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Isoform 3 of Protocadherin-15 AlphaSync

Canonical isoform description: Calcium-dependent cell-adhesion protein. Required for inner ear neuroepithelial cell elaboration and cochlear function. Probably involved in the maintenance of normal retinal function.

AlphaFold DB , UniProt , Accession Q99PJ1-3 (canonical: Q99PJ1), Species MOUSE (Mus musculus, Mouse), Gene Pcdh15, Length 684 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	43.8	Very low	38.2	Very low	227 Å²	227	147.8 Å²	147.8	100%	1.118	74%	0.74	S	S	*	*				0	105.8	0	179.4	174.6	173.9	0	0	107.1
2	F	35.6	Very low	38.8	Very low	176 Å²	176	143.1 Å²	143.1	77%	0.772	73%	0.728	S	S	*	*			trans	50.6	123.7	169.4	-63.4	-85.4	0	0	0	118.6
3	L	34.2	Very low	38.9	Very low	128 Å²	128	146.2 Å²	146.2	67%	0.67	74%	0.737	S	S	*	*				57.2	133	81.2	-86.2	71.8	0	0	0	111.7
4	Q	35.8	Very low	38.8	Very low	130 Å²	130	140.3 Å²	140.3	61%	0.607	73%	0.731	S	S	*	*			cis	-173.7	170.1	11.4	-135.5	163.8	3.2	0	0	111.5
5	F	38.4	Very low	39	Very low	169 Å²	169	142.2 Å²	142.2	74%	0.741	74%	0.74	S	S	*	*			trans	59.6	120	155.3	-60.2	-50.1	0	0	0	119.4
6	A	39	Very low	39	Very low	88 Å²	88	144 Å²	144	73%	0.727	75%	0.75	S	S	*	*				77.9	154.7	70.5	0	0	0	0	0	112.6
7	V	39.2	Very low	39	Very low	108 Å²	108	145.1 Å²	145.1	66%	0.655	76%	0.755	S	S	*	*			cis	-164.8	143.7	39.8	173.6	0	0	0	0	110.7
8	W	36.9	Very low	38.8	Very low	215 Å²	215	142.2 Å²	142.2	81%	0.814	76%	0.756	S	S	*	*			trans	59.9	163.3	157.2	-72.3	-11.1	0	0	0	119.3
9	K	37.5	Very low	38.9	Very low	142 Å²	142	140.1 Å²	140.1	62%	0.617	75%	0.753	S	S	*	*			cis	-165.2	172.7	-10.1	-105.5	166.4	-177.7	164	0	106.3
10	C	41.4	Very low	38.8	Very low	96 Å²	96	141.2 Å²	141.2	65%	0.649	76%	0.758	S	S	*	*			cis	-156.6	152.5	3.5	-127.9	0	0	0	0	111.9
11	L	38.9	Very low	38.8	Very low	147 Å²	147	142.5 Å²	142.5	77%	0.77	76%	0.764	S	S	*	*				8.2	160.9	128	-77.2	156.6	0	0	0	121.9
12	P	44.9	Very low	38.6	Very low	91 Å²	91	138.2 Å²	138.2	59%	0.591	75%	0.75	S	S	*	*			cis	-146.8	175	-0.5	36.7	-14.7	0	0	0	119.9
13	H	40.4	Very low	38.6	Very low	183 Å²	183	135.4 Å²	135.4	85%	0.847	75%	0.748	S	S	*	*			trans	65	137	152.3	-52.7	-34	0	0	0	120.3
14	G	37.5	Very low	38.7	Very low	64 Å²	64	133.9 Å²	133.9	66%	0.66	75%	0.747	S	S	*	*			cis	176.7	-174.8	-3.3	0	0	0	0	0	113.6
15	I	41.2	Very low	38.8	Very low	169 Å²	169	138.8 Å²	138.8	87%	0.867	76%	0.761	S	S	*	*			trans	73.2	87.3	172.3	-43.5	172.1	0	0	0	116.6
16	L	39.9	Very low	38.9	Very low	171 Å²	171	133.9 Å²	133.9	90%	0.895	76%	0.758	S	S	*	*				-170.1	139.5	120.2	-104.8	159.3	0	0	0	110.7
17	I	38.5	Very low	39.5	Very low	162 Å²	162	137.9 Å²	137.9	83%	0.831	76%	0.761	S	S	*	*			trans	-109.5	149.4	-171	-70.3	166.6	0	0	0	109.3
18	A	36.3	Very low	40.1	Very low	93 Å²	93	139.1 Å²	139.1	77%	0.769	76%	0.755	S	S	*	*	S	Bend	trans	70.8	85.4	171	0	0	0	0	0	118
19	S	40	Very low	41.3	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	74%	0.741	S	S	*	*			trans	-169.9	-12.2	155.3	42.1	0	0	0	0	114.9	L21	S19-L21 VanDerWaalsContact C-N 3.32Å; S19-L21 PolarHBondContact O-N 2.94Å
20	L	37.8	Very low	43.4	Very low	163 Å²	163	129.6 Å²	129.6	85%	0.853	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	61.9	-175.9	-73.2	163.1	0	0	0	114.5
21	L	37.9	Very low	45.6	Very low	168 Å²	168	125.9 Å²	125.9	88%	0.88	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.2	2.2	162.9	-107.2	168.6	0	0	0	114.3	S19	S19-L21 VanDerWaalsContact C-N 3.32Å; S19-L21 PolarHBondContact O-N 2.94Å
22	V	38.5	Very low	48	Very low	137 Å²	137	118.9 Å²	118.9	83%	0.83	66%	0.664	S	S	*	*	S	Bend	trans	-125.5	56.1	176.9	-166.9	0	0	0	0	110.1
23	V	37.5	Very low	50.2	Low	118 Å²	118	117.9 Å²	117.9	72%	0.715	65%	0.65	S	S	*	*			trans	-134.9	64.1	-178.3	-167.2	0	0	0	0	110.7
24	S	36.1	Very low	52.6	Low	95 Å²	95	111 Å²	111	66%	0.664	62%	0.62	S	S	*	*	S	Bend	trans	-163.1	-5	166.1	53.1	0	0	0	0	115.8
25	W	36.2	Very low	55.1	Low	233 Å²	233	111.1 Å²	111.1	88%	0.883	61%	0.614	S	S	*	*	S	Bend	trans	-113.6	-6.6	-175.9	-77	51	0	0	0	114.8	Q27	W25-Q27 PolarHBondContact O-N 3.29Å
