 3.46Å; F271-C374 VanDerWaalsContact CE1-CB 3.46Å; F271-C374 HydrophobicContact CZ-CB 3.87Å; F271-P376 HydrophobicContact CE1-CB 4.14Å; F271-P376 HydrophobicContact CZ-CB 4.15Å; F271-P377 WeakPolarHBondContact CA-O 3.31Å
272	L	48.3	Very low	45.2	Very low	29 Å²	29	60.6 Å²	60.6	15%	0.152	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-16.9	-172.5	-59.9	171.1	0	0	0	115.5	L220 Y223 M244 Y334	L220-L272 HydrophobicContact CD2-CD2 4.4Å; Y223-L272 HydrophobicContact CE1-CD1 4.19Å; M244-L272 HydrophobicContact CE-CD1 4.02Å; M244-L272 HydrophobicContact CE-CD2 3.92Å; M244-L272 HydrophobicContact SD-CD2 3.88Å; L272-Y334 HydrophobicContact CB-CE2 3.82Å; L272-Y334 HydrophobicContact CD1-CE2 4.34Å; L272-Y334 WeakPolarHBondContact CD2-OH 3.39Å
273	M	51.6	Low	45.9	Very low	15 Å²	15	60.5 Å²	60.5	7%	0.074	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	11.7	-176.5	-65.5	-168.3	178.4	0	0	114.9	F271 P330 V331 Y334 L336 V378	F271-M273 PolarHBondContact O-N 2.78Å; M273-P330 HydrophobicContact CB-CB 3.85Å; M273-P330 CarbonylContact O-C 3.55Å; M273-P330 VanDerWaalsContact O-C 3.32Å; M273-P330 WeakPolarHBondContact O-CA 3.28Å; M273-P330 WeakPolarHBondContact O-CB 3.38Å; M273-V331 WeakPolarHBondContact CA-O 3.33Å; M273-V331 PolarHBondContact O-N 3.05Å; M273-Y334 HydrophobicContact CE-CD2 4.33Å; M273-L336 HydrophobicContact CE-CD1 3.24Å; M273-L336 HydrophobicContact CE-CG 4.06Å; M273-V378 HydrophobicContact SD-CG1 4.04Å
274	S	50.8	Low	46.5	Very low	15 Å²	15	59.9 Å²	59.9	11%	0.105	31%	0.306	C	S	.	.			trans	-121.5	135.2	-179.2	59.3	0	0	0	0	113.6	F271 R329	F271-S274 WeakPolarHBondContact CB-OG 3.08Å; F271-S274 PolarHBondContact O-N 3.47Å; F271-S274 VanDerWaalsContact O-N 3.13Å; F271-S274 PolarHBondContact O-OG 3.22Å; S274-R329 VanDerWaalsContact CB-CG 3.42Å
275	H	52.4	Low	46.9	Very low	36 Å²	36	62.8 Å²	62.8	17%	0.167	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.6	161.9	-74.8	-75.9	0	0	0	109.7	F277 V328 V331 R333	H275-F277 HydrophobicContact CB-CE2 4.11Å; H275-V328 PolarHBondContact N-O 3.21Å; H275-V328 PolarHBondContact O-N 3.29Å; H275-V328 VanDerWaalsContact O-O 3.04Å; H275-V331 WeakPolarHBondContact CD2-CG2 3.32Å; H275-V331 WeakPolarHBondContact NE2-CG2 3.32Å; H275-R333 PolarHBondContact CE1-NH2 3.08Å; H275-R333 PolarHBondContact ND1-NH2 3.02Å; H275-R333 PolarHBondContact NE2-NE 3.33Å
276	M	51.2	Low	47.4	Very low	40 Å²	40	62.9 Å²	62.9	20%	0.197	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.8	166.2	-81.6	-179.8	-63.9	0	0	109.6	L327 L362 L363	M276-L327 HydrophobicContact CB-CD1 4.37Å; M276-L327 HydrophobicContact CG-CB 4.41Å; M276-L327 HydrophobicContact CG-CD1 3.09Å; M276-L327 HydrophobicContact CG-CG 4.33Å; M276-L327 HydrophobicContact SD-CD1 3.86Å; M276-L362 HydrophobicContact CE-CB 4.21Å; M276-L362 WeakPolarHBondContact CE-O 3.39Å; M276-L362 HydrophobicContact SD-CB 3.95Å; M276-L363 HydrophobicContact SD-CB 4.02Å; M276-L363 HydrophobicContact SD-CD1 4.32Å
277	F	51.9	Low	48	Very low	84 Å²	84	65.1 Å²	65.1	37%	0.368	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	106.6	164.8	-65.7	-81.5	0	0	0	106.8	H275 H326 V328	H275-F277 HydrophobicContact CB-CE2 4.11Å; F277-H326 WeakPolarHBondContact CB-CE1 3.5Å; F277-H326 WeakPolarHBondContact CB-NE2 3.48Å; F277-H326 AromaticContact CD2-CD2 3.92Å; F277-H326 AromaticContact CD2-NE2 3.52Å; F277-H326 AromaticContact CG-CE1 3.95Å; F277-H326 AromaticContact CG-NE2 3.52Å; F277-H326 PolarHBondContact N-O 2.89Å; F277-H326 PolarHBondContact O-N 3.25Å; F277-V328 HydrophobicContact CD2-CG2 4.21Å; F277-V328 HydrophobicContact CE2-CG2 4.41Å
278	H	48.7	Very low	48.6	Very low	44 Å²	44	63.3 Å²	63.3	20%	0.204	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.4	175.5	175.9	-99.5	0	0	0	107.9	H323 L363	H278-H323 AromaticContact CE1-ND1 3.56Å; H278-H323 AromaticContact NE2-ND1 3.46Å; H278-H323 PolarHBondContact NE2-ND1 3.36Å; H278-L363 HydrophobicContact CB-CD1 4.17Å
279	T	49.3	Very low	49	Very low	69 Å²	69	70 Å²	70	42%	0.423	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143.8	173.3	71.5	0	0	0	0	108.7	W324	T279-W324 PolarHBondContact N-O 2.68Å; T279-W324 PolarHBondContact O-N 3.42Å
280	G	46.5	Very low	49	Very low	28 Å²	28	71.3 Å²	71.3	29%	0.289	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.5	179.4	0	0	0	0	0	109.5	Y322	G280-Y322 CarbonylContact C-O 3.55Å; G280-Y322 WeakPolarHBondContact CA-O 3.15Å
281	I	49.8	Very low	49	Very low	100 Å²	100	74 Å²	74	51%	0.513	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	116.9	171.7	-58.9	175.6	0	0	0	106.4	I283 Y322	I281-I283 HydrophobicContact CG2-CD1 4.17Å; I281-I283 HydrophobicContact CG2-CG1 3.84Å; I281-Y322 PolarHBondContact N-O 2.82Å; I281-Y322 PolarHBondContact O-N 3.14Å
282	D	46.7	Very low	48.6	Very low	86 Å²	86	78.6 Å²	78.6	46%	0.46	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121	173.3	174.5	-30.1	0	0	0	107.2	N284 H319	D282-N284 PolarHBondContact OD1-N 2.92Å; D282-H319 IonicContact OD1-CE1 3.99Å; D282-H319 PolarHBondContact OD1-CE1 2.96Å; D282-H319 IonicContact OD1-NE2 3.73Å; D282-H319 PolarHBondContact OD1-NE2 2.57Å; D282-H319 IonicContact OD2-CE1 2.93Å; D282-H319 PolarHBondContact OD2-CE1 3.37Å; D282-H319 VanDerWaalsContact OD2-CE1 3.24Å; D282-H319 IonicContact OD2-NE2 2.92Å; D282-H319 PolarHBondContact OD2-NE2 3.42Å
283	I	49.8	Very low	48.2	Very low	95 Å²	95	79 Å²	79	49%	0.487	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	91.3	174.3	-52.8	178.5	0	0	0	108	I281 L320	I281-I283 HydrophobicContact CG2-CD1 4.17Å; I281-I283 HydrophobicContact CG2-CG1 3.84Å; I283-L320 HydrophobicContact CD1-CD2 4.46Å; I283-L320 PolarHBondContact N-O 3.4Å; I283-L320 VanDerWaalsContact N-O 3.12Å; I283-L320 PolarHBondContact O-N 2.87Å
284	N	49.1	Very low	47.9	Very low	52 Å²	52	84.6 Å²	84.6	28%	0.278	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.9	170.8	-167.8	-9	0	0	0	111.4	D282 G286 D288	D282-N284 PolarHBondContact OD1-N 2.92Å; N284-G286 VanDerWaalsContact C-N 3.28Å; N284-G286 PolarHBondContact O-N 3.32Å; N284-G286 PolarHBondContact OD1-N 2.93Å; N284-D288 PolarHBondContact ND2-OD1 3.2Å; N284-D288 PolarHBondContact ND2-OD2 2.76Å
285	R	47	Very low	47.7	Very low	206 Å²	206	88.5 Å²	88.5	78%	0.777	46%	0.461	S	S	*	.			trans	-87.4	67.7	165.8	-77.2	-169.9	175.6	-172.9	-0.1	110.9	H287	R285-H287 PolarHBondContact O-N 2.97Å
286	G	47	Very low	47.4	Very low	63 Å²	63	91.4 Å²	91.4	65%	0.649	48%	0.477	S	S	*	.	S	Bend	trans	61.8	9.1	138.2	0	0	0	0	0	122.1	N284	N284-G286 VanDerWaalsContact C-N 3.28Å; N284-G286 PolarHBondContact O-N 3.32Å; N284-G286 PolarHBondContact OD1-N 2.93Å
287	H	50.9	Low	47.5	Very low	144 Å²	144	93.3 Å²	93.3	67%	0.667	49%	0.487	S	S	*	.			trans	-132.4	71.4	174.5	-76.4	-91.1	0	0	0	112.3	R285 A317	R285-H287 PolarHBondContact O-N 2.97Å; H287-A317 HydrophobicContact CB-CB 4.02Å; H287-A317 PolarHBondContact O-N 3.31Å
288	D	49.4	Very low	47.2	Very low	67 Å²	67	97.2 Å²	97.2	36%	0.358	50%	0.5	S	S	.	.			trans	-86.8	123	164.7	-71.5	1.2	0	0	0	108.8	N284 T316	N284-D288 PolarHBondContact ND2-OD1 3.2Å; N284-D288 PolarHBondContact ND2-OD2 2.76Å; D288-T316 WeakPolarHBondContact OD1-CA 3.43Å; D288-T316 WeakPolarHBondContact OD1-CB 3.38Å; D288-T316 WeakPolarHBondContact OD1-CG2 3.46Å
289	K	49.3	Very low	47.2	Very low	154 Å²	154	96.5 Å²	96.5	67%	0.67	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.5	166.5	-64.9	-172.2	-178.3	-176.8	0	107.8	A315	K289-A315 PolarHBondContact N-O 2.98Å; K289-A315 PolarHBondContact O-N 3.05Å
290	I	44	Very low	47.5	Very low	103 Å²	103	98.7 Å²	98.7	53%	0.528	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.3	174.8	-56.4	171.6	0	0	0	106.4	Q314	I290-Q314 HydrophobicContact CG1-CG 4.19Å
291	I	44.3	Very low	48.5	Very low	117 Å²	117	103.7 Å²	103.7	60%	0.6	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	110	168.6	-61	173.7	0	0	0	106.2	F312 I313	I291-F312 CarbonylContact O-C 3.44Å; I291-F312 WeakPolarHBondContact O-CA 3.43Å; I291-I313 PolarHBondContact N-O 3.41Å; I291-I313 PolarHBondContact O-N 3Å
292	D	42.2	Very low	48.8	Very low	103 Å²	103	101.1 Å²	101.1	55%	0.551	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	140.4	177.2	59	-32.2	0	0	0	110.9	F294 F312	D292-F294 HydrophobicContact CB-CE2 4.45Å; D292-F312 HydrophobicContact CB-CB 4.34Å
293	G	40.4	Very low	49.5	Very low	39 Å²	39	101 Å²	101	40%	0.402	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	129.7	179.5	0	0	0	0	0	110.5	G311	G293-G311 PolarHBondContact N-O 3.44Å; G293-G311 PolarHBondContact O-N 2.84Å; G293-G311 VanDerWaalsContact O-O 3.12Å
294	F	44.2	Very low	49.6	Very low	132 Å²	132	105.7 Å²	105.7	58%	0.579	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.1	174.4	-57.1	-85.2	0	0	0	107.9	D292 K310	D292-F294 HydrophobicContact CB-CE2 4.45Å; F294-K310 HydrophobicContact CD1-CD 4.37Å; F294-K310 HydrophobicContact CD1-CG 3.95Å; F294-K310 HydrophobicContact CE1-CD 4.18Å; F294-K310 HydrophobicContact CE1-CG 4.13Å
295	L	48.3	Very low	49.3	Very low	97 Å²	97	105 Å²	105	51%	0.508	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	103.3	175.6	-176.2	64.6	0	0	0	108.8	I297 L309	L295-I297 HydrophobicContact CD1-CG1 4.3Å; L295-I297 HydrophobicContact CD2-CD1 3.83Å; L295-I297 HydrophobicContact CD2-CG1 4.02Å; L295-I297 HydrophobicContact CG-CD1 4.16Å; L295-I297 HydrophobicContact CG-CG1 3.76Å; L295-L309 HydrophobicContact CB-CB 4.32Å; L295-L309 PolarHBondContact N-O 3.28Å; L295-L309 VanDerWaalsContact N-O 3.1Å; L295-L309 PolarHBondContact O-N 2.69Å
296	N	45.1	Very low	49.2	Very low	97 Å²	97	100.5 Å²	100.5	52%	0.519	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	99.3	174.2	-70.1	-39.7	0	0	0	108.9	L306 W307 D308	N296-L306 HydrophobicContact CB-CD2 4.31Å; N296-W307 CarbonylContact C-O 3.56Å; N296-W307 WeakPolarHBondContact CA-O 3.41Å; N296-D308 PolarHBondContact OD1-OD1 3.49Å
297	I	54.2	Low	49.2	Very low	79 Å²	79	104.1 Å²	104.1	41%	0.405	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.2	174.7	-51.1	-177.8	0	0	0	107.7	L295 N299 W307	L295-I297 HydrophobicContact CD1-CG1 4.3Å; L295-I297 HydrophobicContact CD2-CD1 3.83Å; L295-I297 HydrophobicContact CD2-CG1 4.02Å; L295-I297 HydrophobicContact CG-CD1 4.16Å; L295-I297 HydrophobicContact CG-CG1 3.76Å; I297-N299 PolarHBondContact O-N 2.98Å; I297-W307 HydrophobicContact CB-CB 4.37Å; I297-W307 PolarHBondContact N-O 3.18Å; I297-W307 WeakPolarHBondContact O-CB 3.47Å; I297-W307 PolarHBondContact O-N 3.19Å
298	R	43.9	Very low	48.7	Very low	166 Å²	166	100.2 Å²	100.2	63%	0.626	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.8	169.5	-158.3	-174.4	-67.4	-95.5	3.4	107.6	P300 P303	R298-P300 WeakPolarHBondContact O-CD 3.31Å; R298-P300 VanDerWaalsContact O-N 3.16Å; R298-P303 VanDerWaalsContact CD-O 3.29Å; R298-P303 WeakPolarHBondContact CD-O 3.36Å; R298-P303 WeakPolarHBondContact CG-O 3.39Å; R298-P303 PolarHBondContact NH1-O 3.16Å
299	N	48.8	Very low	48.6	Very low	30 Å²	30	101.1 Å²	101.1	16%	0.16	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-53.1	122.9	-175.4	175.8	-8	0	0	0	109.4	I297 V301 D302 K305	I297-N299 PolarHBondContact O-N 2.98Å; N299-V301 PolarHBondContact O-N 3.18Å; N299-V301 VanDerWaalsContact O-N 3.12Å; N299-V301 PolarHBondContact OD1-N 3.2Å; N299-D302 WeakPolarHBondContact CB-O 3.4Å; N299-D302 CarbonylContact O-C 3.58Å; N299-D302 PolarHBondContact O-N 3.01Å; N299-K305 HydrophobicContact CB-CB 3.98Å; N299-K305 WeakPolarHBondContact CB-O 3.29Å; N299-K305 PolarHBondContact N-O 3.48Å
300	P	57.6	Low	48.3	Very low	114 Å²	114	98 Å²	98	74%	0.74	50%	0.5	S	S	*	.	S	Bend	trans	-58.8	-26.9	-176.2	-23.8	32.4	0	0	0	113.9	R298	R298-P300 WeakPolarHBondContact O-CD 3.31Å; R298-P300 VanDerWaalsContact O-N 3.16Å
301	V	65.6	Low	48.4	Very low	134 Å²	134	94.7 Å²	94.7	81%	0.812	49%	0.491	S	S	*	.	S	Bend	trans	-95.6	-30	-175.9	-176	0	0	0	0	112.1	N299	N299-V301 PolarHBondContact O-N 3.18Å; N299-V301 VanDerWaalsContact O-N 3.12Å; N299-V301 PolarHBondContact OD1-N 3.2Å
302	D	57.7	Low	48.5	Very low	45 Å²	45	92.9 Å²	92.9	24%	0.241	48%	0.479	C	S	.	.			trans	-133.5	97	179.3	-174.8	-5.2	0	0	0	110.9	N299 K304 K305	N299-D302 WeakPolarHBondContact CB-O 3.4Å; N299-D302 CarbonylContact O-C 3.58Å; N299-D302 PolarHBondContact O-N 3.01Å; D302-K304 PolarHBondContact O-N 3.38Å; D302-K304 WeakPolarHBondContact OD1-CB 3.45Å; D302-K304 PolarHBondContact OD1-N 3.48Å; D302-K304 VanDerWaalsContact OD1-N 3.16Å; D302-K305 HydrophobicContact CB-CD 4.41Å; D302-K305 HydrophobicContact CB-CG 4.33Å; D302-K305 PolarHBondContact O-N 2.99Å; D302-K305 WeakPolarHBondContact OD2-CE 3.35Å
303	P	59.7	Low	48.5	Very low	84 Å²	84	91.5 Å²	91.5	55%	0.545	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-8.7	-174.4	23.5	-32	0	0	0	114.6	R298 K305	R298-P303 VanDerWaalsContact CD-O 3.29Å; R298-P303 WeakPolarHBondContact CD-O 3.36Å; R298-P303 WeakPolarHBondContact CG-O 3.39Å; R298-P303 PolarHBondContact NH1-O 3.16Å; P303-K305 VanDerWaalsContact C-N 3.33Å
304	K	52.2	Low	48.9	Very low	193 Å²	193	92 Å²	92	84%	0.839	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-13.7	172	-65.2	-176.1	179.4	179.6	0	113.2	D302	D302-K304 PolarHBondContact O-N 3.38Å; D302-K304 WeakPolarHBondContact OD1-CB 3.45Å; D302-K304 PolarHBondContact OD1-N 3.48Å; D302-K304 VanDerWaalsContact OD1-N 3.16Å
305	K	43.7	Very low	49.3	Very low	38 Å²	38	87.9 Å²	87.9	17%	0.165	45%	0.453	C	S	.	.			trans	-105.4	138.4	-176.5	-60.5	-170.6	-175.4	-155.2	0	112.2	N299 D302 P303 K409 E416	N299-K305 HydrophobicContact CB-CB 3.98Å; N299-K305 WeakPolarHBondContact CB-O 3.29Å; N299-K305 PolarHBondContact N-O 3.48Å; D302-K305 HydrophobicContact CB-CD 4.41Å; D302-K305 HydrophobicContact CB-CG 4.33Å; D302-K305 PolarHBondContact O-N 2.99Å; D302-K305 WeakPolarHBondContact OD2-CE 3.35Å; P303-K305 VanDerWaalsContact C-N 3.33Å; K305-K409 VanDerWaalsContact NZ-CE 3.31Å; K305-E416 WeakPolarHBondContact CE-OE1 3.47Å; K305-E416 IonicContact NZ-OE1 3.9Å; K305-E416 PolarHBondContact NZ-OE1 3.47Å
306	L	44.6	Very low	49.4	Very low	112 Å²	112	84.6 Å²	84.6	59%	0.586	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.7	177.7	-77.3	142.4	0	0	0	109.3	N296	N296-L306 HydrophobicContact CB-CD2 4.31Å
307	W	46.8	Very low	49.7	Very low	139 Å²	139	81 Å²	81	53%	0.527	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	115	165	-69.4	20.3	0	0	0	107.3	N296 I297	N296-W307 CarbonylContact C-O 3.56Å; N296-W307 WeakPolarHBondContact CA-O 3.41Å; I297-W307 HydrophobicContact CB-CB 4.37Å; I297-W307 PolarHBondContact N-O 3.18Å; I297-W307 WeakPolarHBondContact O-CB 3.47Å; I297-W307 PolarHBondContact O-N 3.19Å
308	D	41.3	Very low	49.5	Very low	61 Å²	61	81.5 Å²	81.5	33%	0.326	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	99.4	179.8	-178.8	8.1	0	0	0	108.9	N296 K310	N296-D308 PolarHBondContact OD1-OD1 3.49Å; D308-K310 WeakPolarHBondContact OD1-CE 3.33Å; D308-K310 WeakPolarHBondContact OD1-CG 3.11Å; D308-K310 IonicContact OD1-NZ 3.24Å; D308-K310 WeakPolarHBondContact OD2-CE 3.39Å; D308-K310 IonicContact OD2-NZ 3.4Å; D308-K310 PolarHBondContact OD2-NZ 3.39Å
309	L	46.5	Very low	49.9	Very low	87 Å²	87	73.9 Å²	73.9	46%	0.455	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	111	175.8	-152.2	96.9	0	0	0	109.1	L295	L295-L309 HydrophobicContact CB-CB 4.32Å; L295-L309 PolarHBondContact N-O 3.28Å; L295-L309 VanDerWaalsContact N-O 3.1Å; L295-L309 PolarHBondContact O-N 2.69Å
310	K	42.9	Very low	50.1	Low	89 Å²	89	76 Å²	76	39%	0.387	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	109.1	176.3	-67.2	-172.5	176.3	124.4	0	110.2	F294 D308 L403	F294-K310 HydrophobicContact CD1-CD 4.37Å; F294-K310 HydrophobicContact CD1-CG 3.95Å; F294-K310 HydrophobicContact CE1-CD 4.18Å; F294-K310 HydrophobicContact CE1-CG 4.13Å; D308-K310 WeakPolarHBondContact OD1-CE 3.33Å; D308-K310 WeakPolarHBondContact OD1-CG 3.11Å; D308-K310 IonicContact OD1-NZ 3.24Å; D308-K310 WeakPolarHBondContact OD2-CE 3.39Å; D308-K310 IonicContact OD2-NZ 3.4Å; D308-K310 PolarHBondContact OD2-NZ 3.39Å; K310-L403 PolarHBondContact O-N 3.26Å
311	G	47.3	Very low	50	Low	33 Å²	33	73.3 Å²	73.3	34%	0.34	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.3	175	0	0	0	0	0	110.9	G293	G293-G311 PolarHBondContact N-O 3.44Å; G293-G311 PolarHBondContact O-N 2.84Å; G293-G311 VanDerWaalsContact O-O 3.12Å
312	F	45.5	Very low	49.4	Very low	79 Å²	79	71.3 Å²	71.3	35%	0.346	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.1	166.3	67.1	-85.1	0	0	0	110.4	I291 D292 Q314 N401	I291-F312 CarbonylContact O-C 3.44Å; I291-F312 WeakPolarHBondContact O-CA 3.43Å; D292-F312 HydrophobicContact CB-CB 4.34Å; F312-Q314 HydrophobicContact CD2-CB 4.35Å; F312-N401 HydrophobicContact CD1-CB 4.27Å; F312-N401 HydrophobicContact CD2-CB 4.3Å; F312-N401 HydrophobicContact CE1-CB 3.56Å; F312-N401 HydrophobicContact CE2-CB 3.62Å; F312-N401 VanDerWaalsContact CE2-ND2 3.27Å; F312-N401 WeakPolarHBondContact CE2-ND2 3.48Å; F312-N401 HydrophobicContact CZ-CB 3.22Å; F312-N401 WeakPolarHBondContact CZ-ND2 3.27Å
313	I	42.8	Very low	49	Very low	74 Å²	74	69.6 Å²	69.6	38%	0.379	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117	174.7	-61.7	175.2	0	0	0	106.3	I291 F398	I291-I313 PolarHBondContact N-O 3.41Å; I291-I313 PolarHBondContact O-N 3Å; I313-F398 HydrophobicContact CG2-CD2 4.29Å; I313-F398 HydrophobicContact CG2-CE2 3.42Å; I313-F398 VanDerWaalsContact CG2-CE2 3.42Å; I313-F398 HydrophobicContact CG2-CZ 3.96Å
314	Q	49.1	Very low	48.6	Very low	50 Å²	50	70.4 Å²	70.4	23%	0.234	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.2	178.1	-173.3	178.5	6.4	0	0	109.3	I290 F312 T316 A399	I290-Q314 HydrophobicContact CG1-CG 4.19Å; F312-Q314 HydrophobicContact CD2-CB 4.35Å; Q314-T316 HydrophobicContact CG-CG2 3.66Å; Q314-T316 VanDerWaalsContact NE2-CG2 3.32Å; Q314-A399 PolarHBondContact N-O 3.13Å; Q314-A399 PolarHBondContact O-N 3.39Å
315	A	51.3	Low	48.5	Very low	44 Å²	44	61.2 Å²	61.2	36%	0.364	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	111.6	169	0	0	0	0	0	108.3	K289	K289-A315 PolarHBondContact N-O 2.98Å; K289-A315 PolarHBondContact O-N 3.05Å
316	T	49.9	Very low	49	Very low	28 Å²	28	61.8 Å²	61.8	17%	0.172	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.5	-178.1	58.1	0	0	0	0	111.5	D288 Q314 G395	D288-T316 WeakPolarHBondContact OD1-CA 3.43Å; D288-T316 WeakPolarHBondContact OD1-CB 3.38Å; D288-T316 WeakPolarHBondContact OD1-CG2 3.46Å; Q314-T316 HydrophobicContact CG-CG2 3.66Å; Q314-T316 VanDerWaalsContact NE2-CG2 3.32Å; T316-G395 CarbonylContact O-C 3.57Å
317	A	52.6	Low	49.3	Very low	21 Å²	21	56.9 Å²	56.9	17%	0.174	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	176.1	168.6	0	0	0	0	0	111.7	H287 H319 G395	H287-A317 HydrophobicContact CB-CB 4.02Å; H287-A317 PolarHBondContact O-N 3.31Å; A317-H319 PolarHBondContact O-N 3.16Å; A317-H319 VanDerWaalsContact O-N 3.15Å; A317-G395 VanDerWaalsContact C-CA 3.49Å; A317-G395 CarbonylContact C-O 3.49Å; A317-G395 WeakPolarHBondContact CA-O 3.31Å
318	N	49.1	Very low	49.6	Very low	91 Å²	91	53.7 Å²	53.7	49%	0.487	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-41.2	118.4	-175.5	-76.6	-31.2	0	0	0	113.3	G395	N318-G395 VanDerWaalsContact CA-CA 3.44Å; N318-G395 PolarHBondContact N-O 2.92Å; N318-G395 PolarHBondContact OD1-N 3.29Å
319	H	53.1	Low	50.3	Low	5 Å²	5	51.3 Å²	51.3	2%	0.023	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	112.9	-175.8	-157.9	112.2	0	0	0	111	D282 A317 Y321 A393	D282-H319 IonicContact OD1-CE1 3.99Å; D282-H319 PolarHBondContact OD1-CE1 2.96Å; D282-H319 IonicContact OD1-NE2 3.73Å; D282-H319 PolarHBondContact OD1-NE2 2.57Å; D282-H319 IonicContact OD2-CE1 2.93Å; D282-H319 PolarHBondContact OD2-CE1 3.37Å; D282-H319 VanDerWaalsContact OD2-CE1 3.24Å; D282-H319 IonicContact OD2-NE2 2.92Å; D282-H319 PolarHBondContact OD2-NE2 3.42Å; A317-H319 PolarHBondContact O-N 3.16Å; A317-H319 VanDerWaalsContact O-N 3.15Å; H319-Y321 HydrophobicContact CB-CD2 4.4Å; H319-Y321 HydrophobicContact CB-CE2 3.87Å; H319-Y321 AromaticContact CD2-CD1 3.52Å; H319-Y321 AromaticContact CD2-CD2 3.01Å; H319-Y321 WeakPolarHBondContact CD2-CD2 3.49Å; H319-Y321 AromaticContact CD2-CE1 3.39Å; H319-Y321 WeakPolarHBondContact CD2-CE1 3.15Å; H319-Y321 AromaticContact CD2-CE2 2.84Å; H319-Y321 WeakPolarHBondContact CD2-CE2 3.17Å; H319-Y321 AromaticContact CD2-CG 3.34Å; H319-Y321 AromaticContact CD2-CZ 3.01Å; H319-Y321 AromaticContact CE1-CE1 3.29Å; H319-Y321 WeakPolarHBondContact CE1-CE1 3.48Å; H319-Y321 AromaticContact CE1-CE2 3.81Å; H319-Y321 AromaticContact CE1-CZ 3.11Å; H319-Y321 PolarHBondContact CE1-OH 2.94Å; H319-Y321 AromaticContact CG-CD2 3.77Å; H319-Y321 AromaticContact CG-CE2 3.16Å; H319-Y321 AromaticContact CG-CZ 3.32Å; H319-Y321 AromaticContact ND1-CE2 3.77Å; H319-Y321 AromaticContact ND1-CZ 3.4Å; H319-Y321 PolarHBondContact ND1-OH 3.48Å; H319-Y321 VanDerWaalsContact ND1-OH 3.1Å; H319-Y321 AromaticContact NE2-CD1 3.12Å; H319-Y321 WeakPolarHBondContact NE2-CD1 3.28Å; H319-Y321 AromaticContact NE2-CD2 3.6Å; H319-Y321 AromaticContact NE2-CE1 2.83Å; H319-Y321 WeakPolarHBondContact NE2-CE1 3.36Å; H319-Y321 AromaticContact NE2-CE2 3.33Å; H319-Y321 VanDerWaalsContact NE2-CE2 3.33Å; H319-Y321 WeakPolarHBondContact NE2-CE2 3.34Å; H319-Y321 AromaticContact NE2-CG 3.49Å; H319-Y321 AromaticContact NE2-CZ 2.9Å; H319-Y321 PolarHBondContact NE2-OH 2.92Å; H319-A393 PolarHBondContact N-O 3.46Å; H319-A393 PolarHBondContact O-N 3.5Å
320	L	52.3	Low	50.6	Low	76 Å²	76	49.2 Å²	49.2	40%	0.398	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.4	170.8	178.9	69.3	0	0	0	109.8	I283 F392	I283-L320 HydrophobicContact CD1-CD2 4.46Å; I283-L320 PolarHBondContact N-O 3.4Å; I283-L320 VanDerWaalsContact N-O 3.12Å; I283-L320 PolarHBondContact O-N 2.87Å; L320-F392 HydrophobicContact CD1-CD2 3.76Å; L320-F392 HydrophobicContact CD1-CE2 4.42Å
321	Y	55.1	Low	51	Low	56 Å²	56	47 Å²	47	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.8	176.6	-67	-82	0	0	0	110	H319 E391	H319-Y321 HydrophobicContact CB-CD2 4.4Å; H319-Y321 HydrophobicContact CB-CE2 3.87Å; H319-Y321 AromaticContact CD2-CD1 3.52Å; H319-Y321 AromaticContact CD2-CD2 3.01Å; H319-Y321 WeakPolarHBondContact CD2-CD2 3.49Å; H319-Y321 AromaticContact CD2-CE1 3.39Å; H319-Y321 WeakPolarHBondContact CD2-CE1 3.15Å; H319-Y321 AromaticContact CD2-CE2 2.84Å; H319-Y321 WeakPolarHBondContact CD2-CE2 3.17Å; H319-Y321 AromaticContact CD2-CG 3.34Å; H319-Y321 AromaticContact CD2-CZ 3.01Å; H319-Y321 AromaticContact CE1-CE1 3.29Å; H319-Y321 WeakPolarHBondContact CE1-CE1 3.48Å; H319-Y321 AromaticContact CE1-CE2 3.81Å; H319-Y321 AromaticContact CE1-CZ 3.11Å; H319-Y321 PolarHBondContact CE1-OH 2.94Å; H319-Y321 AromaticContact CG-CD2 3.77Å; H319-Y321 AromaticContact CG-CE2 3.16Å; H319-Y321 AromaticContact CG-CZ 3.32Å; H319-Y321 AromaticContact ND1-CE2 3.77Å; H319-Y321 AromaticContact ND1-CZ 3.4Å; H319-Y321 PolarHBondContact ND1-OH 3.48Å; H319-Y321 VanDerWaalsContact ND1-OH 3.1Å; H319-Y321 AromaticContact NE2-CD1 3.12Å; H319-Y321 WeakPolarHBondContact NE2-CD1 3.28Å; H319-Y321 AromaticContact NE2-CD2 3.6Å; H319-Y321 AromaticContact NE2-CE1 2.83Å; H319-Y321 WeakPolarHBondContact NE2-CE1 3.36Å; H319-Y321 AromaticContact NE2-CE2 3.33Å; H319-Y321 VanDerWaalsContact NE2-CE2 3.33Å; H319-Y321 WeakPolarHBondContact NE2-CE2 3.34Å; H319-Y321 AromaticContact NE2-CG 3.49Å; H319-Y321 AromaticContact NE2-CZ 2.9Å; H319-Y321 PolarHBondContact NE2-OH 2.92Å; Y321-E391 PolarHBondContact N-O 3.29Å; Y321-E391 PolarHBondContact O-N 2.8Å; Y321-E391 VanDerWaalsContact O-O 3.1Å