26	G	42.2	Very low	57.3	Low	66 Å²	66	106.3 Å²	106.3	68%	0.68	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-5.5	-175.7	0	0	0	0	0	116.2	Y28	G26-Y28 PolarHBondContact O-N 3.15Å
27	Q	50.2	Low	59.4	Low	172 Å²	172	101.3 Å²	101.3	80%	0.804	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-3.4	-167.1	-145.3	166.1	-1.1	0	0	114.4	W25	W25-Q27 PolarHBondContact O-N 3.29Å
28	Y	51.6	Low	61.5	Low	135 Å²	135	97 Å²	97	53%	0.529	57%	0.571	S	S	.	*	S	Bend	trans	-104.1	-15.7	-176.9	-69.3	-64.5	0	0	0	114.8	G26 D30 N122 K124	G26-Y28 PolarHBondContact O-N 3.15Å; Y28-D30 PolarHBondContact O-N 3.18Å; Y28-N122 PolarHBondContact O-ND2 2.96Å; Y28-K124 HydrophobicContact CD1-CD 3.44Å; Y28-K124 VanDerWaalsContact CD1-CD 3.44Å; Y28-K124 HydrophobicContact CE1-CD 3.97Å; Y28-K124 HydrophobicContact CG-CD 4.32Å
29	D	62.7	Low	64	Low	96 Å²	96	96.3 Å²	96.3	51%	0.513	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-4.1	177.6	-171.8	61.8	0	0	0	112.6	K33	D29-K33 WeakPolarHBondContact O-CE 3.44Å; D29-K33 PolarHBondContact O-NZ 3.26Å; D29-K33 IonicContact OD2-NZ 2.67Å; D29-K33 PolarHBondContact OD2-NZ 2.93Å
30	D	82.6	Confident	66.4	Low	60 Å²	60	96.4 Å²	96.4	32%	0.321	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	-16	-174.7	-105.3	23.9	0	0	0	114.6	Y28 K33 K63	Y28-D30 PolarHBondContact O-N 3.18Å; D30-K33 WeakPolarHBondContact O-CB 3.41Å; D30-K33 PolarHBondContact O-N 3.41Å; D30-K33 VanDerWaalsContact O-N 3.12Å; D30-K33 WeakPolarHBondContact OD1-CD 3.43Å; D30-K33 IonicContact OD1-NZ 3.06Å; D30-K33 PolarHBondContact OD1-NZ 3.38Å; D30-K63 HydrophobicContact CB-CD 4.04Å; D30-K63 VanDerWaalsContact O-CB 3.26Å; D30-K63 WeakPolarHBondContact O-CB 3.43Å; D30-K63 WeakPolarHBondContact O-CD 3.48Å; D30-K63 IonicContact OD2-NZ 3.61Å; D30-K63 PolarHBondContact OD2-NZ 3.02Å
31	D	86.6	Confident	68.9	Low	18 Å²	18	89.3 Å²	89.3	10%	0.096	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	138.1	170.3	-82.4	-46.7	0	0	0	109.8	G64 T72 I73 N122 K124	D31-G64 WeakPolarHBondContact OD1-CA 3.45Å; D31-T72 PolarHBondContact OD1-OG1 3.34Å; D31-T72 WeakPolarHBondContact OD2-CB 3.42Å; D31-I73 HydrophobicContact CB-CG2 3.93Å; D31-N122 VanDerWaalsContact CB-ND2 3.26Å; D31-N122 WeakPolarHBondContact CB-ND2 3.44Å; D31-N122 PolarHBondContact O-ND2 2.66Å; D31-N122 VanDerWaalsContact O-ND2 3.12Å; D31-K124 IonicContact OD2-NZ 3.41Å; D31-K124 PolarHBondContact OD2-NZ 2.86Å
32	C	90	Very high	71.5	Confident	0 Å²	0	82 Å²	82	0%	0	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	-5.2	-168	-69.2	0	0	0	0	118.3	K63 I73 C120 N122 I129 H131	C32-K63 PolarHBondContact N-O 3.06Å; C32-I73 VanDerWaalsContact SG-CG2 3.53Å; C32-C120 WeakPolarHBondContact CA-SG 3.38Å; C32-C120 HydrophobicContact CB-CB 3.68Å; C32-C120 WeakPolarHBondContact CB-SG 3.37Å; C32-C120 WeakPolarHBondContact SG-CB 3.48Å; C32-C120 CovalentContact SG-SG 2.03Å; C32-C120 PolarHBondContact SG-SG 3.09Å; C32-N122 HydrophobicContact CB-CB 4.42Å; C32-N122 PolarHBondContact SG-N 3.06Å; C32-N122 VanDerWaalsContact SG-N 3.39Å; C32-I129 HydrophobicContact CB-CB 4.33Å; C32-I129 HydrophobicContact CB-CD1 3.94Å; C32-I129 HydrophobicContact CB-CG1 4.3Å; C32-H131 PolarHBondContact O-CE1 2.69Å; C32-H131 VanDerWaalsContact O-CE1 3.23Å; C32-H131 PolarHBondContact O-NE2 3.45Å
33	K	91.3	Very high	74.1	Confident	71 Å²	71	80.5 Å²	80.5	31%	0.309	47%	0.47	S	S	.	.	S	Bend	trans	-80.5	155.3	170.8	-60.7	178.6	-167.2	153.4	0	111	D29 D30 K63 I129	D29-K33 WeakPolarHBondContact O-CE 3.44Å; D29-K33 PolarHBondContact O-NZ 3.26Å; D29-K33 IonicContact OD2-NZ 2.67Å; D29-K33 PolarHBondContact OD2-NZ 2.93Å; D30-K33 WeakPolarHBondContact O-CB 3.41Å; D30-K33 PolarHBondContact O-N 3.41Å; D30-K33 VanDerWaalsContact O-N 3.12Å; D30-K33 WeakPolarHBondContact OD1-CD 3.43Å; D30-K33 IonicContact OD1-NZ 3.06Å; D30-K33 PolarHBondContact OD1-NZ 3.38Å; K33-K63 HydrophobicContact CB-CD 4.45Å; K33-K63 WeakPolarHBondContact O-CB 3.44Å; K33-K63 WeakPolarHBondContact O-CG 3.49Å; K33-K63 PolarHBondContact O-N 2.77Å; K33-I129 HydrophobicContact CG-CD1 4.31Å
34	L	90.1	Very high	76.9	Confident	39 Å²	39	76.5 Å²	76.5	20%	0.204	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-68.3	139.1	173.6	-68.4	172.7	0	0	0	111.3	R36 I62	L34-R36 HydrophobicContact CB-CG 4.21Å; L34-I62 HydrophobicContact CD2-CG1 4.16Å