322	Y	53.4	Low	51.3	Low	92 Å²	92	48.6 Å²	48.6	36%	0.361	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115	171.2	-179.5	-109.2	0	0	0	110.3	G280 I281 W324 L390	G280-Y322 CarbonylContact C-O 3.55Å; G280-Y322 WeakPolarHBondContact CA-O 3.15Å; I281-Y322 PolarHBondContact N-O 2.82Å; I281-Y322 PolarHBondContact O-N 3.14Å; Y322-W324 HydrophobicContact CE1-CB 4.07Å; Y322-L390 HydrophobicContact CD2-CD2 3.4Å; Y322-L390 VanDerWaalsContact CD2-CD2 3.4Å; Y322-L390 HydrophobicContact CD2-CG 4.17Å; Y322-L390 HydrophobicContact CE2-CD2 3.75Å; Y322-L390 HydrophobicContact CE2-CG 4.23Å
323	H	50.8	Low	51.5	Low	9 Å²	9	50.5 Å²	50.5	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126	175.8	-71.8	-108.3	0	0	0	111	H278 P366 A389	H278-H323 AromaticContact CE1-ND1 3.56Å; H278-H323 AromaticContact NE2-ND1 3.46Å; H278-H323 PolarHBondContact NE2-ND1 3.36Å; H323-P366 VanDerWaalsContact CB-CD 3.48Å; H323-P366 HydrophobicContact CB-CG 3.45Å; H323-P366 VanDerWaalsContact CB-CG 3.45Å; H323-P366 WeakPolarHBondContact CD2-CG 3.46Å; H323-A389 PolarHBondContact N-O 2.97Å; H323-A389 PolarHBondContact O-N 2.68Å
324	W	51.3	Low	52.1	Low	102 Å²	102	51.5 Å²	51.5	39%	0.386	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.7	176.3	174.9	54.2	0	0	0	109	T279 Y322 H326	T279-W324 PolarHBondContact N-O 2.68Å; T279-W324 PolarHBondContact O-N 3.42Å; Y322-W324 HydrophobicContact CE1-CB 4.07Å; W324-H326 AromaticContact CE2-ND1 3.77Å; W324-H326 AromaticContact CH2-CE1 3.52Å; W324-H326 AromaticContact CH2-ND1 3.43Å; W324-H326 WeakPolarHBondContact CH2-ND1 3.28Å; W324-H326 HydrophobicContact CZ2-CB 4.41Å; W324-H326 AromaticContact CZ2-CE1 3.91Å; W324-H326 AromaticContact CZ2-ND1 3.36Å; W324-H326 WeakPolarHBondContact CZ2-ND1 3.49Å; W324-H326 AromaticContact CZ3-CE1 3.94Å; W324-H326 AromaticContact CZ3-ND1 3.89Å
325	G	49.8	Very low	52.5	Low	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	108.9	-178.5	0	0	0	0	0	110.7
326	H	53.4	Low	52.9	Low	50 Å²	50	56 Å²	56	23%	0.231	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.2	170.3	64	-81.6	0	0	0	109.7	F277 W324	F277-H326 WeakPolarHBondContact CB-CE1 3.5Å; F277-H326 WeakPolarHBondContact CB-NE2 3.48Å; F277-H326 AromaticContact CD2-CD2 3.92Å; F277-H326 AromaticContact CD2-NE2 3.52Å; F277-H326 AromaticContact CG-CE1 3.95Å; F277-H326 AromaticContact CG-NE2 3.52Å; F277-H326 PolarHBondContact N-O 2.89Å; F277-H326 PolarHBondContact O-N 3.25Å; W324-H326 AromaticContact CE2-ND1 3.77Å; W324-H326 AromaticContact CH2-CE1 3.52Å; W324-H326 AromaticContact CH2-ND1 3.43Å; W324-H326 WeakPolarHBondContact CH2-ND1 3.28Å; W324-H326 HydrophobicContact CZ2-CB 4.41Å; W324-H326 AromaticContact CZ2-CE1 3.91Å; W324-H326 AromaticContact CZ2-ND1 3.36Å; W324-H326 WeakPolarHBondContact CZ2-ND1 3.49Å; W324-H326 AromaticContact CZ3-CE1 3.94Å; W324-H326 AromaticContact CZ3-ND1 3.89Å
327	L	51.8	Low	53.6	Low	9 Å²	9	58.9 Å²	58.9	5%	0.047	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	108.2	177	169.2	80.4	0	0	0	108	M276 R329 I372	M276-L327 HydrophobicContact CB-CD1 4.37Å; M276-L327 HydrophobicContact CG-CB 4.41Å; M276-L327 HydrophobicContact CG-CD1 3.09Å; M276-L327 HydrophobicContact CG-CG 4.33Å; M276-L327 HydrophobicContact SD-CD1 3.86Å; L327-R329 HydrophobicContact CD1-CG 3.86Å; L327-R329 HydrophobicContact CD2-CB 4.28Å; L327-R329 HydrophobicContact CD2-CG 4.01Å; L327-R329 HydrophobicContact CG-CB 4.09Å; L327-R329 HydrophobicContact CG-CG 3.85Å; L327-R329 PolarHBondContact O-N 3.48Å; L327-I372 HydrophobicContact CD2-CD1 3.18Å
328	V	52.4	Low	54.2	Low	72 Å²	72	62 Å²	62	44%	0.436	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	98.5	173.7	-172.3	0	0	0	0	107.1	H275 F277	H275-V328 PolarHBondContact N-O 3.21Å; H275-V328 PolarHBondContact O-N 3.29Å; H275-V328 VanDerWaalsContact O-O 3.04Å; F277-V328 HydrophobicContact CD2-CG2 4.21Å; F277-V328 HydrophobicContact CE2-CG2 4.41Å
329	R	55.5	Low	54.9	Low	10 Å²	10	60.2 Å²	60.2	4%	0.038	30%	0.3	C	S	.	.			trans	-121.8	148.5	-176.4	-108.7	-167.2	-148.8	140.9	27.3	112.5	S274 L327 L362 C379 H384	S274-R329 VanDerWaalsContact CB-CG 3.42Å; L327-R329 HydrophobicContact CD1-CG 3.86Å; L327-R329 HydrophobicContact CD2-CB 4.28Å; L327-R329 HydrophobicContact CD2-CG 4.01Å; L327-R329 HydrophobicContact CG-CB 4.09Å; L327-R329 HydrophobicContact CG-CG 3.85Å; L327-R329 PolarHBondContact O-N 3.48Å; R329-L362 VanDerWaalsContact NH2-CD2 3.27Å; R329-C379 PolarHBondContact NH1-SG 3.27Å; R329-H384 PolarHBondContact O-ND1 3.03Å
330	P	53.8	Low	55.6	Low	43 Å²	43	61.3 Å²	61.3	28%	0.279	31%	0.31	S	S	.	.			cis	-79.5	149	-37.2	35.1	-37.6	0	0	0	111.1	M273 P381	M273-P330 HydrophobicContact CB-CB 3.85Å; M273-P330 CarbonylContact O-C 3.55Å; M273-P330 VanDerWaalsContact O-C 3.32Å; M273-P330 WeakPolarHBondContact O-CA 3.28Å; M273-P330 WeakPolarHBondContact O-CB 3.38Å; P330-P381 HydrophobicContact CB-CB 4.41Å; P330-P381 WeakPolarHBondContact CD-O 3.22Å; P330-P381 HydrophobicContact CG-CB 3.51Å; P330-P381 WeakPolarHBondContact CG-O 3.23Å
331	V	50.9	Low	56.4	Low	43 Å²	43	58.7 Å²	58.7	26%	0.261	30%	0.297	S	S	.	.			trans	-87	123.5	156.9	-89.3	0	0	0	0	108.1	M273 H275 R333	M273-V331 WeakPolarHBondContact CA-O 3.33Å; M273-V331 PolarHBondContact O-N 3.05Å; H275-V331 WeakPolarHBondContact CD2-CG2 3.32Å; H275-V331 WeakPolarHBondContact NE2-CG2 3.32Å; V331-R333 HydrophobicContact CB-CG 4.26Å; V331-R333 HydrophobicContact CG2-CG 3.88Å; V331-R333 PolarHBondContact O-N 3.47Å
332	N	53.5	Low	57	Low	67 Å²	67	56.7 Å²	56.7	36%	0.358	29%	0.292	S	S	.	.			trans	-73.7	69.1	171.1	-172.6	16.9	0	0	0	110.5	Y334 N335 L336	N332-Y334 PolarHBondContact O-N 3.25Å; N332-N335 VanDerWaalsContact ND2-C 3.26Å; N332-N335 WeakPolarHBondContact ND2-CA 3.47Å; N332-N335 PolarHBondContact O-N 3.34Å; N332-N335 PolarHBondContact OD1-N 3.18Å; N332-L336 VanDerWaalsContact CG-N 3.26Å; N332-L336 PolarHBondContact ND2-N 2.7Å; N332-L336 PolarHBondContact ND2-O 3.37Å; N332-L336 PolarHBondContact OD1-N 2.92Å
333	R	49.2	Very low	57.6	Low	119 Å²	119	59.3 Å²	59.3	45%	0.449	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-32.7	-176	-73.6	-165.6	-174.6	179.2	13.9	112.9	H275 V331 N335	H275-R333 PolarHBondContact CE1-NH2 3.08Å; H275-R333 PolarHBondContact ND1-NH2 3.02Å; H275-R333 PolarHBondContact NE2-NE 3.33Å; V331-R333 HydrophobicContact CB-CG 4.26Å; V331-R333 HydrophobicContact CG2-CG 3.88Å; V331-R333 PolarHBondContact O-N 3.47Å; R333-N335 VanDerWaalsContact C-N 3.31Å
334	Y	55.3	Low	58.5	Low	94 Å²	94	62.3 Å²	62.3	37%	0.369	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	5.5	178.8	-52.4	-71.6	0	0	0	113.6	M244 L272 M273 N332 L336	M244-Y334 HydrophobicContact CE-CE1 4.21Å; M244-Y334 WeakPolarHBondContact CE-OH 3.03Å; M244-Y334 HydrophobicContact SD-CE1 4.06Å; M244-Y334 PolarHBondContact SD-OH 3.49Å; L272-Y334 HydrophobicContact CB-CE2 3.82Å; L272-Y334 HydrophobicContact CD1-CE2 4.34Å; L272-Y334 WeakPolarHBondContact CD2-OH 3.39Å; M273-Y334 HydrophobicContact CE-CD2 4.33Å; N332-Y334 PolarHBondContact O-N 3.25Å; Y334-L336 PolarHBondContact O-N 2.7Å; Y334-L336 VanDerWaalsContact O-N 3.14Å
335	N	57.9	Low	59.3	Low	138 Å²	138	60 Å²	60	74%	0.738	32%	0.323	S	S	*	.			trans	51.6	36.5	-176	-160.8	31.1	0	0	0	113.2	N332 R333 T337	N332-N335 VanDerWaalsContact ND2-C 3.26Å; N332-N335 WeakPolarHBondContact ND2-CA 3.47Å; N332-N335 PolarHBondContact O-N 3.34Å; N332-N335 PolarHBondContact OD1-N 3.18Å; R333-N335 VanDerWaalsContact C-N 3.31Å; N335-T337 PolarHBondContact O-N 2.85Å
336	L	59.4	Low	60.2	Low	50 Å²	50	66.6 Å²	66.6	26%	0.262	36%	0.357	S	S	.	.			trans	-62.5	134.1	175.6	-60.2	-171.6	0	0	0	110.6	M273 N332 Y334 A340 V341	M273-L336 HydrophobicContact CE-CD1 3.24Å; M273-L336 HydrophobicContact CE-CG 4.06Å; N332-L336 VanDerWaalsContact CG-N 3.26Å; N332-L336 PolarHBondContact ND2-N 2.7Å; N332-L336 PolarHBondContact ND2-O 3.37Å; N332-L336 PolarHBondContact OD1-N 2.92Å; Y334-L336 PolarHBondContact O-N 2.7Å; Y334-L336 VanDerWaalsContact O-N 3.14Å; L336-A340 HydrophobicContact CB-CB 4.25Å; L336-V341 HydrophobicContact CB-CG2 3.89Å; L336-V341 HydrophobicContact CD1-CG2 4.29Å
337	T	65.8	Low	61.2	Low	90 Å²	90	67.7 Å²	67.7	55%	0.552	37%	0.365	S	S	*	.			trans	-65.7	155.8	172.6	61	0	0	0	0	110.7	N335 A339 A340 V341	N335-T337 PolarHBondContact O-N 2.85Å; T337-A339 PolarHBondContact O-N 3.13Å; T337-A340 WeakPolarHBondContact O-CB 3.48Å; T337-A340 PolarHBondContact O-N 3.21Å; T337-A340 WeakPolarHBondContact OG1-CB 3.03Å; T337-A340 PolarHBondContact OG1-N 2.82Å; T337-V341 PolarHBondContact O-N 2.88Å
338	E	64.5	Low	62.1	Low	85 Å²	85	72.1 Å²	72.1	40%	0.397	39%	0.394	S	S	.	.	H	α-helix	trans	-54.6	-37.1	175.4	-64.6	177.4	-179.4	0	0	111.4	V341 A342 I449	E338-V341 PolarHBondContact O-N 2.72Å; E338-A342 WeakPolarHBondContact O-CB 3.48Å; E338-A342 PolarHBondContact O-N 3.43Å; E338-I449 HydrophobicContact CB-CD1 4.02Å; E338-I449 HydrophobicContact CB-CG1 4.38Å
339	A	63.4	Low	62.7	Low	55 Å²	55	71.9 Å²	71.9	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-41.9	174.3	0	0	0	0	0	112.8	T337 A342 Q343	T337-A339 PolarHBondContact O-N 3.13Å; A339-A342 PolarHBondContact O-N 2.89Å; A339-Q343 WeakPolarHBondContact O-CB 3.1Å; A339-Q343 WeakPolarHBondContact O-CG 3.36Å; A339-Q343 PolarHBondContact O-N 2.95Å
340	A	68	Low	63.4	Low	27 Å²	27	72.4 Å²	72.4	22%	0.223	39%	0.391	C	S	.	.	H	α-helix	trans	-64.9	-39.8	176.3	0	0	0	0	0	111.6	L336 T337 Q343 L344	L336-A340 HydrophobicContact CB-CB 4.25Å; T337-A340 WeakPolarHBondContact O-CB 3.48Å; T337-A340 PolarHBondContact O-N 3.21Å; T337-A340 WeakPolarHBondContact OG1-CB 3.03Å; T337-A340 PolarHBondContact OG1-N 2.82Å; A340-Q343 PolarHBondContact O-N 2.82Å; A340-L344 VanDerWaalsContact O-CB 3.32Å; A340-L344 WeakPolarHBondContact O-CB 3.48Å; A340-L344 PolarHBondContact O-N 2.86Å
341	V	69	Low	64.2	Low	21 Å²	21	79.7 Å²	79.7	13%	0.127	41%	0.413	C	S	.	.	H	α-helix	trans	-63.9	-42.2	174.1	177	0	0	0	0	111	L336 T337 E338 L344 S345 P381	L336-V341 HydrophobicContact CB-CG2 3.89Å; L336-V341 HydrophobicContact CD1-CG2 4.29Å; T337-V341 PolarHBondContact O-N 2.88Å; E338-V341 PolarHBondContact O-N 2.72Å; V341-L344 PolarHBondContact O-N 3.4Å; V341-S345 WeakPolarHBondContact O-CB 3.33Å; V341-S345 PolarHBondContact O-N 3.22Å; V341-S345 PolarHBondContact O-OG 3.49Å; V341-P381 HydrophobicContact CG1-CG 3.85Å
342	A	67.5	Low	65	Low	15 Å²	15	81.3 Å²	81.3	12%	0.124	41%	0.414	C	S	.	.	H	α-helix	trans	-62.3	-48.9	175.8	0	0	0	0	0	111.4	E338 A339 L344 S345 L346 F446	E338-A342 WeakPolarHBondContact O-CB 3.48Å; E338-A342 PolarHBondContact O-N 3.43Å; A339-A342 PolarHBondContact O-N 2.89Å; A342-L344 VanDerWaalsContact C-N 3.34Å; A342-L344 PolarHBondContact O-N 2.74Å; A342-S345 PolarHBondContact O-N 2.78Å; A342-S345 VanDerWaalsContact O-N 3.14Å; A342-S345 PolarHBondContact O-OG 3.47Å; A342-L346 WeakPolarHBondContact O-CB 3.47Å; A342-L346 WeakPolarHBondContact O-CG 2.93Å; A342-L346 PolarHBondContact O-N 2.88Å; A342-F446 HydrophobicContact CB-CE1 4.28Å
343	Q	65.7	Low	65.4	Low	146 Å²	146	80.9 Å²	80.9	68%	0.682	41%	0.412	S	S	*	.	H	α-helix	trans	-58.6	-43.7	175.3	-77.6	-177	-16.6	0	0	112.2	A339 A340 S345 L346 N347	A339-Q343 WeakPolarHBondContact O-CB 3.1Å; A339-Q343 WeakPolarHBondContact O-CG 3.36Å; A339-Q343 PolarHBondContact O-N 2.95Å; A340-Q343 PolarHBondContact O-N 2.82Å; Q343-S345 VanDerWaalsContact C-N 3.3Å; Q343-S345 PolarHBondContact O-N 3.46Å; Q343-L346 PolarHBondContact O-N 2.75Å; Q343-N347 WeakPolarHBondContact O-CB 3.38Å; Q343-N347 PolarHBondContact O-N 2.87Å
344	L	70.1	Confident	66.3	Low	73 Å²	73	78.6 Å²	78.6	38%	0.382	40%	0.403	S	S	.	.	H	α-helix	trans	-61.6	-41.7	176.6	-149.5	106.8	0	0	0	110.9	A340 V341 A342 N347 L350 V378	A340-L344 VanDerWaalsContact O-CB 3.32Å; A340-L344 WeakPolarHBondContact O-CB 3.48Å; A340-L344 PolarHBondContact O-N 2.86Å; V341-L344 PolarHBondContact O-N 3.4Å; A342-L344 VanDerWaalsContact C-N 3.34Å; A342-L344 PolarHBondContact O-N 2.74Å; L344-N347 WeakPolarHBondContact O-CB 3.18Å; L344-N347 PolarHBondContact O-N 3.21Å; L344-L350 HydrophobicContact CD2-CD2 3.65Å; L344-L350 HydrophobicContact CG-CD2 4Å; L344-L350 WeakPolarHBondContact O-CD2 3.4Å; L344-V378 HydrophobicContact CD2-CG2 4.15Å
345	S	69.3	Low	66.9	Low	54 Å²	54	76.6 Å²	76.6	38%	0.378	41%	0.411	S	S	.	.	H	α-helix	trans	-70.5	-32	179.5	77.2	0	0	0	0	113.8	V341 A342 Q343	V341-S345 WeakPolarHBondContact O-CB 3.33Å; V341-S345 PolarHBondContact O-N 3.22Å; V341-S345 PolarHBondContact O-OG 3.49Å; A342-S345 PolarHBondContact O-N 2.78Å; A342-S345 VanDerWaalsContact O-N 3.14Å; A342-S345 PolarHBondContact O-OG 3.47Å; Q343-S345 VanDerWaalsContact C-N 3.3Å; Q343-S345 PolarHBondContact O-N 3.46Å
346	L	68.1	Low	67.3	Low	137 Å²	137	77 Å²	77	72%	0.717	41%	0.41	S	S	*	.	H	α-helix	trans	-82.4	-15.8	176.4	-70.3	172.5	0	0	0	112.5	A342 Q343 P348	A342-L346 WeakPolarHBondContact O-CB 3.47Å; A342-L346 WeakPolarHBondContact O-CG 2.93Å; A342-L346 PolarHBondContact O-N 2.88Å; Q343-L346 PolarHBondContact O-N 2.75Å; L346-P348 WeakPolarHBondContact O-CD 3.47Å; L346-P348 VanDerWaalsContact O-N 3.16Å
347	N	74.4	Confident	67.3	Low	73 Å²	73	76.9 Å²	76.9	39%	0.39	41%	0.411	S	S	.	.			trans	-58.6	120.3	-178.3	-171	-38	0	0	0	110.4	Q343 L344 F349 L350 R351	Q343-N347 WeakPolarHBondContact O-CB 3.38Å; Q343-N347 PolarHBondContact O-N 2.87Å; L344-N347 WeakPolarHBondContact O-CB 3.18Å; L344-N347 PolarHBondContact O-N 3.21Å; N347-F349 PolarHBondContact O-N 2.8Å; N347-F349 WeakPolarHBondContact OD1-CB 3.47Å; N347-F349 PolarHBondContact OD1-N 2.73Å; N347-L350 HydrophobicContact CB-CB 4.25Å; N347-L350 PolarHBondContact O-N 3.24Å; N347-R351 PolarHBondContact O-N 2.93Å
348	P	71	Confident	66.9	Low	102 Å²	102	80.6 Å²	80.6	66%	0.662	42%	0.423	S	S	*	.	H	α-helix	trans	-59.9	-31.9	-177	23.4	-33.7	0	0	0	112.5	L346 R351 R352	L346-P348 WeakPolarHBondContact O-CD 3.47Å; L346-P348 VanDerWaalsContact O-N 3.16Å; P348-R351 PolarHBondContact O-N 3.3Å; P348-R352 PolarHBondContact O-N 3.12Å
349	F	64.5	Low	66.7	Low	67 Å²	67	82.5 Å²	82.5	29%	0.294	43%	0.429	S	S	.	.	H	α-helix	trans	-64.4	-52.8	176.4	179.6	-97.7	0	0	0	111.7	E145 F206 N347 R351 R352 L353	E145-F349 VanDerWaalsContact CD-CE2 3.47Å; E145-F349 WeakPolarHBondContact OE1-CE2 3.35Å; E145-F349 WeakPolarHBondContact OE2-CE2 3.42Å; E145-F349 VanDerWaalsContact OE2-CZ 3.26Å; E145-F349 WeakPolarHBondContact OE2-CZ 3.49Å; F206-F349 HydrophobicContact CE1-CE1 4.3Å; F206-F349 AromaticContact CE1-CZ 3.89Å; F206-F349 HydrophobicContact CE1-CZ 3.89Å; F206-F349 HydrophobicContact CE2-CE2 4.26Å; F206-F349 AromaticContact CE2-CZ 3.83Å; F206-F349 HydrophobicContact CE2-CZ 3.83Å; F206-F349 HydrophobicContact CZ-CE1 4.02Å; F206-F349 AromaticContact CZ-CE2 3.85Å; F206-F349 HydrophobicContact CZ-CE2 3.85Å; F206-F349 AromaticContact CZ-CZ 3.21Å; F206-F349 HydrophobicContact CZ-CZ 3.21Å; N347-F349 PolarHBondContact O-N 2.8Å; N347-F349 WeakPolarHBondContact OD1-CB 3.47Å; N347-F349 PolarHBondContact OD1-N 2.73Å; F349-R351 PolarHBondContact O-N 2.79Å; F349-R352 PolarHBondContact O-N 2.86Å; F349-L353 HydrophobicContact CD1-CD1 3.93Å; F349-L353 HydrophobicContact CD1-CG 4.47Å; F349-L353 HydrophobicContact CE1-CD1 3.21Å; F349-L353 HydrophobicContact CE1-CG 3.99Å; F349-L353 HydrophobicContact CZ-CD1 3.54Å; F349-L353 HydrophobicContact CZ-CD2 4.42Å; F349-L353 HydrophobicContact CZ-CG 4Å; F349-L353 PolarHBondContact O-N 3.38Å
350	L	70.6	Confident	66.5	Low	21 Å²	21	85.4 Å²	85.4	11%	0.11	43%	0.429	C	S	.	.	H	α-helix	trans	-61.3	-36.6	178.3	-164.1	77.9	0	0	0	110.9	L344 N347 R354 P377	L344-L350 HydrophobicContact CD2-CD2 3.65Å; L344-L350 HydrophobicContact CG-CD2 4Å; L344-L350 WeakPolarHBondContact O-CD2 3.4Å; N347-L350 HydrophobicContact CB-CB 4.25Å; N347-L350 PolarHBondContact O-N 3.24Å; L350-R354 VanDerWaalsContact O-CB 3.28Å; L350-R354 WeakPolarHBondContact O-CB 3.36Å; L350-R354 WeakPolarHBondContact O-CG 3.17Å; L350-R354 PolarHBondContact O-N 2.65Å; L350-P377 HydrophobicContact CD1-CG 3.86Å
351	R	69.7	Low	66.1	Low	196 Å²	196	85.4 Å²	85.4	74%	0.74	43%	0.426	S	S	*	.	H	α-helix	trans	-66.2	-37.1	175.5	-173.8	175.8	161.4	179.6	-5.4	112.4	N347 P348 F349 G355	N347-R351 PolarHBondContact O-N 2.93Å; P348-R351 PolarHBondContact O-N 3.3Å; F349-R351 PolarHBondContact O-N 2.79Å; R351-G355 PolarHBondContact O-N 2.74Å
352	R	67.7	Low	65.4	Low	78 Å²	78	84.5 Å²	84.5	29%	0.294	42%	0.421	S	S	.	.	H	α-helix	trans	-69	-48.4	176.2	-173.1	-178.8	-72	172.1	6.8	111.7	K148 P348 F349 R354 G355 M356	K148-R352 VanDerWaalsContact CE-NH2 3.31Å; P348-R352 PolarHBondContact O-N 3.12Å; F349-R352 PolarHBondContact O-N 2.86Å; R352-R354 VanDerWaalsContact C-N 3.29Å; R352-R354 PolarHBondContact O-N 3Å; R352-G355 VanDerWaalsContact O-CA 3.28Å; R352-G355 WeakPolarHBondContact O-CA 3.26Å; R352-G355 PolarHBondContact O-N 2.81Å; R352-M356 HydrophobicContact CG-CE 3.94Å; R352-M356 PolarHBondContact O-N 3.01Å
353	L	63.2	Low	64.9	Low	57 Å²	57	84 Å²	84	30%	0.298	42%	0.416	S	S	.	.	H	α-helix	trans	-57.7	-43.3	173.5	-73.4	-178.6	0	0	0	111.6	F349 G355 M356 T357	F349-L353 HydrophobicContact CD1-CD1 3.93Å; F349-L353 HydrophobicContact CD1-CG 4.47Å; F349-L353 HydrophobicContact CE1-CD1 3.21Å; F349-L353 HydrophobicContact CE1-CG 3.99Å; F349-L353 HydrophobicContact CZ-CD1 3.54Å; F349-L353 HydrophobicContact CZ-CD2 4.42Å; F349-L353 HydrophobicContact CZ-CG 4Å; F349-L353 PolarHBondContact O-N 3.38Å; L353-G355 VanDerWaalsContact C-N 3.29Å; L353-G355 PolarHBondContact O-N 2.88Å; L353-M356 PolarHBondContact O-N 2.91Å; L353-T357 VanDerWaalsContact O-CG2 3.28Å; L353-T357 WeakPolarHBondContact O-CG2 3.35Å; L353-T357 PolarHBondContact O-N 3.03Å; L353-T357 PolarHBondContact O-OG1 3.37Å
354	R	67.9	Low	64.3	Low	72 Å²	72	78.7 Å²	78.7	27%	0.272	39%	0.394	S	S	.	.	H	α-helix	trans	-62.2	-38.1	171.8	-73.7	179.3	76.4	177.5	4.5	111.5	L350 R352 M356 T357 K375	L350-R354 VanDerWaalsContact O-CB 3.28Å; L350-R354 WeakPolarHBondContact O-CB 3.36Å; L350-R354 WeakPolarHBondContact O-CG 3.17Å; L350-R354 PolarHBondContact O-N 2.65Å; R352-R354 VanDerWaalsContact C-N 3.29Å; R352-R354 PolarHBondContact O-N 3Å; R354-M356 PolarHBondContact O-N 2.92Å; R354-T357 WeakPolarHBondContact CA-OG1 3.37Å; R354-T357 PolarHBondContact O-N 2.74Å; R354-T357 PolarHBondContact O-OG1 3.15Å; R354-K375 HydrophobicContact CB-CB 4.46Å; R354-K375 HydrophobicContact CG-CB 4.45Å; R354-K375 WeakPolarHBondContact O-CD 3.36Å; R354-K375 WeakPolarHBondContact O-CE 3.08Å; R354-K375 PolarHBondContact O-NZ 3.03Å
355	G	67.7	Low	63.6	Low	51 Å²	51	75.5 Å²	75.5	53%	0.526	38%	0.377	S	S	.	.	H	α-helix	trans	-54.3	-50.2	174.4	0	0	0	0	0	112.5	R351 R352 L353 K375	R351-G355 PolarHBondContact O-N 2.74Å; R352-G355 VanDerWaalsContact O-CA 3.28Å; R352-G355 WeakPolarHBondContact O-CA 3.26Å; R352-G355 PolarHBondContact O-N 2.81Å; L353-G355 VanDerWaalsContact C-N 3.29Å; L353-G355 PolarHBondContact O-N 2.88Å; G355-K375 PolarHBondContact O-NZ 3.29Å; G355-K375 VanDerWaalsContact O-NZ 3.08Å
356	M	65.5	Low	62.6	Low	147 Å²	147	73.4 Å²	73.4	72%	0.724	36%	0.362	S	S	*	.	H	α-helix	trans	-74.4	-28	-176.7	-64.9	173	175.2	0	0	113.8	R352 L353 R354	R352-M356 HydrophobicContact CG-CE 3.94Å; R352-M356 PolarHBondContact O-N 3.01Å; L353-M356 PolarHBondContact O-N 2.91Å; R354-M356 PolarHBondContact O-N 2.92Å
357	T	59.6	Low	61.8	Low	47 Å²	47	71.2 Å²	71.2	29%	0.288	35%	0.347	S	S	.	.	S	Bend	trans	-79.3	137.4	-177.4	48.9	0	0	0	0	112.9	L353 R354 K375 P376	L353-T357 VanDerWaalsContact O-CG2 3.28Å; L353-T357 WeakPolarHBondContact O-CG2 3.35Å; L353-T357 PolarHBondContact O-N 3.03Å; L353-T357 PolarHBondContact O-OG1 3.37Å; R354-T357 WeakPolarHBondContact CA-OG1 3.37Å; R354-T357 PolarHBondContact O-N 2.74Å; R354-T357 PolarHBondContact O-OG1 3.15Å; T357-K375 WeakPolarHBondContact O-CE 3.27Å; T357-K375 PolarHBondContact O-NZ 3.17Å; T357-P376 HydrophobicContact CG2-CG 4.35Å
358	Q	57.4	Low	60.7	Low	169 Å²	169	73.1 Å²	73.1	79%	0.79	36%	0.357	S	S	*	.			trans	-70.9	144.5	173.5	-164.5	177.5	13.7	0	0	110.8	R360	Q358-R360 PolarHBondContact O-N 2.98Å
359	K	61.4	Low	59.9	Low	124 Å²	124	72.3 Å²	72.3	54%	0.539	34%	0.341	S	S	.	.			trans	-65.1	114.4	174.3	-67.1	179.5	179	179.4	0	109.5	R373 C374 K375	K359-R373 HydrophobicContact CB-CB 3.87Å; K359-C374 CarbonylContact C-O 3.58Å; K359-C374 WeakPolarHBondContact CA-O 3.42Å; K359-K375 HydrophobicContact CG-CD 4.27Å; K359-K375 HydrophobicContact CG-CG 3.79Å
360	R	58.6	Low	59.6	Low	116 Å²	116	70.8 Å²	70.8	44%	0.438	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.7	176.6	-63.2	-170.8	176	-149.6	-6.2	111.3	L268 D270 F271 Q358 R373 C374	L268-R360 HydrophobicContact CD1-CB 4.26Å; L268-R360 HydrophobicContact CD2-CB 4.34Å; D270-R360 WeakPolarHBondContact OD2-CD 3.33Å; D270-R360 IonicContact OD2-CZ 3.57Å; D270-R360 IonicContact OD2-NE 3.88Å; D270-R360 IonicContact OD2-NH1 2.7Å; D270-R360 PolarHBondContact OD2-NH1 2.05Å; F271-R360 HydrophobicContact CE2-CB 4.25Å; F271-R360 HydrophobicContact CZ-CB 4.24Å; Q358-R360 PolarHBondContact O-N 2.98Å; R360-R373 CarbonylContact O-C 3.53Å; R360-R373 VanDerWaalsContact O-CA 3.28Å; R360-R373 WeakPolarHBondContact O-CA 3.48Å; R360-C374 PolarHBondContact N-O 3Å; R360-C374 PolarHBondContact O-N 2.92Å
361	P	58.2	Low	59.1	Low	27 Å²	27	70.6 Å²	70.6	18%	0.175	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	126.2	176.9	31.3	-33.4	0	0	0	109.7	I266 L268 V364 I370	I266-P361 HydrophobicContact CD1-CG 4.31Å; L268-P361 WeakPolarHBondContact CD1-O 3.17Å; P361-V364 HydrophobicContact CB-CG2 4.32Å; P361-I370 HydrophobicContact CB-CB 4.3Å; P361-I370 HydrophobicContact CB-CD1 3.69Å; P361-I370 HydrophobicContact CB-CG1 3.78Å; P361-I370 HydrophobicContact CB-CG2 3.49Å; P361-I370 VanDerWaalsContact CB-CG2 3.49Å; P361-I370 HydrophobicContact CG-CD1 4.4Å
362	L	55.2	Low	58.7	Low	3 Å²	3	62.1 Å²	62.1	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-52.7	-178.4	-66	116.5	0	0	0	112.3	F271 M276 R329 I372 C374 C379	F271-L362 HydrophobicContact CB-CD2 4.02Å; F271-L362 HydrophobicContact CD1-CD2 3.84Å; F271-L362 HydrophobicContact CD2-CD2 3.17Å; F271-L362 HydrophobicContact CD2-CG 4.19Å; F271-L362 HydrophobicContact CE1-CD2 4.04Å; F271-L362 HydrophobicContact CE2-CD2 3.41Å; F271-L362 VanDerWaalsContact CE2-CD2 3.41Å; F271-L362 HydrophobicContact CE2-CG 3.94Å; F271-L362 HydrophobicContact CG-CD2 3.39Å; F271-L362 HydrophobicContact CZ-CD1 4.43Å; F271-L362 HydrophobicContact CZ-CD2 3.83Å; F271-L362 HydrophobicContact CZ-CG 4.22Å; M276-L362 HydrophobicContact CE-CB 4.21Å; M276-L362 WeakPolarHBondContact CE-O 3.39Å; M276-L362 HydrophobicContact SD-CB 3.95Å; R329-L362 VanDerWaalsContact NH2-CD2 3.27Å; L362-I372 HydrophobicContact CD1-CG2 4.04Å; L362-I372 PolarHBondContact N-O 3.46Å; L362-I372 VanDerWaalsContact N-O 3.15Å; L362-C374 HydrophobicContact CD1-CB 3.47Å; L362-C374 VanDerWaalsContact CD1-CB 3.47Å; L362-C374 WeakPolarHBondContact CD1-SG 3.43Å; L362-C379 VanDerWaalsContact CD1-SG 3.58Å