35	A	89.2	Confident	79.7	Confident	65 Å²	65	74.2 Å²	74.2	54%	0.537	43%	0.432	S	S	.	.	S	Bend	trans	-94.1	8.9	172.3	0	0	0	0	0	112.7	L61 K63	A35-L61 HydrophobicContact CB-CB 4.47Å; A35-L61 WeakPolarHBondContact CB-O 3.44Å; A35-L61 PolarHBondContact N-O 2.88Å; A35-K63 HydrophobicContact CB-CG 3.9Å
36	R	88	Confident	82.6	Confident	68 Å²	68	63.7 Å²	63.7	26%	0.257	39%	0.393	S	S	.	.	S	Bend	trans	-113.7	155.4	176.3	63.3	171.2	-175.6	77	-5.4	111.7	L34 P39 P40 A41 T42 L61	L34-R36 HydrophobicContact CB-CG 4.21Å; R36-P39 PolarHBondContact NH1-O 2.87Å; R36-P39 PolarHBondContact NH2-O 2.9Å; R36-P40 PolarHBondContact NH2-O 3.03Å; R36-A41 VanDerWaalsContact NH2-C 3.31Å; R36-A41 PolarHBondContact NH2-O 3.41Å; R36-T42 PolarHBondContact NH2-OG1 3.09Å; R36-L61 HydrophobicContact CB-CB 4.43Å; R36-L61 HydrophobicContact CB-CD1 3.95Å
37	G	83.3	Confident	85.1	Confident	67 Å²	67	62.9 Å²	62.9	69%	0.691	37%	0.373	S	S	*	.			trans	-75.9	-178.7	163.1	0	0	0	0	0	112.5
38	G	83.9	Confident	87.2	Confident	71 Å²	71	54.8 Å²	54.8	73%	0.732	34%	0.336	S	S	*	.	S	Bend	trans	91.9	-170.5	178.2	0	0	0	0	0	114
39	P	89.1	Confident	89.3	Confident	79 Å²	79	53.4 Å²	53.4	51%	0.513	33%	0.334	S	S	.	.			trans	-67.3	157.9	-179.2	28.9	-35.4	0	0	0	112	R36 A41	R36-P39 PolarHBondContact NH1-O 2.87Å; R36-P39 PolarHBondContact NH2-O 2.9Å; P39-A41 VanDerWaalsContact C-N 3.32Å; P39-A41 PolarHBondContact O-N 3.1Å
40	P	88.9	Confident	90.8	Very high	104 Å²	104	49.8 Å²	49.8	68%	0.675	32%	0.316	S	S	*	.	S	Bend	trans	-64.6	-34.9	179.9	25.8	-34.3	0	0	0	112.7	R36	R36-P40 PolarHBondContact NH2-O 3.03Å
41	A	91.3	Very high	91.4	Very high	14 Å²	14	57.1 Å²	57.1	12%	0.116	34%	0.339	C	S	.	.	S	Bend	trans	-69.2	136.9	173	0	0	0	0	0	110.9	R36 P39 I43 E132	R36-A41 VanDerWaalsContact NH2-C 3.31Å; R36-A41 PolarHBondContact NH2-O 3.41Å; P39-A41 VanDerWaalsContact C-N 3.32Å; P39-A41 PolarHBondContact O-N 3.1Å; A41-I43 HydrophobicContact CB-CG1 4.27Å; A41-E132 CarbonylContact C-O 3.4Å; A41-E132 WeakPolarHBondContact CA-O 3.34Å; A41-E132 HydrophobicContact CB-CB 4.3Å; A41-E132 HydrophobicContact CB-CG 4.48Å
42	T	92.9	Very high	91.8	Very high	14 Å²	14	60.1 Å²	60.1	9%	0.086	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	108.7	166.8	-63	0	0	0	0	107.5	R36 V44 V57 M60 E132 V133 R134	R36-T42 PolarHBondContact NH2-OG1 3.09Å; T42-V44 HydrophobicContact CG2-CG1 4.36Å; T42-V57 HydrophobicContact CG2-CG1 4.11Å; T42-V57 HydrophobicContact CG2-CG2 3.87Å; T42-M60 HydrophobicContact CG2-SD 4.26Å; T42-E132 PolarHBondContact N-O 2.84Å; T42-V133 CarbonylContact O-C 3.48Å; T42-V133 VanDerWaalsContact O-CA 3.31Å; T42-V133 WeakPolarHBondContact O-CA 3.49Å; T42-R134 PolarHBondContact O-N 3.04Å
43	I	93.5	Very high	91.9	Very high	105 Å²	105	62 Å²	62	54%	0.538	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.5	-179.4	-53.3	177.6	0	0	0	108.3	A41 R134 V136	A41-I43 HydrophobicContact CB-CG1 4.27Å; I43-R134 WeakPolarHBondContact CA-O 3.32Å; I43-R134 HydrophobicContact CG1-CB 4.34Å; I43-V136 HydrophobicContact CG2-CG2 4.41Å
44	V	94.8	Very high	92.1	Very high	35 Å²	35	60.5 Å²	60.5	21%	0.212	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	162	177.4	-65.7	0	0	0	0	109.4	T42 L56 V57 R134 I135 V136	T42-V44 HydrophobicContact CG2-CG1 4.36Å; V44-L56 WeakPolarHBondContact CG1-O 3.49Å; V44-L56 WeakPolarHBondContact CG2-O 3.25Å; V44-V57 HydrophobicContact CG1-CG2 3.99Å; V44-V57 HydrophobicContact CG2-CG2 4.19Å; V44-R134 PolarHBondContact N-O 2.86Å; V44-I135 HydrophobicContact CG2-CB 4.28Å; V44-I135 HydrophobicContact CG2-CG1 3.79Å; V44-I135 HydrophobicContact CG2-CG2 4.39Å; V44-I135 WeakPolarHBondContact O-CA 3.42Å; V44-V136 PolarHBondContact O-N 2.98Å
45	A	95.6	Very high	92.4	Very high	46 Å²	46	62.6 Å²	62.6	38%	0.38	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.9	177.7	0	0	0	0	0	110.6	V136 R138	A45-V136 VanDerWaalsContact CA-O 3.24Å; A45-V136 WeakPolarHBondContact CA-O 3.33Å; A45-V136 HydrophobicContact CB-CB 4.14Å; A45-R138 HydrophobicContact CB-CG 4.34Å; A45-R138 VanDerWaalsContact CB-NH1 3.29Å; A45-R138 PolarHBondContact O-NH1 3.06Å
46	I	96.1	Very high	92.7	Very high	12 Å²	12	60 Å²	60	6%	0.062	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	161.2	175	56.7	165.4	0	0	0	109.2	T54 L56 L96 L103 I135 V136 R138	I46-T54 HydrophobicContact CG2-CG2 4.26Å; I46-L56 HydrophobicContact CD1-CD2 3.64Å; I46-L56 HydrophobicContact CG1-CD2 4.35Å; I46-L56 HydrophobicContact CG2-CD2 3.96Å; I46-L96 HydrophobicContact CD1-CD2 4.03Å; I46-L103 HydrophobicContact CD1-CD2 3.48Å; I46-L103 VanDerWaalsContact CD1-CD2 3.48Å; I46-L103 HydrophobicContact CG1-CD2 4.39Å; I46-I135 HydrophobicContact CD1-CG2 4.01Å; I46-I135 HydrophobicContact CG1-CG2 3.72Å; I46-V136 PolarHBondContact N-O 2.69Å; I46-V136 VanDerWaalsContact N-O 3.12Å; I46-R138 WeakPolarHBondContact O-CB 3.37Å; I46-R138 PolarHBondContact O-N 3.46Å
47	D	95.2	Very high	93.1	Very high	49 Å²	49	57.2 Å²	57.2	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	153.5	169.1	-55.3	-17.4	0	0	0	109.2	S50 R138 R140	D47-S50 VanDerWaalsContact O-CB 3.26Å; D47-S50 WeakPolarHBondContact O-CB 3.29Å; D47-S50 PolarHBondContact O-OG 3.11Å; D47-R138 IonicContact OD1-CZ 2.63Å; D47-R138 IonicContact OD1-NE 3.18Å; D47-R138 PolarHBondContact OD1-NE 2.85Å; D47-R138 IonicContact OD1-NH2 3.98Å; D47-R138 PolarHBondContact OD1-NH2 3.19Å; D47-R140 HydrophobicContact CB-CG 4.03Å; D47-R140 IonicContact OD2-NH1 3.77Å; D47-R140 PolarHBondContact OD2-NH1 2.96Å
48	E	95.5	Very high	93.6	Very high	3 Å²	3	59.7 Å²	59.7	1%	0.014	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	169.4	162.8	81.1	-168.9	94	0	0	112.5	S50 L103 R105 V137 R138 D139 R140	E48-S50 PolarHBondContact O-N 3.45Å; E48-L103 WeakPolarHBondContact CA-O 3.42Å; E48-L103 WeakPolarHBondContact CB-O 3.34Å; E48-R105 HydrophobicContact CB-CB 4.06Å; E48-R105 VanDerWaalsContact CD-CB 3.47Å; E48-R105 HydrophobicContact CG-CB 4.5Å; E48-R105 WeakPolarHBondContact OE1-CB 3.25Å; E48-R105 WeakPolarHBondContact OE2-CA 3.33Å; E48-R105 WeakPolarHBondContact OE2-CB 3.22Å; E48-R105 PolarHBondContact OE2-N 2.89Å; E48-V137 HydrophobicContact CB-CG1 3.61Å; E48-R138 PolarHBondContact N-O 3.37Å; E48-D139 WeakPolarHBondContact OE1-CA 3.36Å; E48-R140 HydrophobicContact CG-CB 3.97Å; E48-R140 HydrophobicContact CG-CG 3.97Å; E48-R140 PolarHBondContact OE1-N 3.49Å
49	E	94.1	Very high	94.1	Very high	105 Å²	105	59.7 Å²	59.7	49%	0.491	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	10.8	-168.2	-57.4	-136	120	0	0	115	R51 V102 L103	E49-R51 PolarHBondContact O-N 3.14Å; E49-V102 HydrophobicContact CB-CG1 4.03Å; E49-V102 HydrophobicContact CG-CG1 3.53Å; E49-V102 WeakPolarHBondContact OE1-CG1 3.48Å; E49-L103 PolarHBondContact N-O 2.95Å
50	S	94.9	Very high	94.2	Very high	20 Å²	20	56 Å²	56	14%	0.14	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-52.1	131	-176.7	-86.6	0	0	0	0	111.5	D47 E48 L96	D47-S50 VanDerWaalsContact O-CB 3.26Å; D47-S50 WeakPolarHBondContact O-CB 3.29Å; D47-S50 PolarHBondContact O-OG 3.11Å; E48-S50 PolarHBondContact O-N 3.45Å; S50-L96 WeakPolarHBondContact O-CD2 3.4Å
51	R	95	Very high	94.5	Very high	215 Å²	215	54.8 Å²	54.8	81%	0.811	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-56.1	143.5	-173.5	-63	-178.5	-176.9	179.3	1.6	111.6	E49 G53 T54	E49-R51 PolarHBondContact O-N 3.14Å; R51-G53 PolarHBondContact O-N 2.92Å; R51-T54 PolarHBondContact N-OG1 3.08Å; R51-T54 VanDerWaalsContact O-CB 3.27Å; R51-T54 WeakPolarHBondContact O-CB 3.49Å; R51-T54 PolarHBondContact O-N 3.11Å; R51-T54 PolarHBondContact O-OG1 3.09Å
52	N	94.5	Very high	94.6	Very high	80 Å²	80	54.4 Å²	54.4	43%	0.428	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	131.2	170.8	-179.6	71	0	0	0	111.1	N97 S98 T99	N52-N97 WeakPolarHBondContact OD1-CA 3.5Å; N52-S98 PolarHBondContact OD1-N 2.95Å; N52-T99 PolarHBondContact ND2-OG1 2.95Å; N52-T99 VanDerWaalsContact ND2-OG1 3.16Å; N52-T99 PolarHBondContact OD1-N 2.81Å; N52-T99 PolarHBondContact OD1-OG1 2.7Å
53	G	93.7	Very high	94.5	Very high	40 Å²	40	57.2 Å²	57.2	41%	0.412	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	1.8	-173.3	0	0	0	0	0	115.1	R51 I55 L96	R51-G53 PolarHBondContact O-N 2.92Å; G53-I55 PolarHBondContact O-N 3.49Å; G53-L96 PolarHBondContact N-O 2.95Å