363	L	56.6	Low	58.6	Low	5 Å²	5	65.2 Å²	65.2	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.2	175.3	-174.9	67	0	0	0	107.3	M276 H278 L365 P371 A387	M276-L363 HydrophobicContact SD-CB 4.02Å; M276-L363 HydrophobicContact SD-CD1 4.32Å; H278-L363 HydrophobicContact CB-CD1 4.17Å; L363-L365 HydrophobicContact CD2-CD1 4.36Å; L363-L365 HydrophobicContact CD2-CD2 4.18Å; L363-L365 HydrophobicContact CD2-CG 4.15Å; L363-L365 HydrophobicContact CG-CD2 4.26Å; L363-L365 HydrophobicContact CG-CG 4.18Å; L363-P371 HydrophobicContact CB-CG 4.36Å; L363-P371 HydrophobicContact CD2-CG 4.1Å; L363-P371 WeakPolarHBondContact O-CD 3.43Å; L363-A387 HydrophobicContact CD2-CB 4.26Å
364	V	54.6	Low	58.7	Low	34 Å²	34	63.2 Å²	63.2	21%	0.206	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.5	171.4	-172.4	0	0	0	0	106.4	P361 I370	P361-V364 HydrophobicContact CB-CG2 4.32Å; V364-I370 HydrophobicContact CG2-CG1 4.23Å
365	L	54.7	Low	58.6	Low	5 Å²	5	62.3 Å²	62.3	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	170.8	171.4	-68.2	177.7	0	0	0	109.1	L363 D368 Y369 P371 A387 A389	L363-L365 HydrophobicContact CD2-CD1 4.36Å; L363-L365 HydrophobicContact CD2-CD2 4.18Å; L363-L365 HydrophobicContact CD2-CG 4.15Å; L363-L365 HydrophobicContact CG-CD2 4.26Å; L363-L365 HydrophobicContact CG-CG 4.18Å; L365-D368 PolarHBondContact O-N 2.98Å; L365-Y369 HydrophobicContact CB-CD1 4.14Å; L365-Y369 WeakPolarHBondContact CB-O 3.26Å; L365-Y369 HydrophobicContact CD1-CD1 3.97Å; L365-Y369 HydrophobicContact CD1-CE1 4.33Å; L365-Y369 PolarHBondContact N-O 3.24Å; L365-Y369 PolarHBondContact O-N 3.07Å; L365-P371 HydrophobicContact CD1-CG 4.33Å; L365-A387 HydrophobicContact CD1-CB 3.49Å; L365-A387 VanDerWaalsContact CD1-CB 3.49Å; L365-A389 HydrophobicContact CB-CB 3.93Å; L365-A389 HydrophobicContact CD1-CB 4.02Å; L365-A389 HydrophobicContact CD2-CB 4.47Å; L365-A389 HydrophobicContact CG-CB 4.37Å
366	P	47.9	Very low	58.3	Low	10 Å²	10	60.8 Å²	60.8	7%	0.065	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-44.2	141.5	-176.2	-34.8	39.5	0	0	0	115.3	H323 D368 Y369 A389	H323-P366 VanDerWaalsContact CB-CD 3.48Å; H323-P366 HydrophobicContact CB-CG 3.45Å; H323-P366 VanDerWaalsContact CB-CG 3.45Å; H323-P366 WeakPolarHBondContact CD2-CG 3.46Å; P366-D368 VanDerWaalsContact C-N 3.3Å; P366-D368 PolarHBondContact O-N 3.18Å; P366-Y369 PolarHBondContact O-N 3.34Å; P366-A389 HydrophobicContact CG-CB 4.3Å
367	K	51	Low	57.8	Low	92 Å²	92	55.9 Å²	55.9	40%	0.4	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	46.8	48.2	-172.1	-67.2	-129.4	-166	-178.2	0	113.9	Y369 E391 R433	K367-Y369 PolarHBondContact O-N 3.37Å; K367-Y369 VanDerWaalsContact O-N 3.15Å; K367-E391 WeakPolarHBondContact CE-OE1 3.42Å; K367-R433 VanDerWaalsContact CB-NH2 3.33Å; K367-R433 VanDerWaalsContact CD-NH2 3.31Å; K367-R433 VanDerWaalsContact CG-NH2 3.25Å
368	D	51.2	Low	57.9	Low	113 Å²	113	54.5 Å²	54.5	60%	0.604	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	60.9	25.1	172.1	-51.9	-43.4	0	0	0	114.6	L365 P366 I370	L365-D368 PolarHBondContact O-N 2.98Å; P366-D368 VanDerWaalsContact C-N 3.3Å; P366-D368 PolarHBondContact O-N 3.18Å; D368-I370 WeakPolarHBondContact O-CG1 2.83Å; D368-I370 PolarHBondContact O-N 3.3Å; D368-I370 VanDerWaalsContact O-N 3.1Å
369	Y	54.6	Low	58.2	Low	84 Å²	84	46.9 Å²	46.9	33%	0.329	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	111.2	170.5	179	-99.9	0	0	0	109.5	L365 P366 K367 P371 V435	L365-Y369 HydrophobicContact CB-CD1 4.14Å; L365-Y369 WeakPolarHBondContact CB-O 3.26Å; L365-Y369 HydrophobicContact CD1-CD1 3.97Å; L365-Y369 HydrophobicContact CD1-CE1 4.33Å; L365-Y369 PolarHBondContact N-O 3.24Å; L365-Y369 PolarHBondContact O-N 3.07Å; P366-Y369 PolarHBondContact O-N 3.34Å; K367-Y369 PolarHBondContact O-N 3.37Å; K367-Y369 VanDerWaalsContact O-N 3.15Å; Y369-P371 HydrophobicContact CD1-CG 4.5Å; Y369-P371 HydrophobicContact CE1-CB 3.77Å; Y369-P371 HydrophobicContact CE1-CG 4.16Å; Y369-P371 VanDerWaalsContact O-CD 3.27Å; Y369-P371 WeakPolarHBondContact O-CD 3.29Å; Y369-V435 HydrophobicContact CD1-CG1 3.25Å; Y369-V435 HydrophobicContact CD2-CG1 3.8Å; Y369-V435 HydrophobicContact CE1-CG1 3.09Å; Y369-V435 HydrophobicContact CE2-CG1 3.67Å; Y369-V435 HydrophobicContact CG-CG1 3.59Å
370	I	59.3	Low	58.2	Low	36 Å²	36	44.3 Å²	44.3	19%	0.185	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	95.7	-176.7	-63.4	151.7	0	0	0	108.1	P361 V364 D368 I372 R373	P361-I370 HydrophobicContact CB-CB 4.3Å; P361-I370 HydrophobicContact CB-CD1 3.69Å; P361-I370 HydrophobicContact CB-CG1 3.78Å; P361-I370 HydrophobicContact CB-CG2 3.49Å; P361-I370 VanDerWaalsContact CB-CG2 3.49Å; P361-I370 HydrophobicContact CG-CD1 4.4Å; V364-I370 HydrophobicContact CG2-CG1 4.23Å; D368-I370 WeakPolarHBondContact O-CG1 2.83Å; D368-I370 PolarHBondContact O-N 3.3Å; D368-I370 VanDerWaalsContact O-N 3.1Å; I370-I372 VanDerWaalsContact CG2-O 3.31Å; I370-I372 WeakPolarHBondContact CG2-O 3.38Å; I370-I372 PolarHBondContact O-N 3.22Å; I370-R373 HydrophobicContact CG2-CG 3.61Å
371	P	58.8	Low	58.3	Low	16 Å²	16	40.1 Å²	40.1	10%	0.104	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	-24.1	179.3	24.8	-32.9	0	0	0	112.2	L363 L365 Y369 A387 H439	L363-P371 HydrophobicContact CB-CG 4.36Å; L363-P371 HydrophobicContact CD2-CG 4.1Å; L363-P371 WeakPolarHBondContact O-CD 3.43Å; L365-P371 HydrophobicContact CD1-CG 4.33Å; Y369-P371 HydrophobicContact CD1-CG 4.5Å; Y369-P371 HydrophobicContact CE1-CB 3.77Å; Y369-P371 HydrophobicContact CE1-CG 4.16Å; Y369-P371 VanDerWaalsContact O-CD 3.27Å; Y369-P371 WeakPolarHBondContact O-CD 3.29Å; P371-A387 HydrophobicContact CB-CB 4.21Å; P371-A387 HydrophobicContact CG-CB 3.9Å; P371-H439 PolarHBondContact O-CE1 2.97Å
372	I	62	Low	58.4	Low	19 Å²	19	41.2 Å²	41.2	10%	0.097	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	130.7	-178	-49.1	162.8	0	0	0	112	L327 L362 I370 T385	L327-I372 HydrophobicContact CD2-CD1 3.18Å; L362-I372 HydrophobicContact CD1-CG2 4.04Å; L362-I372 PolarHBondContact N-O 3.46Å; L362-I372 VanDerWaalsContact N-O 3.15Å; I370-I372 VanDerWaalsContact CG2-O 3.31Å; I370-I372 WeakPolarHBondContact CG2-O 3.38Å; I370-I372 PolarHBondContact O-N 3.22Å; I372-T385 HydrophobicContact CD1-CG2 3.41Å; I372-T385 VanDerWaalsContact CD1-CG2 3.41Å; I372-T385 VanDerWaalsContact CD1-OG1 3.27Å; I372-T385 WeakPolarHBondContact CD1-OG1 3.11Å; I372-T385 HydrophobicContact CG1-CG2 3.73Å
373	R	65.1	Low	58.5	Low	142 Å²	142	43.9 Å²	43.9	54%	0.536	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.1	166.2	-54.8	177.5	179.6	-112.8	1.8	109.4	K359 R360 I370	K359-R373 HydrophobicContact CB-CB 3.87Å; R360-R373 CarbonylContact O-C 3.53Å; R360-R373 VanDerWaalsContact O-CA 3.28Å; R360-R373 WeakPolarHBondContact O-CA 3.48Å; I370-R373 HydrophobicContact CG2-CG 3.61Å
374	C	65.4	Low	58.9	Low	15 Å²	15	48.5 Å²	48.5	10%	0.101	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	160.1	173.5	-65	0	0	0	0	111.2	F271 K359 R360 L362 C379	F271-C374 HydrophobicContact CD1-CB 4.34Å; F271-C374 HydrophobicContact CE1-CB 3.46Å; F271-C374 VanDerWaalsContact CE1-CB 3.46Å; F271-C374 HydrophobicContact CZ-CB 3.87Å; K359-C374 CarbonylContact C-O 3.58Å; K359-C374 WeakPolarHBondContact CA-O 3.42Å; R360-C374 PolarHBondContact N-O 3Å; R360-C374 PolarHBondContact O-N 2.92Å; L362-C374 HydrophobicContact CD1-CB 3.47Å; L362-C374 VanDerWaalsContact CD1-CB 3.47Å; L362-C374 WeakPolarHBondContact CD1-SG 3.43Å; C374-C379 HydrophobicContact CB-CB 4.09Å; C374-C379 WeakPolarHBondContact CB-SG 2.89Å; C374-C379 WeakPolarHBondContact SG-CB 3.28Å; C374-C379 CovalentContact SG-SG 2.05Å; C374-C379 PolarHBondContact SG-SG 2.91Å
375	K	66.8	Low	59.2	Low	54 Å²	54	47.1 Å²	47.1	24%	0.235	23%	0.229	C	C	.	.			trans	-91.7	126.1	167.4	-69.1	169.2	153.5	-136.4	0	108.5	R354 G355 T357 K359	R354-K375 HydrophobicContact CB-CB 4.46Å; R354-K375 HydrophobicContact CG-CB 4.45Å; R354-K375 WeakPolarHBondContact O-CD 3.36Å; R354-K375 WeakPolarHBondContact O-CE 3.08Å; R354-K375 PolarHBondContact O-NZ 3.03Å; G355-K375 PolarHBondContact O-NZ 3.29Å; G355-K375 VanDerWaalsContact O-NZ 3.08Å; T357-K375 WeakPolarHBondContact O-CE 3.27Å; T357-K375 PolarHBondContact O-NZ 3.17Å; K359-K375 HydrophobicContact CG-CD 4.27Å; K359-K375 HydrophobicContact CG-CG 3.79Å
376	P	60.2	Low	59.7	Low	19 Å²	19	50.5 Å²	50.5	12%	0.123	25%	0.25	C	S	.	.	S	Bend	trans	-61.5	159.9	173	27.2	-33.6	0	0	0	111.1	D270 F271 T357	D270-P376 HydrophobicContact CB-CB 4.02Å; F271-P376 HydrophobicContact CE1-CB 4.14Å; F271-P376 HydrophobicContact CZ-CB 4.15Å; T357-P376 HydrophobicContact CG2-CG 4.35Å
377	P	56	Low	60.3	Low	43 Å²	43	50.1 Å²	50.1	28%	0.279	25%	0.247	S	C	.	.	S	Bend	cis	-90.2	-11.5	1.9	32.8	-32.9	0	0	0	114.9	D270 F271 L350	D270-P377 WeakPolarHBondContact O-CA 3.48Å; F271-P377 WeakPolarHBondContact CA-O 3.31Å; L350-P377 HydrophobicContact CD1-CG 3.86Å
378	V	61.6	Low	60.8	Low	18 Å²	18	48.2 Å²	48.2	11%	0.109	24%	0.242	C	C	.	.			trans	-127.4	121.9	-175	-174.9	0	0	0	0	110.5	M273 L344	M273-V378 HydrophobicContact SD-CG1 4.04Å; L344-V378 HydrophobicContact CD2-CG2 4.15Å
379	C	63.3	Low	61.1	Low	9 Å²	9	42.9 Å²	42.9	6%	0.061	21%	0.213	C	C	.	.			trans	-69.3	160.7	167.4	-82.9	0	0	0	0	111	R329 L362 C374 P381	R329-C379 PolarHBondContact NH1-SG 3.27Å; L362-C379 VanDerWaalsContact CD1-SG 3.58Å; C374-C379 HydrophobicContact CB-CB 4.09Å; C374-C379 WeakPolarHBondContact CB-SG 2.89Å; C374-C379 WeakPolarHBondContact SG-CB 3.28Å; C374-C379 CovalentContact SG-SG 2.05Å; C374-C379 PolarHBondContact SG-SG 2.91Å; C379-P381 VanDerWaalsContact O-CD 3.25Å; C379-P381 WeakPolarHBondContact O-CD 3.25Å; C379-P381 VanDerWaalsContact O-N 3.08Å
380	N	61.8	Low	61.3	Low	70 Å²	70	42.3 Å²	42.3	37%	0.374	22%	0.215	S	C	.	.			trans	-56.1	118.6	170.4	-174.9	-12.6	0	0	0	109.7	Y382 I383	N380-Y382 PolarHBondContact O-N 2.95Å; N380-Y382 WeakPolarHBondContact OD1-CD2 3.08Å; N380-Y382 PolarHBondContact OD1-N 3.22Å; N380-I383 HydrophobicContact CB-CD1 4.14Å; N380-I383 HydrophobicContact CB-CG1 4.37Å; N380-I383 VanDerWaalsContact ND2-CD1 3.26Å; N380-I383 WeakPolarHBondContact ND2-CD1 3.49Å
381	P	59.2	Low	61.3	Low	28 Å²	28	41.2 Å²	41.2	18%	0.182	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-14	-177.1	30	-35.9	0	0	0	113.6	P330 V341 C379	P330-P381 HydrophobicContact CB-CB 4.41Å; P330-P381 WeakPolarHBondContact CD-O 3.22Å; P330-P381 HydrophobicContact CG-CB 3.51Å; P330-P381 WeakPolarHBondContact CG-O 3.23Å; V341-P381 HydrophobicContact CG1-CG 3.85Å; C379-P381 VanDerWaalsContact O-CD 3.25Å; C379-P381 WeakPolarHBondContact O-CD 3.25Å; C379-P381 VanDerWaalsContact O-N 3.08Å
382	Y	60.5	Low	61.3	Low	51 Å²	51	45.6 Å²	45.6	20%	0.2	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	6.7	-171.5	-55.2	-69.8	0	0	0	114.5	N380 S441 P445 F446	N380-Y382 PolarHBondContact O-N 2.95Å; N380-Y382 WeakPolarHBondContact OD1-CD2 3.08Å; N380-Y382 PolarHBondContact OD1-N 3.22Å; Y382-S441 VanDerWaalsContact O-CA 3.26Å; Y382-S441 WeakPolarHBondContact O-CA 3.44Å; Y382-S441 VanDerWaalsContact O-CB 3.25Å; Y382-S441 WeakPolarHBondContact O-CB 2.93Å; Y382-P445 HydrophobicContact CD1-CB 3.23Å; Y382-P445 HydrophobicContact CD2-CB 3.52Å; Y382-P445 HydrophobicContact CD2-CG 4.14Å; Y382-P445 HydrophobicContact CE1-CB 3.59Å; Y382-P445 HydrophobicContact CE2-CB 3.87Å; Y382-P445 HydrophobicContact CG-CB 3.18Å; Y382-P445 HydrophobicContact CG-CG 4.15Å; Y382-F446 HydrophobicContact CE2-CE1 4.1Å; Y382-F446 HydrophobicContact CE2-CZ 4.03Å; Y382-F446 WeakPolarHBondContact OH-CE1 3.48Å