54	T	95.4	Very high	94.4	Very high	40 Å²	40	53.4 Å²	53.4	25%	0.245	29%	0.287	C	S	.	.			trans	-54.7	130.1	171	-68.2	0	0	0	0	110.4	I46 R51 L56 F95 L96	I46-T54 HydrophobicContact CG2-CG2 4.26Å; R51-T54 PolarHBondContact N-OG1 3.08Å; R51-T54 VanDerWaalsContact O-CB 3.27Å; R51-T54 WeakPolarHBondContact O-CB 3.49Å; R51-T54 PolarHBondContact O-N 3.11Å; R51-T54 PolarHBondContact O-OG1 3.09Å; T54-L56 PolarHBondContact O-N 3.04Å; T54-F95 CarbonylContact O-C 3.56Å; T54-F95 WeakPolarHBondContact O-CA 3.29Å; T54-L96 PolarHBondContact O-N 2.9Å
55	I	96.1	Very high	94.2	Very high	83 Å²	83	55.5 Å²	55.5	43%	0.426	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	118.2	178.3	-60.8	169.9	0	0	0	108.4	G53 D58 M93 F95	G53-I55 PolarHBondContact O-N 3.49Å; I55-D58 HydrophobicContact CG2-CB 4.27Å; I55-M93 HydrophobicContact CD1-SD 3.86Å; I55-M93 HydrophobicContact CG1-SD 3.96Å; I55-M93 HydrophobicContact CG2-CG 4.11Å; I55-M93 HydrophobicContact CG2-SD 3.9Å; I55-F95 HydrophobicContact CG1-CD1 4.03Å; I55-F95 HydrophobicContact CG1-CE1 4.03Å
56	L	95.7	Very high	94	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-46.2	177.1	-61.2	175	0	0	0	110.7	V44 I46 T54 V85 L94 L96 I135	V44-L56 WeakPolarHBondContact CG1-O 3.49Å; V44-L56 WeakPolarHBondContact CG2-O 3.25Å; I46-L56 HydrophobicContact CD1-CD2 3.64Å; I46-L56 HydrophobicContact CG1-CD2 4.35Å; I46-L56 HydrophobicContact CG2-CD2 3.96Å; T54-L56 PolarHBondContact O-N 3.04Å; L56-V85 HydrophobicContact CD1-CB 4.38Å; L56-V85 HydrophobicContact CD1-CG1 4.05Å; L56-V85 HydrophobicContact CD1-CG2 3.84Å; L56-L94 HydrophobicContact CB-CB 4.1Å; L56-L94 PolarHBondContact N-O 3.3Å; L56-L96 HydrophobicContact CD1-CB 4.39Å; L56-L96 HydrophobicContact CD2-CB 4.09Å; L56-L96 HydrophobicContact CG-CB 4.27Å; L56-I135 HydrophobicContact CB-CG1 4.48Å; L56-I135 HydrophobicContact CD1-CG1 4.25Å; L56-I135 HydrophobicContact CD2-CG1 4.36Å; L56-I135 HydrophobicContact CD2-CG2 4Å
57	V	94.9	Very high	93.5	Very high	10 Å²	10	55.1 Å²	55.1	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	114.8	177.4	-177.8	0	0	0	0	107.5	T42 V44 N59 M60 M93 L94 V133	T42-V57 HydrophobicContact CG2-CG1 4.11Å; T42-V57 HydrophobicContact CG2-CG2 3.87Å; V44-V57 HydrophobicContact CG1-CG2 3.99Å; V44-V57 HydrophobicContact CG2-CG2 4.19Å; V57-N59 PolarHBondContact O-N 3.12Å; V57-M60 HydrophobicContact CB-SD 4.45Å; V57-M60 HydrophobicContact CG1-CG 4.23Å; V57-M60 HydrophobicContact CG1-SD 3.92Å; V57-M60 HydrophobicContact CG2-SD 4.43Å; V57-M93 CarbonylContact O-C 3.23Å; V57-M93 VanDerWaalsContact O-CA 3.31Å; V57-M93 WeakPolarHBondContact O-CA 3.44Å; V57-M93 WeakPolarHBondContact O-CG 3.39Å; V57-L94 HydrophobicContact CB-CB 4.07Å; V57-L94 HydrophobicContact CB-CD1 4.18Å; V57-L94 HydrophobicContact CB-CG 4.23Å; V57-L94 HydrophobicContact CG2-CB 4.39Å; V57-L94 HydrophobicContact CG2-CD1 3.95Å; V57-L94 PolarHBondContact N-O 2.9Å; V57-L94 PolarHBondContact O-N 2.93Å; V57-V133 HydrophobicContact CG2-CG1 3.9Å
58	D	94	Very high	93.1	Very high	119 Å²	119	55.8 Å²	55.8	64%	0.636	32%	0.319	S	S	*	.	S	Bend	trans	-63.3	-40.1	-178.4	-175	60.4	0	0	0	112.3	I55 M93	I55-D58 HydrophobicContact CG2-CB 4.27Å; D58-M93 WeakPolarHBondContact O-CB 3.47Å
59	N	94	Very high	92.6	Very high	72 Å²	72	61.4 Å²	61.4	39%	0.385	36%	0.356	S	S	.	.			trans	-154.9	125.1	174.2	-168.3	-35	0	0	0	110.6	V57 L61	V57-N59 PolarHBondContact O-N 3.12Å; N59-L61 HydrophobicContact CB-CD2 4.35Å; N59-L61 HydrophobicContact CB-CG 4.49Å; N59-L61 PolarHBondContact O-N 2.8Å; N59-L61 WeakPolarHBondContact OD1-CA 3.41Å; N59-L61 PolarHBondContact OD1-N 2.9Å
60	M	93	Very high	92.4	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.005	37%	0.367	C	S	.	.			trans	-68.2	-16.5	177.1	-75.3	-70.9	-65.1	0	0	114.2	T42 V57 I62 Q92 L94 V118 H131 V133	T42-M60 HydrophobicContact CG2-SD 4.26Å; V57-M60 HydrophobicContact CB-SD 4.45Å; V57-M60 HydrophobicContact CG1-CG 4.23Å; V57-M60 HydrophobicContact CG1-SD 3.92Å; V57-M60 HydrophobicContact CG2-SD 4.43Å; M60-I62 VanDerWaalsContact C-N 3.32Å; M60-I62 HydrophobicContact CB-CD1 3.85Å; M60-I62 HydrophobicContact CB-CG1 3.92Å; M60-I62 HydrophobicContact CE-CD1 4.33Å; M60-I62 PolarHBondContact O-N 2.83Å; M60-Q92 HydrophobicContact CB-CB 4.08Å; M60-Q92 WeakPolarHBondContact CG-O 3.4Å; M60-Q92 PolarHBondContact N-O 2.9Å; M60-L94 HydrophobicContact CG-CD1 4.48Å; M60-L94 HydrophobicContact SD-CD1 4.05Å; M60-V118 HydrophobicContact CE-CB 4.04Å; M60-V118 HydrophobicContact CE-CG2 3.89Å; M60-V118 HydrophobicContact SD-CG2 4.32Å; M60-H131 HydrophobicContact CE-CB 3.62Å; M60-V133 HydrophobicContact CE-CG2 3.63Å; M60-V133 HydrophobicContact SD-CG2 3.64Å
61	L	93.8	Very high	92.1	Very high	78 Å²	78	63.8 Å²	63.8	41%	0.408	37%	0.373	S	S	.	.			trans	55.4	42.4	-178.8	-59.7	172.3	0	0	0	112.7	A35 R36 N59	A35-L61 HydrophobicContact CB-CB 4.47Å; A35-L61 WeakPolarHBondContact CB-O 3.44Å; A35-L61 PolarHBondContact N-O 2.88Å; R36-L61 HydrophobicContact CB-CB 4.43Å; R36-L61 HydrophobicContact CB-CD1 3.95Å; N59-L61 HydrophobicContact CB-CD2 4.35Å; N59-L61 HydrophobicContact CB-CG 4.49Å; N59-L61 PolarHBondContact O-N 2.8Å; N59-L61 WeakPolarHBondContact OD1-CA 3.41Å; N59-L61 PolarHBondContact OD1-N 2.9Å
62	I	93.4	Very high	91.9	Very high	7 Å²	7	54.6 Å²	54.6	4%	0.036	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-84.6	129.6	173.3	-59.1	165.5	0	0	0	108.7	L34 M60 G64 I73 L75 Q92 V118 C120	L34-I62 HydrophobicContact CD2-CG1 4.16Å; M60-I62 VanDerWaalsContact C-N 3.32Å; M60-I62 HydrophobicContact CB-CD1 3.85Å; M60-I62 HydrophobicContact CB-CG1 3.92Å; M60-I62 HydrophobicContact CE-CD1 4.33Å; M60-I62 PolarHBondContact O-N 2.83Å; I62-G64 PolarHBondContact O-N 3.05Å; I62-I73 HydrophobicContact CG2-CD1 4.2Å; I62-L75 HydrophobicContact CD1-CD1 4.4Å; I62-L75 HydrophobicContact CD1-CD2 3.74Å; I62-L75 HydrophobicContact CG2-CD2 4.45Å; I62-Q92 PolarHBondContact O-NE2 2.76Å; I62-Q92 PolarHBondContact O-OE1 2.85Å; I62-V118 HydrophobicContact CD1-CG1 3.9Å; I62-C120 HydrophobicContact CG2-CB 4.37Å
63	K	92.1	Very high	91.9	Very high	73 Å²	73	50.8 Å²	50.8	32%	0.317	32%	0.321	S	S	.	.	S	Bend	trans	-64.4	131.5	176.5	-70.8	179.3	178.7	172.3	0	110.9	D30 C32 K33 A35	D30-K63 HydrophobicContact CB-CD 4.04Å; D30-K63 VanDerWaalsContact O-CB 3.26Å; D30-K63 WeakPolarHBondContact O-CB 3.43Å; D30-K63 WeakPolarHBondContact O-CD 3.48Å; D30-K63 IonicContact OD2-NZ 3.61Å; D30-K63 PolarHBondContact OD2-NZ 3.02Å; C32-K63 PolarHBondContact N-O 3.06Å; K33-K63 HydrophobicContact CB-CD 4.45Å; K33-K63 WeakPolarHBondContact O-CB 3.44Å; K33-K63 WeakPolarHBondContact O-CG 3.49Å; K33-K63 PolarHBondContact O-N 2.77Å; A35-K63 HydrophobicContact CB-CG 3.9Å
64	G	90	Very high	91.9	Very high	25 Å²	25	53.6 Å²	53.6	26%	0.258	32%	0.323	S	S	.	.	S	Bend	trans	119.5	170.1	177.4	0	0	0	0	0	113.3	D31 I62 T72	D31-G64 WeakPolarHBondContact OD1-CA 3.45Å; I62-G64 PolarHBondContact O-N 3.05Å; G64-T72 WeakPolarHBondContact CA-OG1 3.37Å
65	T	91.5	Very high	91.9	Very high	78 Å²	78	52.5 Å²	52.5	48%	0.479	32%	0.315	S	S	.	.			trans	-114.6	117.4	-179.2	50.6	0	0	0	0	110.4	P71 T72 I73	T65-P71 CarbonylContact O-C 3.36Å; T65-P71 WeakPolarHBondContact O-CA 3.47Å; T65-P71 WeakPolarHBondContact O-CB 3.27Å; T65-T72 PolarHBondContact N-OG1 3.24Å; T65-T72 PolarHBondContact O-N 2.89Å; T65-I73 PolarHBondContact O-N 3.02Å
66	A	90.8	Very high	91.8	Very high	27 Å²	27	50.3 Å²	50.3	22%	0.223	31%	0.308	C	S	.	.	S	Bend	trans	-89	-19.1	176.2	0	0	0	0	0	113.4	I73 L75 P89	A66-I73 HydrophobicContact CB-CD1 4.46Å; A66-I73 HydrophobicContact CB-CG1 4.05Å; A66-L75 HydrophobicContact CB-CD1 4.37Å; A66-L75 HydrophobicContact CB-CG 4.34Å; A66-P89 HydrophobicContact CB-CB 4.34Å; A66-P89 VanDerWaalsContact CB-O 3.32Å; A66-P89 WeakPolarHBondContact CB-O 3.31Å
67	G	86.3	Confident	91.9	Very high	24 Å²	24	51.7 Å²	51.7	25%	0.247	32%	0.315	C	S	.	.	S	Bend	trans	-109.6	170.8	174.8	0	0	0	0	0	112.8
68	G	85.9	Confident	91.9	Very high	62 Å²	62	55.8 Å²	55.8	64%	0.639	33%	0.332	S	S	*	.	S	Bend	trans	96.7	-179.1	-173.9	0	0	0	0	0	112.8
69	P	86.6	Confident	91.9	Very high	121 Å²	121	55.3 Å²	55.3	79%	0.786	33%	0.329	S	S	*	.	S	Bend	trans	-70.3	-34.3	-178.1	27.7	-34	0	0	0	113	P71	P69-P71 VanDerWaalsContact C-CD 3.5Å; P69-P71 VanDerWaalsContact O-CD 3.3Å; P69-P71 WeakPolarHBondContact O-CD 3.32Å