383	I	58.6	Low	61.1	Low	58 Å²	58	45.3 Å²	45.3	30%	0.297	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	110.1	179.6	-55.6	175.8	0	0	0	108.4	N380 H439 L440	N380-I383 HydrophobicContact CB-CD1 4.14Å; N380-I383 HydrophobicContact CB-CG1 4.37Å; N380-I383 VanDerWaalsContact ND2-CD1 3.26Å; N380-I383 WeakPolarHBondContact ND2-CD1 3.49Å; I383-H439 HydrophobicContact CG2-CB 4.05Å; I383-L440 CarbonylContact C-O 3.52Å
384	H	64	Low	60.5	Low	102 Å²	102	46.6 Å²	46.6	47%	0.472	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	147.5	167.4	-54.6	-71.7	0	0	0	109.8	R329 H439 L440	R329-H384 PolarHBondContact O-ND1 3.03Å; H384-H439 CarbonylContact O-C 3.48Å; H384-H439 VanDerWaalsContact O-CA 3.3Å; H384-H439 WeakPolarHBondContact O-CA 3.29Å; H384-L440 HydrophobicContact CB-CB 4.23Å; H384-L440 PolarHBondContact N-O 2.98Å; H384-L440 PolarHBondContact O-N 2.85Å
385	T	60.5	Low	59.9	Low	5 Å²	5	46 Å²	46	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	126.7	177.3	-53.9	0	0	0	0	111.2	I372 H438 H439	I372-T385 HydrophobicContact CD1-CG2 3.41Å; I372-T385 VanDerWaalsContact CD1-CG2 3.41Å; I372-T385 VanDerWaalsContact CD1-OG1 3.27Å; I372-T385 WeakPolarHBondContact CD1-OG1 3.11Å; I372-T385 HydrophobicContact CG1-CG2 3.73Å; T385-H438 VanDerWaalsContact CA-O 3.28Å; T385-H438 WeakPolarHBondContact CA-O 2.97Å; T385-H439 VanDerWaalsContact CG2-CE1 3.41Å; T385-H439 WeakPolarHBondContact CG2-CE1 3.19Å; T385-H439 WeakPolarHBondContact CG2-ND1 3.48Å; T385-H439 PolarHBondContact OG1-ND1 3.35Å
386	V	66	Low	59.2	Low	77 Å²	77	49.4 Å²	49.4	47%	0.467	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	134.5	173.7	179.4	0	0	0	0	107.5	H438	V386-H438 PolarHBondContact N-O 3.29Å; V386-H438 PolarHBondContact O-N 3.1Å
387	A	60.4	Low	58.8	Low	1 Å²	1	49.1 Å²	49.1	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.9	178.3	0	0	0	0	0	111.6	L363 L365 P371 Y436	L363-A387 HydrophobicContact CD2-CB 4.26Å; L365-A387 HydrophobicContact CD1-CB 3.49Å; L365-A387 VanDerWaalsContact CD1-CB 3.49Å; P371-A387 HydrophobicContact CB-CB 4.21Å; P371-A387 HydrophobicContact CG-CB 3.9Å; A387-Y436 CarbonylContact C-O 3.54Å; A387-Y436 VanDerWaalsContact CA-O 3.3Å; A387-Y436 WeakPolarHBondContact CA-O 3.5Å
388	L	62.8	Low	58.5	Low	53 Å²	53	51.2 Å²	51.2	28%	0.277	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132	179.8	178.8	123.2	0	0	0	108.1	L390 Y436	L388-L390 HydrophobicContact CD2-CD1 3.73Å; L388-L390 HydrophobicContact CD2-CG 4.32Å; L388-Y436 PolarHBondContact N-O 3.03Å; L388-Y436 PolarHBondContact O-N 3.23Å
389	A	56.2	Low	57.8	Low	1 Å²	1	51.2 Å²	51.2	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121.5	179.3	0	0	0	0	0	110.8	H323 L365 P366 V435	H323-A389 PolarHBondContact N-O 2.97Å; H323-A389 PolarHBondContact O-N 2.68Å; L365-A389 HydrophobicContact CB-CB 3.93Å; L365-A389 HydrophobicContact CD1-CB 4.02Å; L365-A389 HydrophobicContact CD2-CB 4.47Å; L365-A389 HydrophobicContact CG-CB 4.37Å; P366-A389 HydrophobicContact CG-CB 4.3Å; A389-V435 HydrophobicContact CB-CG2 4.13Å
390	L	60	Low	56.8	Low	72 Å²	72	54.6 Å²	54.6	38%	0.377	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122	176	-80.3	153.1	0	0	0	107.9	Y322 L388 V434	Y322-L390 HydrophobicContact CD2-CD2 3.4Å; Y322-L390 VanDerWaalsContact CD2-CD2 3.4Å; Y322-L390 HydrophobicContact CD2-CG 4.17Å; Y322-L390 HydrophobicContact CE2-CD2 3.75Å; Y322-L390 HydrophobicContact CE2-CG 4.23Å; L388-L390 HydrophobicContact CD2-CD1 3.73Å; L388-L390 HydrophobicContact CD2-CG 4.32Å; L390-V434 HydrophobicContact CB-CB 4.37Å; L390-V434 PolarHBondContact N-O 3.44Å; L390-V434 PolarHBondContact O-N 3.47Å
391	E	58	Low	55.9	Low	12 Å²	12	53 Å²	53	6%	0.056	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	116.1	174.9	-176.3	163.5	-150	0	0	109.5	Y321 K367 P431 R433	Y321-E391 PolarHBondContact N-O 3.29Å; Y321-E391 PolarHBondContact O-N 2.8Å; Y321-E391 VanDerWaalsContact O-O 3.1Å; K367-E391 WeakPolarHBondContact CE-OE1 3.42Å; E391-P431 HydrophobicContact CG-CB 4.34Å; E391-R433 IonicContact OE1-CZ 3.83Å; E391-R433 IonicContact OE1-NE 3.9Å; E391-R433 IonicContact OE1-NH2 2.93Å; E391-R433 PolarHBondContact OE1-NH2 2.87Å
392	F	59.2	Low	55.2	Low	108 Å²	108	53 Å²	53	47%	0.474	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	104.9	175.7	-177.3	-99.6	0	0	0	108.9	L320 R394 P431 I432	L320-F392 HydrophobicContact CD1-CD2 3.76Å; L320-F392 HydrophobicContact CD1-CE2 4.42Å; F392-R394 HydrophobicContact CE1-CB 4.42Å; F392-P431 WeakPolarHBondContact O-CA 3.27Å; F392-I432 PolarHBondContact N-O 3Å; F392-I432 PolarHBondContact O-N 3.19Å; F392-I432 VanDerWaalsContact O-N 3.12Å
393	A	56.9	Low	54.4	Low	14 Å²	14	54.3 Å²	54.3	12%	0.116	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.6	174.9	0	0	0	0	0	109.4	H319 G395 P431	H319-A393 PolarHBondContact N-O 3.46Å; H319-A393 PolarHBondContact O-N 3.5Å; A393-G395 PolarHBondContact O-N 2.93Å; A393-P431 HydrophobicContact CB-CB 4.27Å
394	R	53.6	Low	53.8	Low	169 Å²	169	55.8 Å²	55.8	64%	0.638	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	95.7	174.7	-164.2	176.4	-173.5	164.2	1	107.2	F392 N396	F392-R394 HydrophobicContact CE1-CB 4.42Å; R394-N396 VanDerWaalsContact C-N 3.32Å; R394-N396 PolarHBondContact O-N 2.73Å
395	G	51.8	Low	52.9	Low	2 Å²	2	53.6 Å²	53.6	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	85.4	-169.1	0	0	0	0	0	113.7	T316 A317 N318 A393	T316-G395 CarbonylContact O-C 3.57Å; A317-G395 VanDerWaalsContact C-CA 3.49Å; A317-G395 CarbonylContact C-O 3.49Å; A317-G395 WeakPolarHBondContact CA-O 3.31Å; N318-G395 VanDerWaalsContact CA-CA 3.44Å; N318-G395 PolarHBondContact N-O 2.92Å; N318-G395 PolarHBondContact OD1-N 3.29Å; A393-G395 PolarHBondContact O-N 2.93Å
396	N	52.7	Low	52.6	Low	126 Å²	126	57.2 Å²	57.2	67%	0.674	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	32.5	139.8	-80.2	-27.4	0	0	0	108.8	R394	R394-N396 VanDerWaalsContact C-N 3.32Å; R394-N396 PolarHBondContact O-N 2.73Å
397	D	51.7	Low	51.9	Low	13 Å²	13	55.9 Å²	55.9	7%	0.07	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.6	-175.4	-67.9	-28	0	0	0	110.1	H429	D397-H429 PolarHBondContact OD1-N 2.88Å
398	F	48.9	Very low	51.5	Low	86 Å²	86	58.3 Å²	58.3	38%	0.377	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.8	173.8	178.4	-98.1	0	0	0	108	I313 L400 G427	I313-F398 HydrophobicContact CG2-CD2 4.29Å; I313-F398 HydrophobicContact CG2-CE2 3.42Å; I313-F398 VanDerWaalsContact CG2-CE2 3.42Å; I313-F398 HydrophobicContact CG2-CZ 3.96Å; F398-L400 HydrophobicContact CD1-CB 4.48Å; F398-L400 HydrophobicContact CE1-CB 3.78Å; F398-L400 HydrophobicContact CE1-CD1 3.69Å; F398-L400 HydrophobicContact CE1-CG 4.14Å; F398-L400 HydrophobicContact CZ-CB 4.33Å; F398-L400 HydrophobicContact CZ-CD1 3.84Å; F398-L400 HydrophobicContact CZ-CG 4.29Å; F398-G427 PolarHBondContact N-O 3.32Å; F398-G427 PolarHBondContact O-N 2.95Å; F398-G427 VanDerWaalsContact O-N 3.08Å
399	A	47.8	Very low	50.8	Low	19 Å²	19	63 Å²	63	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.5	173.6	0	0	0	0	0	109.3	Q314	Q314-A399 PolarHBondContact N-O 3.13Å; Q314-A399 PolarHBondContact O-N 3.39Å
400	L	43.2	Very low	50.3	Low	79 Å²	79	65.2 Å²	65.2	41%	0.414	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	108.5	172.2	-150	159.4	0	0	0	107.6	F398 T424 M425	F398-L400 HydrophobicContact CD1-CB 4.48Å; F398-L400 HydrophobicContact CE1-CB 3.78Å; F398-L400 HydrophobicContact CE1-CD1 3.69Å; F398-L400 HydrophobicContact CE1-CG 4.14Å; F398-L400 HydrophobicContact CZ-CB 4.33Å; F398-L400 HydrophobicContact CZ-CD1 3.84Å; F398-L400 HydrophobicContact CZ-CG 4.29Å; L400-T424 WeakPolarHBondContact O-CA 3.26Å; L400-M425 PolarHBondContact N-O 2.83Å; L400-M425 PolarHBondContact O-N 3.1Å
401	N	42.3	Very low	49.9	Very low	36 Å²	36	73.3 Å²	73.3	19%	0.193	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	109.8	177.6	-69.7	-14.7	0	0	0	107.8	F312 T424	F312-N401 HydrophobicContact CD1-CB 4.27Å; F312-N401 HydrophobicContact CD2-CB 4.3Å; F312-N401 HydrophobicContact CE1-CB 3.56Å; F312-N401 HydrophobicContact CE2-CB 3.62Å; F312-N401 VanDerWaalsContact CE2-ND2 3.27Å; F312-N401 WeakPolarHBondContact CE2-ND2 3.48Å; F312-N401 HydrophobicContact CZ-CB 3.22Å; F312-N401 WeakPolarHBondContact CZ-ND2 3.27Å; N401-T424 WeakPolarHBondContact OD1-CB 3.36Å; N401-T424 WeakPolarHBondContact OD1-CG2 3.37Å
402	G	44.5	Very low	49.2	Very low	30 Å²	30	77.7 Å²	77.7	31%	0.309	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134.6	178.1	0	0	0	0	0	110.8	G422 G423	G402-G422 WeakPolarHBondContact O-CA 3.36Å; G402-G423 PolarHBondContact N-O 2.92Å; G402-G423 VanDerWaalsContact N-O 3.16Å; G402-G423 PolarHBondContact O-N 3.12Å; G402-G423 VanDerWaalsContact O-N 3.12Å
403	L	43	Very low	48.9	Very low	77 Å²	77	78.3 Å²	78.3	40%	0.403	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.5	166.5	-177.3	80.4	0	0	0	108.1	K310 P420	K310-L403 PolarHBondContact O-N 3.26Å; L403-P420 HydrophobicContact CD1-CB 4.27Å
404	I	46.8	Very low	48.5	Very low	90 Å²	90	85.1 Å²	85.1	46%	0.462	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	108.3	172.2	-57.1	176.7	0	0	0	106.6	F406 L421	I404-F406 HydrophobicContact CG2-CD1 4.18Å; I404-L421 HydrophobicContact CB-CB 4.48Å; I404-L421 PolarHBondContact N-O 3.16Å; I404-L421 PolarHBondContact O-N 3.29Å
405	D	44.1	Very low	47.8	Very low	55 Å²	55	80.5 Å²	80.5	29%	0.294	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.9	174.6	-173.8	10.4	0	0	0	108.4
406	F	55.6	Low	47.3	Very low	82 Å²	82	84.8 Å²	84.8	36%	0.36	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.4	176.7	59.5	-81.8	0	0	0	111.1	I404 V408 F419 L421	I404-F406 HydrophobicContact CG2-CD1 4.18Å; F406-V408 HydrophobicContact CD2-CG2 3.77Å; F406-V408 HydrophobicContact CE2-CG2 3.56Å; F406-F419 HydrophobicContact CD1-CB 4.4Å; F406-F419 HydrophobicContact CD2-CB 4.4Å; F406-F419 HydrophobicContact CE1-CB 3.91Å; F406-F419 HydrophobicContact CE2-CB 3.92Å; F406-F419 HydrophobicContact CE2-CD2 4.44Å; F406-F419 HydrophobicContact CE2-CG 4.34Å; F406-F419 HydrophobicContact CZ-CB 3.65Å; F406-F419 HydrophobicContact CZ-CG 4.31Å; F406-F419 PolarHBondContact N-O 3.41Å; F406-F419 PolarHBondContact O-N 3.04Å; F406-L421 HydrophobicContact CE1-CD1 3.63Å; F406-L421 HydrophobicContact CE1-CG 4.1Å; F406-L421 HydrophobicContact CZ-CD1 4.21Å
407	P	51.2	Low	46.7	Very low	48 Å²	48	82.9 Å²	82.9	31%	0.312	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	125.5	173.3	30.9	-32.2	0	0	0	110.1	L417	P407-L417 CarbonylContact C-O 3.59Å; P407-L417 WeakPolarHBondContact CA-O 3.43Å
408	V	51.2	Low	46.2	Very low	53 Å²	53	90.7 Å²	90.7	32%	0.321	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.2	166.3	176.4	0	0	0	0	107.8	F406 T410 L417 F419	F406-V408 HydrophobicContact CD2-CG2 3.77Å; F406-V408 HydrophobicContact CE2-CG2 3.56Å; V408-T410 PolarHBondContact O-N 3.1Å; V408-L417 PolarHBondContact N-O 3.24Å; V408-L417 PolarHBondContact O-N 3.39Å; V408-F419 HydrophobicContact CB-CD2 3.75Å; V408-F419 HydrophobicContact CB-CE2 3.57Å; V408-F419 HydrophobicContact CG1-CE2 4.17Å; V408-F419 HydrophobicContact CG2-CD2 3.29Å; V408-F419 HydrophobicContact CG2-CE2 3.47Å; V408-F419 VanDerWaalsContact CG2-CE2 3.47Å; V408-F419 HydrophobicContact CG2-CG 4.29Å
409	K	48.5	Very low	45.9	Very low	150 Å²	150	91 Å²	91	65%	0.652	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	128.1	171.4	-65.8	-175.5	176.3	-174.7	0	108.9	K305	K305-K409 VanDerWaalsContact NZ-CE 3.31Å
410	T	44.5	Very low	45.5	Very low	48 Å²	48	94.2 Å²	94.2	29%	0.294	48%	0.481	S	S	.	.			trans	-78.8	179.2	162.6	47.2	0	0	0	0	109.7	V408 D412 V415 L417	V408-T410 PolarHBondContact O-N 3.1Å; T410-D412 PolarHBondContact O-N 3.4Å; T410-V415 HydrophobicContact CG2-CG1 4.39Å; T410-V415 WeakPolarHBondContact OG1-CB 3.26Å; T410-V415 PolarHBondContact OG1-O 3.3Å; T410-L417 HydrophobicContact CG2-CB 4.48Å; T410-L417 HydrophobicContact CG2-CD1 3.26Å; T410-L417 HydrophobicContact CG2-CG 3.85Å
411	Y	51.9	Low	45.3	Very low	242 Å²	242	95.8 Å²	95.8	95%	0.949	49%	0.489	S	S	*	.	S	Bend	trans	-64.5	-20.7	175.3	-153.6	-93.1	0	0	0	112.4
412	D	44.6	Very low	45.2	Very low	105 Å²	105	96.8 Å²	96.8	56%	0.561	51%	0.508	S	S	*	.	S	Bend	trans	-87.9	127.4	177.3	-113.3	-34.8	0	0	0	111.4	T410 D414 V415	T410-D412 PolarHBondContact O-N 3.4Å; D412-D414 PolarHBondContact O-N 3.24Å; D412-V415 HydrophobicContact CB-CB 4.23Å; D412-V415 HydrophobicContact CB-CG2 4.18Å; D412-V415 PolarHBondContact O-N 3.15Å
413	P	51.6	Low	45	Very low	121 Å²	121	97.6 Å²	97.6	79%	0.786	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.8	-177.1	24.5	-32.1	0	0	0	114.3
414	D	50	Low	45.1	Very low	156 Å²	156	98.4 Å²	98.4	83%	0.834	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-0.3	-178.2	-68.2	-29.2	0	0	0	114	D412	D412-D414 PolarHBondContact O-N 3.24Å
415	V	37.2	Very low	45	Very low	72 Å²	72	101.5 Å²	101.5	44%	0.436	54%	0.539	S	S	.	.			trans	-118.8	123.8	-176.7	-179.9	0	0	0	0	111	T410 D412	T410-V415 HydrophobicContact CG2-CG1 4.39Å; T410-V415 WeakPolarHBondContact OG1-CB 3.26Å; T410-V415 PolarHBondContact OG1-O 3.3Å; D412-V415 HydrophobicContact CB-CB 4.23Å; D412-V415 HydrophobicContact CB-CG2 4.18Å; D412-V415 PolarHBondContact O-N 3.15Å
416	E	43.2	Very low	45.1	Very low	93 Å²	93	103.1 Å²	103.1	44%	0.435	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.2	173.2	-66	-170.5	161.7	0	0	110.4	K305	K305-E416 WeakPolarHBondContact CE-OE1 3.47Å; K305-E416 IonicContact NZ-OE1 3.9Å; K305-E416 PolarHBondContact NZ-OE1 3.47Å
417	L	40	Very low	44.6	Very low	85 Å²	85	100.6 Å²	100.6	45%	0.445	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.2	172	-86.8	162.4	0	0	0	109.3	P407 V408 T410 F419	P407-L417 CarbonylContact C-O 3.59Å; P407-L417 WeakPolarHBondContact CA-O 3.43Å; V408-L417 PolarHBondContact N-O 3.24Å; V408-L417 PolarHBondContact O-N 3.39Å; T410-L417 HydrophobicContact CG2-CB 4.48Å; T410-L417 HydrophobicContact CG2-CD1 3.26Å; T410-L417 HydrophobicContact CG2-CG 3.85Å; L417-F419 HydrophobicContact CB-CD2 4.36Å; L417-F419 HydrophobicContact CB-CE2 3.79Å
418	R	39.4	Very low	44.7	Very low	178 Å²	178	106.5 Å²	106.5	67%	0.672	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.4	127	173.4	-67.2	-170.9	-177	-167.8	1.2	110.7	P420	R418-P420 VanDerWaalsContact O-CD 3.26Å; R418-P420 WeakPolarHBondContact O-CD 3.25Å
419	F	42.5	Very low	44.9	Very low	93 Å²	93	109 Å²	109	41%	0.408	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.7	93.7	177	-75.7	-93.5	0	0	0	110.4	F406 V408 L417 L421	F406-F419 HydrophobicContact CD1-CB 4.4Å; F406-F419 HydrophobicContact CD2-CB 4.4Å; F406-F419 HydrophobicContact CE1-CB 3.91Å; F406-F419 HydrophobicContact CE2-CB 3.92Å; F406-F419 HydrophobicContact CE2-CD2 4.44Å; F406-F419 HydrophobicContact CE2-CG 4.34Å; F406-F419 HydrophobicContact CZ-CB 3.65Å; F406-F419 HydrophobicContact CZ-CG 4.31Å; F406-F419 PolarHBondContact N-O 3.41Å; F406-F419 PolarHBondContact O-N 3.04Å; V408-F419 HydrophobicContact CB-CD2 3.75Å; V408-F419 HydrophobicContact CB-CE2 3.57Å; V408-F419 HydrophobicContact CG1-CE2 4.17Å; V408-F419 HydrophobicContact CG2-CD2 3.29Å; V408-F419 HydrophobicContact CG2-CE2 3.47Å; V408-F419 VanDerWaalsContact CG2-CE2 3.47Å; V408-F419 HydrophobicContact CG2-CG 4.29Å; L417-F419 HydrophobicContact CB-CD2 4.36Å; L417-F419 HydrophobicContact CB-CE2 3.79Å; F419-L421 PolarHBondContact O-N 3.25Å
420	P	39.6	Very low	45.2	Very low	85 Å²	85	109.7 Å²	109.7	55%	0.552	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.5	102.3	172.5	30.5	-33.1	0	0	0	110.1	L403 R418 G422	L403-P420 HydrophobicContact CD1-CB 4.27Å; R418-P420 VanDerWaalsContact O-CD 3.26Å; R418-P420 WeakPolarHBondContact O-CD 3.25Å; P420-G422 PolarHBondContact O-N 3.42Å
421	L	40.5	Very low	45.9	Very low	113 Å²	113	108.4 Å²	108.4	59%	0.592	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.1	102.8	164.6	-73.1	171.8	0	0	0	108.5	I404 F406 F419	I404-L421 HydrophobicContact CB-CB 4.48Å; I404-L421 PolarHBondContact N-O 3.16Å; I404-L421 PolarHBondContact O-N 3.29Å; F406-L421 HydrophobicContact CE1-CD1 3.63Å; F406-L421 HydrophobicContact CE1-CG 4.1Å; F406-L421 HydrophobicContact CZ-CD1 4.21Å; F419-L421 PolarHBondContact O-N 3.25Å
422	G	39.7	Very low	46.3	Very low	57 Å²	57	102.6 Å²	102.6	59%	0.588	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.9	136.7	176.5	0	0	0	0	0	111.8	G402 P420	G402-G422 WeakPolarHBondContact O-CA 3.36Å; P420-G422 PolarHBondContact O-N 3.42Å
423	G	40	Very low	47	Very low	47 Å²	47	102.8 Å²	102.8	49%	0.485	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-157.3	150	178.9	0	0	0	0	0	112.9	G402	G402-G423 PolarHBondContact N-O 2.92Å; G402-G423 VanDerWaalsContact N-O 3.16Å; G402-G423 PolarHBondContact O-N 3.12Å; G402-G423 VanDerWaalsContact O-N 3.12Å
424	T	45.8	Very low	47.5	Very low	94 Å²	94	100.9 Å²	100.9	58%	0.577	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.7	178.9	66.3	0	0	0	0	109.4	L400 N401	L400-T424 WeakPolarHBondContact O-CA 3.26Å; N401-T424 WeakPolarHBondContact OD1-CB 3.36Å; N401-T424 WeakPolarHBondContact OD1-CG2 3.37Å
425	M	43.2	Very low	48.1	Very low	154 Å²	154	95.6 Å²	95.6	76%	0.759	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.9	171.8	-62.8	-168.2	87.3	0	0	109.7	L400	L400-M425 PolarHBondContact N-O 2.83Å; L400-M425 PolarHBondContact O-N 3.1Å
426	L	47.1	Very low	49.3	Very low	90 Å²	90	98.5 Å²	98.5	47%	0.471	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.4	178	-73	127.3	0	0	0	109.6
427	G	45.3	Very low	50.2	Low	28 Å²	28	95.4 Å²	95.4	29%	0.289	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	145.8	177.8	0	0	0	0	0	113.2	F398	F398-G427 PolarHBondContact N-O 3.32Å; F398-G427 PolarHBondContact O-N 2.95Å; F398-G427 VanDerWaalsContact O-N 3.08Å
428	K	52.2	Low	51.5	Low	172 Å²	172	95.2 Å²	95.2	75%	0.748	50%	0.504	S	S	*	.	S	Bend	trans	96.4	-76.6	175.8	-62.5	-177.1	176.9	176.5	0	116.9
429	H	55.4	Low	52.5	Low	107 Å²	107	91.4 Å²	91.4	50%	0.495	49%	0.494	S	S	.	.			trans	-116.8	124.4	-179.8	-69.1	-64.6	0	0	0	110.5	D397 P431	D397-H429 PolarHBondContact OD1-N 2.88Å; H429-P431 WeakPolarHBondContact O-CD 3.19Å
430	I	55.5	Low	53.5	Low	163 Å²	163	91.6 Å²	91.6	84%	0.836	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-69.3	121.3	168.7	-58.3	169.2	0	0	0	105.7	I432	I430-I432 PolarHBondContact O-N 2.84Å
431	P	59.7	Low	54.5	Low	22 Å²	22	91.2 Å²	91.2	14%	0.143	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-59.3	138.3	179.5	23.8	-33.3	0	0	0	109.8	E391 F392 A393 H429 R433	E391-P431 HydrophobicContact CG-CB 4.34Å; F392-P431 WeakPolarHBondContact O-CA 3.27Å; A393-P431 HydrophobicContact CB-CB 4.27Å; H429-P431 WeakPolarHBondContact O-CD 3.19Å; P431-R433 PolarHBondContact O-N 3.31Å
432	I	60.4	Low	55.2	Low	120 Å²	120	88.6 Å²	88.6	62%	0.615	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	117.9	171.5	-62.3	174.2	0	0	0	106.3	F392 I430	F392-I432 PolarHBondContact N-O 3Å; F392-I432 PolarHBondContact O-N 3.19Å; F392-I432 VanDerWaalsContact O-N 3.12Å; I430-I432 PolarHBondContact O-N 2.84Å
433	R	58.3	Low	55.8	Low	108 Å²	108	94.6 Å²	94.6	41%	0.408	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.3	-175.6	-179.9	178.5	-62.4	-165.5	-4.2	109.6	K367 E391 P431 V435	K367-R433 VanDerWaalsContact CB-NH2 3.33Å; K367-R433 VanDerWaalsContact CD-NH2 3.31Å; K367-R433 VanDerWaalsContact CG-NH2 3.25Å; E391-R433 IonicContact OE1-CZ 3.83Å; E391-R433 IonicContact OE1-NE 3.9Å; E391-R433 IonicContact OE1-NH2 2.93Å; E391-R433 PolarHBondContact OE1-NH2 2.87Å; P431-R433 PolarHBondContact O-N 3.31Å; R433-V435 HydrophobicContact CG-CG2 3.69Å
434	V	63.5	Low	56.4	Low	81 Å²	81	96.6 Å²	96.6	49%	0.491	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	109.6	169.8	-178.1	0	0	0	0	107.5	L390	L390-V434 HydrophobicContact CB-CB 4.37Å; L390-V434 PolarHBondContact N-O 3.44Å; L390-V434 PolarHBondContact O-N 3.47Å
435	V	61	Low	56.7	Low	46 Å²	46	94.1 Å²	94.1	28%	0.279	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.8	175.5	174.7	0	0	0	0	107.3	Y369 A389 R433	Y369-V435 HydrophobicContact CD1-CG1 3.25Å; Y369-V435 HydrophobicContact CD2-CG1 3.8Å; Y369-V435 HydrophobicContact CE1-CG1 3.09Å; Y369-V435 HydrophobicContact CE2-CG1 3.67Å; Y369-V435 HydrophobicContact CG-CG1 3.59Å; A389-V435 HydrophobicContact CB-CG2 4.13Å; R433-V435 HydrophobicContact CG-CG2 3.69Å
436	Y	62.5	Low	57.2	Low	133 Å²	133	90.7 Å²	90.7	52%	0.522	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.4	179.1	179.5	-99.8	0	0	0	108.9	A387 L388 H438	A387-Y436 CarbonylContact C-O 3.54Å; A387-Y436 VanDerWaalsContact CA-O 3.3Å; A387-Y436 WeakPolarHBondContact CA-O 3.5Å; L388-Y436 PolarHBondContact N-O 3.03Å; L388-Y436 PolarHBondContact O-N 3.23Å; Y436-H438 HydrophobicContact CE1-CB 4.02Å; Y436-H438 AromaticContact CZ-ND1 3.92Å; Y436-H438 PolarHBondContact OH-ND1 2.92Å
437	G	62.9	Low	57.3	Low	28 Å²	28	87.5 Å²	87.5	29%	0.289	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.5	175	0	0	0	0	0	109.6
438	H	66.1	Low	57.5	Low	80 Å²	80	94.6 Å²	94.6	37%	0.37	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	129.1	179.6	-159.6	114.6	0	0	0	109.9	T385 V386 Y436 L440	T385-H438 VanDerWaalsContact CA-O 3.28Å; T385-H438 WeakPolarHBondContact CA-O 2.97Å; V386-H438 PolarHBondContact N-O 3.29Å; V386-H438 PolarHBondContact O-N 3.1Å; Y436-H438 HydrophobicContact CE1-CB 4.02Å; Y436-H438 AromaticContact CZ-ND1 3.92Å; Y436-H438 PolarHBondContact OH-ND1 2.92Å; H438-L440 WeakPolarHBondContact NE2-CD2 2.83Å
439	H	62.1	Low	57.3	Low	98 Å²	98	88.1 Å²	88.1	45%	0.454	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.5	173	-55.7	-70.6	0	0	0	109.8	P371 I383 H384 T385	P371-H439 PolarHBondContact O-CE1 2.97Å; I383-H439 HydrophobicContact CG2-CB 4.05Å; H384-H439 CarbonylContact O-C 3.48Å; H384-H439 VanDerWaalsContact O-CA 3.3Å; H384-H439 WeakPolarHBondContact O-CA 3.29Å; T385-H439 VanDerWaalsContact CG2-CE1 3.41Å; T385-H439 WeakPolarHBondContact CG2-CE1 3.19Å; T385-H439 WeakPolarHBondContact CG2-ND1 3.48Å; T385-H439 PolarHBondContact OG1-ND1 3.35Å
440	L	61.8	Low	56.8	Low	98 Å²	98	90.9 Å²	90.9	51%	0.513	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	125	176.2	-67.7	162.4	0	0	0	108.3	I383 H384 H438	I383-L440 CarbonylContact C-O 3.52Å; H384-L440 HydrophobicContact CB-CB 4.23Å; H384-L440 PolarHBondContact N-O 2.98Å; H384-L440 PolarHBondContact O-N 2.85Å; H438-L440 WeakPolarHBondContact NE2-CD2 2.83Å
441	S	60.8	Low	56.6	Low	77 Å²	77	89.3 Å²	89.3	54%	0.538	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148	173.6	60.8	0	0	0	0	110.7	Y382	Y382-S441 VanDerWaalsContact O-CA 3.26Å; Y382-S441 WeakPolarHBondContact O-CA 3.44Å; Y382-S441 VanDerWaalsContact O-CB 3.25Å; Y382-S441 WeakPolarHBondContact O-CB 2.93Å
442	A	54.8	Low	56.2	Low	58 Å²	58	94.7 Å²	94.7	48%	0.479	47%	0.472	S	S	.	.			trans	-63	138.2	169.6	0	0	0	0	0	110.3	N444	A442-N444 PolarHBondContact O-N 2.81Å
443	I	53.7	Low	55.5	Low	183 Å²	183	93.7 Å²	93.7	94%	0.938	47%	0.465	S	S	*	.	S	Bend	trans	-58	-37.1	176.1	-68.2	166.2	0	0	0	110.6