70	D	88.1	Confident	91.9	Very high	136 Å²	136	53.4 Å²	53.4	73%	0.727	32%	0.319	S	S	*	.	S	Bend	trans	-120.2	74.2	-176.2	-62.5	-58.5	0	0	0	110.9	T72	D70-T72 PolarHBondContact O-N 3.07Å
71	P	89.7	Confident	91.9	Very high	40 Å²	40	58 Å²	58	26%	0.26	35%	0.347	S	S	.	.			trans	-68.3	129.2	179.9	28	-34.4	0	0	0	111.4	T65 P69 K123	T65-P71 CarbonylContact O-C 3.36Å; T65-P71 WeakPolarHBondContact O-CA 3.47Å; T65-P71 WeakPolarHBondContact O-CB 3.27Å; P69-P71 VanDerWaalsContact C-CD 3.5Å; P69-P71 VanDerWaalsContact O-CD 3.3Å; P69-P71 WeakPolarHBondContact O-CD 3.32Å; P71-K123 HydrophobicContact CG-CD 4.46Å
72	T	91.2	Very high	91.8	Very high	21 Å²	21	59 Å²	59	13%	0.129	35%	0.353	C	S	.	.	S	Bend	trans	-84.6	-24.1	178.2	71.2	0	0	0	0	112.6	D31 G64 T65 D70 K123	D31-T72 PolarHBondContact OD1-OG1 3.34Å; D31-T72 WeakPolarHBondContact OD2-CB 3.42Å; G64-T72 WeakPolarHBondContact CA-OG1 3.37Å; T65-T72 PolarHBondContact N-OG1 3.24Å; T65-T72 PolarHBondContact O-N 2.89Å; D70-T72 PolarHBondContact O-N 3.07Å; T72-K123 PolarHBondContact O-N 3.2Å
73	I	93.5	Very high	91.9	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.005	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.1	-179.1	60.9	172.3	0	0	0	111.3	D31 C32 I62 T65 A66 L75 V121	D31-I73 HydrophobicContact CB-CG2 3.93Å; C32-I73 VanDerWaalsContact SG-CG2 3.53Å; I62-I73 HydrophobicContact CG2-CD1 4.2Å; T65-I73 PolarHBondContact O-N 3.02Å; A66-I73 HydrophobicContact CB-CD1 4.46Å; A66-I73 HydrophobicContact CB-CG1 4.05Å; I73-L75 HydrophobicContact CD1-CD1 4.26Å; I73-L75 HydrophobicContact CD1-CD2 4.16Å; I73-L75 HydrophobicContact CD1-CG 4.13Å; I73-V121 CarbonylContact C-O 3.53Å; I73-V121 VanDerWaalsContact CA-O 3.27Å; I73-V121 WeakPolarHBondContact CA-O 3.4Å
74	E	93.4	Very high	92	Very high	99 Å²	99	64 Å²	64	46%	0.463	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128	167.7	-161.6	166.1	122.4	0	0	109.1	C120 V121 K123	E74-C120 CarbonylContact O-C 3.59Å; E74-C120 VanDerWaalsContact O-CA 3.32Å; E74-C120 WeakPolarHBondContact O-CA 3.44Å; E74-V121 HydrophobicContact CB-CB 4.19Å; E74-V121 PolarHBondContact N-O 3.47Å; E74-V121 PolarHBondContact O-N 3.17Å; E74-K123 WeakPolarHBondContact OE2-CE 3.44Å; E74-K123 IonicContact OE2-NZ 2.68Å; E74-K123 PolarHBondContact OE2-NZ 3.46Å
75	L	95.6	Very high	92.4	Very high	16 Å²	16	62.9 Å²	62.9	8%	0.084	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.9	-179.5	-62.1	179.6	0	0	0	110.3	I62 A66 I73 L87 P89 Q92 V118 Q119 C120	I62-L75 HydrophobicContact CD1-CD1 4.4Å; I62-L75 HydrophobicContact CD1-CD2 3.74Å; I62-L75 HydrophobicContact CG2-CD2 4.45Å; A66-L75 HydrophobicContact CB-CD1 4.37Å; A66-L75 HydrophobicContact CB-CG 4.34Å; I73-L75 HydrophobicContact CD1-CD1 4.26Å; I73-L75 HydrophobicContact CD1-CD2 4.16Å; I73-L75 HydrophobicContact CD1-CG 4.13Å; L75-L87 HydrophobicContact CB-CD2 4.01Å; L75-P89 HydrophobicContact CB-CB 4.03Å; L75-Q92 HydrophobicContact CD1-CB 4.27Å; L75-Q92 HydrophobicContact CD1-CG 3.73Å; L75-V118 HydrophobicContact CD2-CG1 4.2Å; L75-Q119 WeakPolarHBondContact CA-O 3.28Å; L75-C120 HydrophobicContact CD2-CB 3.59Å; L75-C120 VanDerWaalsContact CD2-SG 3.53Å
76	S	95.3	Very high	92.6	Very high	38 Å²	38	63.2 Å²	63.2	27%	0.266	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	158.5	175.7	60.7	0	0	0	0	111.2	V118 Q119	S76-V118 CarbonylContact O-C 3.56Å; S76-Q119 PolarHBondContact N-O 3.07Å; S76-Q119 PolarHBondContact O-N 2.9Å
77	L	96.2	Very high	92.8	Very high	38 Å²	38	63.6 Å²	63.6	20%	0.199	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.5	174.7	-71	169.3	0	0	0	111	N80 V85 L87 L94 V116 V118	L77-N80 HydrophobicContact CB-CB 4.25Å; L77-V85 HydrophobicContact CD1-CB 4.1Å; L77-V85 HydrophobicContact CD1-CG1 3.88Å; L77-V85 WeakPolarHBondContact CD1-O 3.23Å; L77-V85 HydrophobicContact CD2-CG1 4.25Å; L77-L87 HydrophobicContact CD1-CB 3.82Å; L77-L87 HydrophobicContact CG-CB 3.93Å; L77-L87 HydrophobicContact CG-CD2 4.28Å; L77-L94 HydrophobicContact CD2-CD2 4.11Å; L77-V116 HydrophobicContact CD2-CB 4.41Å; L77-V116 HydrophobicContact CD2-CG2 4.01Å; L77-V118 HydrophobicContact CD2-CG2 3.89Å