444	N	51.3	Low	55	Low	89 Å²	89	94.4 Å²	94.4	48%	0.476	47%	0.471	S	S	.	.			trans	-131.7	100.1	171.5	-173.8	-2.9	0	0	0	110.1	A442 F446 G447	A442-N444 PolarHBondContact O-N 2.81Å; N444-F446 PolarHBondContact O-N 2.99Å; N444-F446 WeakPolarHBondContact OD1-CA 3.39Å; N444-F446 PolarHBondContact OD1-N 2.86Å; N444-G447 PolarHBondContact O-N 2.89Å; N444-G447 PolarHBondContact OD1-N 2.95Å
445	P	52.2	Low	54.3	Low	41 Å²	41	96.2 Å²	96.2	27%	0.266	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.5	177.1	24.2	-31.6	0	0	0	114	Y382	Y382-P445 HydrophobicContact CD1-CB 3.23Å; Y382-P445 HydrophobicContact CD2-CB 3.52Å; Y382-P445 HydrophobicContact CD2-CG 4.14Å; Y382-P445 HydrophobicContact CE1-CB 3.59Å; Y382-P445 HydrophobicContact CE2-CB 3.87Å; Y382-P445 HydrophobicContact CG-CB 3.18Å; Y382-P445 HydrophobicContact CG-CG 4.15Å
446	F	54	Low	53.6	Low	82 Å²	82	99.7 Å²	99.7	36%	0.36	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	10.7	-178.4	-55.6	-72.4	0	0	0	112.8	A342 Y382 N444 R448 I449 W450	A342-F446 HydrophobicContact CB-CE1 4.28Å; Y382-F446 HydrophobicContact CE2-CE1 4.1Å; Y382-F446 HydrophobicContact CE2-CZ 4.03Å; Y382-F446 WeakPolarHBondContact OH-CE1 3.48Å; N444-F446 PolarHBondContact O-N 2.99Å; N444-F446 WeakPolarHBondContact OD1-CA 3.39Å; N444-F446 PolarHBondContact OD1-N 2.86Å; F446-R448 VanDerWaalsContact C-N 3.27Å; F446-R448 PolarHBondContact O-N 3.3Å; F446-I449 HydrophobicContact CB-CB 4.46Å; F446-I449 HydrophobicContact CD1-CD1 3.71Å; F446-I449 HydrophobicContact CE1-CD1 4.5Å; F446-I449 WeakPolarHBondContact O-CA 3.27Å; F446-I449 WeakPolarHBondContact O-CB 3.48Å; F446-I449 PolarHBondContact O-N 3.03Å; F446-W450 PolarHBondContact O-N 2.99Å
447	G	50.4	Low	52.8	Low	23 Å²	23	98.8 Å²	98.8	24%	0.237	49%	0.492	C	S	.	.	H	α-helix	trans	-54.1	-42.3	-176.8	0	0	0	0	0	113.1	N444 W450 E451	N444-G447 PolarHBondContact O-N 2.89Å; N444-G447 PolarHBondContact OD1-N 2.95Å; G447-W450 PolarHBondContact O-N 3.19Å; G447-E451 PolarHBondContact O-N 3.32Å
448	R	49.7	Very low	52.1	Low	177 Å²	177	101.3 Å²	101.3	67%	0.668	50%	0.502	S	S	*	.	H	α-helix	trans	-68.5	-31.8	175.5	-74.5	-175.9	179.2	179.9	-1.9	113.9	F446 K452	F446-R448 VanDerWaalsContact C-N 3.27Å; F446-R448 PolarHBondContact O-N 3.3Å; R448-K452 WeakPolarHBondContact O-CB 3.22Å; R448-K452 PolarHBondContact O-N 3.38Å
449	I	47.1	Very low	51.2	Low	37 Å²	37	104.2 Å²	104.2	19%	0.19	52%	0.516	C	S	.	.	H	α-helix	trans	-70.1	-38.2	174	-70.7	160.2	0	0	0	109.6	E338 F446 Q453	E338-I449 HydrophobicContact CB-CD1 4.02Å; E338-I449 HydrophobicContact CB-CG1 4.38Å; F446-I449 HydrophobicContact CB-CB 4.46Å; F446-I449 HydrophobicContact CD1-CD1 3.71Å; F446-I449 HydrophobicContact CE1-CD1 4.5Å; F446-I449 WeakPolarHBondContact O-CA 3.27Å; F446-I449 WeakPolarHBondContact O-CB 3.48Å; F446-I449 PolarHBondContact O-N 3.03Å; I449-Q453 HydrophobicContact CG2-CG 4.33Å; I449-Q453 WeakPolarHBondContact O-CB 3.37Å; I449-Q453 WeakPolarHBondContact O-CG 3.3Å; I449-Q453 PolarHBondContact O-N 2.95Å
450	W	45.8	Very low	50.2	Low	165 Å²	165	105 Å²	105	63%	0.625	52%	0.523	S	S	*	.	H	α-helix	trans	-69.8	-36.5	175.7	-159.7	-90.8	0	0	0	112.3	F446 G447 K454	F446-W450 PolarHBondContact O-N 2.99Å; G447-W450 PolarHBondContact O-N 3.19Å; W450-K454 WeakPolarHBondContact O-CB 3.43Å; W450-K454 WeakPolarHBondContact O-CG 3.33Å; W450-K454 PolarHBondContact O-N 2.93Å
451	E	51	Low	49.2	Very low	130 Å²	130	105 Å²	105	61%	0.607	52%	0.524	S	S	*	.	H	α-helix	trans	-67.7	-45.9	171.7	-76.7	-173.7	166.3	0	0	112	G447 K454 E455	G447-E451 PolarHBondContact O-N 3.32Å; E451-K454 CarbonylContact O-C 3.59Å; E451-K454 WeakPolarHBondContact O-CB 3.41Å; E451-K454 PolarHBondContact O-N 3.19Å; E451-E455 WeakPolarHBondContact O-CB 3.23Å; E451-E455 WeakPolarHBondContact O-CG 3.28Å; E451-E455 PolarHBondContact O-N 3.31Å
452	K	50.1	Low	48.1	Very low	134 Å²	134	105.5 Å²	105.5	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-66.1	-38.7	174.8	-89.6	-174.6	171	-178.4	0	113.5	R448 K454 E455 M456	R448-K452 WeakPolarHBondContact O-CB 3.22Å; R448-K452 PolarHBondContact O-N 3.38Å; K452-K454 VanDerWaalsContact C-N 3.35Å; K452-E455 PolarHBondContact O-N 2.92Å; K452-M456 WeakPolarHBondContact O-CB 2.84Å; K452-M456 VanDerWaalsContact O-CG 3.31Å; K452-M456 WeakPolarHBondContact O-CG 3.01Å; K452-M456 PolarHBondContact O-N 2.93Å
453	Q	47.1	Very low	47.5	Very low	100 Å²	100	105.9 Å²	105.9	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-67.2	-38.8	172.1	-83.1	-176.1	-46.4	0	0	110.4	I449 M456 L457	I449-Q453 HydrophobicContact CG2-CG 4.33Å; I449-Q453 WeakPolarHBondContact O-CB 3.37Å; I449-Q453 WeakPolarHBondContact O-CG 3.3Å; I449-Q453 PolarHBondContact O-N 2.95Å; Q453-M456 PolarHBondContact O-N 3.24Å; Q453-L457 WeakPolarHBondContact O-CB 3.3Å; Q453-L457 WeakPolarHBondContact O-CD1 3.48Å; Q453-L457 WeakPolarHBondContact O-CG 3.15Å; Q453-L457 PolarHBondContact O-N 2.79Å
454	K	47.3	Very low	46.9	Very low	123 Å²	123	100.7 Å²	100.7	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-60.2	-47.7	170.4	-96.5	-176	169.1	-177.3	0	111.1	W450 E451 K452 M456 L457 T458	W450-K454 WeakPolarHBondContact O-CB 3.43Å; W450-K454 WeakPolarHBondContact O-CG 3.33Å; W450-K454 PolarHBondContact O-N 2.93Å; E451-K454 CarbonylContact O-C 3.59Å; E451-K454 WeakPolarHBondContact O-CB 3.41Å; E451-K454 PolarHBondContact O-N 3.19Å; K452-K454 VanDerWaalsContact C-N 3.35Å; K454-M456 PolarHBondContact O-N 2.86Å; K454-L457 CarbonylContact O-C 3.5Å; K454-L457 PolarHBondContact O-N 2.99Å; K454-T458 WeakPolarHBondContact O-CB 3.36Å; K454-T458 VanDerWaalsContact O-CG2 3.26Å; K454-T458 WeakPolarHBondContact O-CG2 3.4Å; K454-T458 PolarHBondContact O-N 3.35Å; K454-T458 PolarHBondContact O-OG1 3.12Å
455	E	48.8	Very low	46.4	Very low	118 Å²	118	104.3 Å²	104.3	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-57.7	-48.9	177	-78.5	175.4	162.8	0	0	111	E451 K452 L457 T458 E459	E451-E455 WeakPolarHBondContact O-CB 3.23Å; E451-E455 WeakPolarHBondContact O-CG 3.28Å; E451-E455 PolarHBondContact O-N 3.31Å; K452-E455 PolarHBondContact O-N 2.92Å; E455-L457 PolarHBondContact O-N 3.08Å; E455-T458 VanDerWaalsContact CA-OG1 3.27Å; E455-T458 WeakPolarHBondContact CA-OG1 3.5Å; E455-T458 PolarHBondContact O-N 3.18Å; E455-T458 PolarHBondContact O-OG1 3.21Å; E455-E459 WeakPolarHBondContact O-CB 3.48Å; E455-E459 PolarHBondContact O-N 3.15Å
456	M	46.6	Very low	45.9	Very low	120 Å²	120	110.6 Å²	110.6	59%	0.591	55%	0.547	S	S	*	.	H	α-helix	trans	-63.7	-37.7	175.7	-73.6	-177.9	-177.2	0	0	113.2	K452 Q453 K454 N460	K452-M456 WeakPolarHBondContact O-CB 2.84Å; K452-M456 VanDerWaalsContact O-CG 3.31Å; K452-M456 WeakPolarHBondContact O-CG 3.01Å; K452-M456 PolarHBondContact O-N 2.93Å; Q453-M456 PolarHBondContact O-N 3.24Å; K454-M456 PolarHBondContact O-N 2.86Å; M456-N460 WeakPolarHBondContact O-CB 3.12Å; M456-N460 VanDerWaalsContact O-CG 3.29Å; M456-N460 PolarHBondContact O-N 2.87Å; M456-N460 PolarHBondContact O-ND2 2.84Å; M456-N460 VanDerWaalsContact O-ND2 3.16Å
457	L	44.8	Very low	44.9	Very low	114 Å²	114	112.2 Å²	112.2	60%	0.597	57%	0.567	S	S	*	*	H	α-helix	trans	-71.1	-36	175.7	-72.5	165.5	0	0	0	110.9	Q453 K454 E455 D461	Q453-L457 WeakPolarHBondContact O-CB 3.3Å; Q453-L457 WeakPolarHBondContact O-CD1 3.48Å; Q453-L457 WeakPolarHBondContact O-CG 3.15Å; Q453-L457 PolarHBondContact O-N 2.79Å; K454-L457 CarbonylContact O-C 3.5Å; K454-L457 PolarHBondContact O-N 2.99Å; E455-L457 PolarHBondContact O-N 3.08Å; L457-D461 WeakPolarHBondContact O-CB 3.49Å; L457-D461 PolarHBondContact O-N 3.31Å
458	T	49.7	Very low	44.3	Very low	81 Å²	81	115.9 Å²	115.9	50%	0.497	59%	0.589	S	S	.	*	H	α-helix	trans	-75.9	-34.8	177.4	52.5	0	0	0	0	113	K454 E455 C462	K454-T458 WeakPolarHBondContact O-CB 3.36Å; K454-T458 VanDerWaalsContact O-CG2 3.26Å; K454-T458 WeakPolarHBondContact O-CG2 3.4Å; K454-T458 PolarHBondContact O-N 3.35Å; K454-T458 PolarHBondContact O-OG1 3.12Å; E455-T458 VanDerWaalsContact CA-OG1 3.27Å; E455-T458 WeakPolarHBondContact CA-OG1 3.5Å; E455-T458 PolarHBondContact O-N 3.18Å; E455-T458 PolarHBondContact O-OG1 3.21Å; T458-C462 WeakPolarHBondContact O-CB 3.47Å; T458-C462 PolarHBondContact O-N 3.41Å
459	E	45.8	Very low	43.5	Very low	140 Å²	140	117 Å²	117	65%	0.654	60%	0.598	S	S	*	*	H	α-helix	trans	-66.8	-41.5	173.5	-82.3	-175.3	152.2	0	0	111	E455 C462 A463	E455-E459 WeakPolarHBondContact O-CB 3.48Å; E455-E459 PolarHBondContact O-N 3.15Å; E459-C462 PolarHBondContact O-N 3.12Å; E459-A463 WeakPolarHBondContact O-CB 3.45Å; E459-A463 PolarHBondContact O-N 3.39Å
460	N	42.1	Very low	43.2	Very low	115 Å²	115	125.7 Å²	125.7	62%	0.615	65%	0.653	S	S	*	*	H	α-helix	trans	-71.8	-31.5	177.2	-71.6	-25.7	0	0	0	112.9	M456 S464	M456-N460 WeakPolarHBondContact O-CB 3.12Å; M456-N460 VanDerWaalsContact O-CG 3.29Å; M456-N460 PolarHBondContact O-N 2.87Å; M456-N460 PolarHBondContact O-ND2 2.84Å; M456-N460 VanDerWaalsContact O-ND2 3.16Å; N460-S464 PolarHBondContact O-N 2.82Å; N460-S464 PolarHBondContact O-OG 3.07Å
461	D	40.4	Very low	43	Very low	99 Å²	99	123.7 Å²	123.7	53%	0.529	65%	0.654	S	S	.	*	H	α-helix	trans	-75.6	-28.7	172.7	-86.5	-11.4	0	0	0	113.2	L457 S464 K465	L457-D461 WeakPolarHBondContact O-CB 3.49Å; L457-D461 PolarHBondContact O-N 3.31Å; D461-S464 PolarHBondContact O-OG 3.26Å; D461-S464 VanDerWaalsContact O-OG 3.13Å; D461-K465 PolarHBondContact O-N 3.02Å
462	C	36.8	Very low	42.6	Very low	87 Å²	87	123.4 Å²	123.4	59%	0.588	66%	0.657	S	S	*	*	H	α-helix	trans	-74.3	-37.1	172.6	-92.5	0	0	0	0	112.1	T458 E459 S464 K465 Q466	T458-C462 WeakPolarHBondContact O-CB 3.47Å; T458-C462 PolarHBondContact O-N 3.41Å; E459-C462 PolarHBondContact O-N 3.12Å; C462-S464 VanDerWaalsContact C-N 3.32Å; C462-S464 PolarHBondContact O-N 3.43Å; C462-K465 PolarHBondContact O-N 3.22Å; C462-Q466 PolarHBondContact O-N 2.96Å
463	A	42.5	Very low	42.2	Very low	65 Å²	65	122.8 Å²	122.8	54%	0.537	66%	0.661	S	S	.	*	H	α-helix	trans	-66	-33.8	174.6	0	0	0	0	0	112.5	E459	E459-A463 WeakPolarHBondContact O-CB 3.45Å; E459-A463 PolarHBondContact O-N 3.39Å
464	S	41.4	Very low	41.9	Very low	75 Å²	75	124.1 Å²	124.1	52%	0.524	67%	0.672	S	S	.	*	H	α-helix	trans	-78.4	-27.2	178.7	68.8	0	0	0	0	113.8	N460 D461 C462	N460-S464 PolarHBondContact O-N 2.82Å; N460-S464 PolarHBondContact O-OG 3.07Å; D461-S464 PolarHBondContact O-OG 3.26Å; D461-S464 VanDerWaalsContact O-OG 3.13Å; C462-S464 VanDerWaalsContact C-N 3.32Å; C462-S464 PolarHBondContact O-N 3.43Å
465	K	41.2	Very low	41.6	Very low	165 Å²	165	124.2 Å²	124.2	72%	0.717	68%	0.681	S	S	*	*	H	α-helix	trans	-86	-12.2	-179.5	-78.5	-177.4	178.2	173.3	0	115.6	D461 C462	D461-K465 PolarHBondContact O-N 3.02Å; C462-K465 PolarHBondContact O-N 3.22Å
466	Q	40.4	Very low	41.1	Very low	172 Å²	172	124.6 Å²	124.6	80%	0.804	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-0.5	177.2	-100.2	171.4	-17.3	0	0	115.1	C462	C462-Q466 PolarHBondContact O-N 2.96Å
467	C	34.6	Very low	40.7	Very low	117 Å²	117	124.9 Å²	124.9	79%	0.791	70%	0.696	S	S	*	*	S	Bend	trans	-91.7	8	176.4	-74	0	0	0	0	115.2
468	S	37.9	Very low	40.4	Very low	99 Å²	99	125.8 Å²	125.8	69%	0.692	70%	0.704	S	S	*	*			trans	-118.5	66.3	175.1	67.3	0	0	0	0	112.2
469	K	31.5	Very low	39.6	Very low	200 Å²	200	129.5 Å²	129.5	87%	0.87	72%	0.721	S	S	*	*			trans	-141.3	89	155.3	-82.1	-169.3	177.4	179.6	0	108.6
470	V	40.9	Very low	39.1	Very low	220 Å²	220	128.5 Å²	128.5	100%	1.333	73%	0.727	S	S	*	*			trans	-123.1	0	153.1	177.7	0	0	0	0	106.2

Retrieved 470 of 470 residues in 220.2 ms (Link to these results)

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