78	K	95	Very high	93.3	Very high	96 Å²	96	64.3 Å²	64.3	42%	0.417	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	157.8	166.8	-64.9	-60.5	-176	-175.4	0	109.4	N80 Q117 Q119 Y130	K78-N80 PolarHBondContact O-N 3.39Å; K78-N80 VanDerWaalsContact O-N 3.07Å; K78-Q117 HydrophobicContact CB-CB 4.09Å; K78-Q117 PolarHBondContact N-O 2.96Å; K78-Q117 PolarHBondContact O-N 3.46Å; K78-Q119 HydrophobicContact CG-CB 4.02Å; K78-Y130 HydrophobicContact CG-CE1 4.23Å
79	D	94.1	Very high	93.7	Very high	109 Å²	109	63.7 Å²	63.7	58%	0.583	34%	0.338	S	S	*	.	S	Bend	trans	54.6	26.6	-178.9	-47	-30.7	0	0	0	114	V81 Q117	D79-V81 PolarHBondContact O-N 3.47Å; D79-Q117 WeakPolarHBondContact OD2-CG 3.38Å
80	N	94.4	Very high	94	Very high	31 Å²	31	62.7 Å²	62.7	17%	0.166	33%	0.329	C	S	.	.			trans	-78.1	67	177.7	-171.6	21.8	0	0	0	111	L77 K78 D82 Y83 W84 V85 V116	L77-N80 HydrophobicContact CB-CB 4.25Å; K78-N80 PolarHBondContact O-N 3.39Å; K78-N80 VanDerWaalsContact O-N 3.07Å; N80-D82 PolarHBondContact O-N 3.11Å; N80-Y83 PolarHBondContact O-N 3.1Å; N80-Y83 VanDerWaalsContact O-N 3.07Å; N80-W84 PolarHBondContact OD1-N 3.34Å; N80-V85 PolarHBondContact ND2-O 3.44Å; N80-V85 PolarHBondContact OD1-N 2.93Å; N80-V116 HydrophobicContact CB-CG1 4.19Å
81	V	92.2	Very high	94.3	Very high	99 Å²	99	61.9 Å²	61.9	60%	0.6	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-53.6	135.4	177.8	-176.9	0	0	0	0	109.5	D79 Y83 W84	D79-V81 PolarHBondContact O-N 3.47Å; V81-Y83 PolarHBondContact O-N 3.34Å; V81-W84 VanDerWaalsContact O-CD1 3.32Å; V81-W84 PolarHBondContact O-N 3Å
82	D	92.8	Very high	94.5	Very high	98 Å²	98	60.8 Å²	60.8	52%	0.524	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	51.3	14.7	-174.7	-53.6	-37.2	0	0	0	116.2	N80 W84 R101	N80-D82 PolarHBondContact O-N 3.11Å; D82-W84 VanDerWaalsContact C-N 3.28Å; D82-W84 PolarHBondContact O-N 2.82Å; D82-R101 PolarHBondContact O-NH1 2.89Å; D82-R101 PolarHBondContact O-NH2 2.96Å
83	Y	95	Very high	94.8	Very high	173 Å²	173	60.7 Å²	60.7	68%	0.678	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	56	37.7	-178.3	-51.4	-83.8	0	0	0	113.8	N80 V81 V85 N97 R101	N80-Y83 PolarHBondContact O-N 3.1Å; N80-Y83 VanDerWaalsContact O-N 3.07Å; V81-Y83 PolarHBondContact O-N 3.34Å; Y83-V85 PolarHBondContact O-N 3.43Å; Y83-N97 WeakPolarHBondContact O-CB 3.42Å; Y83-N97 PolarHBondContact O-ND2 3.19Å; Y83-R101 PolarHBondContact O-NH2 2.94Å
84	W	95.4	Very high	94.9	Very high	12 Å²	12	60.7 Å²	60.7	5%	0.045	31%	0.309	C	S	.	.			trans	-64.4	-26.6	177.1	-76.3	114	0	0	0	113.7	N80 V81 D82 L96 N97 R101 V102 L103 M109 I111 I114	N80-W84 PolarHBondContact OD1-N 3.34Å; V81-W84 VanDerWaalsContact O-CD1 3.32Å; V81-W84 PolarHBondContact O-N 3Å; D82-W84 VanDerWaalsContact C-N 3.28Å; D82-W84 PolarHBondContact O-N 2.82Å; W84-L96 HydrophobicContact CE3-CD1 3.92Å; W84-L96 WeakPolarHBondContact O-CA 3.18Å; W84-N97 PolarHBondContact O-N 2.79Å; W84-R101 VanDerWaalsContact CH2-CD 3.41Å; W84-R101 HydrophobicContact CH2-CG 3.77Å; W84-R101 HydrophobicContact CZ3-CG 3.98Å; W84-R101 VanDerWaalsContact CZ3-NE 3.3Å; W84-V102 VanDerWaalsContact CH2-O 3.31Å; W84-V102 WeakPolarHBondContact CH2-O 3.09Å; W84-L103 HydrophobicContact CD2-CD1 4.39Å; W84-L103 HydrophobicContact CE3-CD1 4.32Å; W84-L103 HydrophobicContact CH2-CB 4.34Å; W84-L103 HydrophobicContact CH2-CD1 4.38Å; W84-L103 HydrophobicContact CZ2-CD1 4.46Å; W84-L103 HydrophobicContact CZ3-CB 4Å; W84-L103 HydrophobicContact CZ3-CD1 4.31Å; W84-M109 HydrophobicContact CH2-CE 4.43Å; W84-M109 HydrophobicContact CZ2-CE 4.15Å; W84-I111 HydrophobicContact CZ2-CD1 3.61Å; W84-I114 HydrophobicContact CB-CD1 3.75Å; W84-I114 HydrophobicContact CB-CG1 4.28Å; W84-I114 HydrophobicContact CB-CG2 4.15Å; W84-I114 HydrophobicContact CD2-CD1 4.35Å; W84-I114 HydrophobicContact CG-CD1 3.9Å; W84-I114 HydrophobicContact CG-CG1 4.27Å
85	V	96.4	Very high	95.1	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136.9	-176.9	-174.4	0	0	0	0	111.4	L56 L77 N80 Y83 L94 F95 I114 V116 I135	L56-V85 HydrophobicContact CD1-CB 4.38Å; L56-V85 HydrophobicContact CD1-CG1 4.05Å; L56-V85 HydrophobicContact CD1-CG2 3.84Å; L77-V85 HydrophobicContact CD1-CB 4.1Å; L77-V85 HydrophobicContact CD1-CG1 3.88Å; L77-V85 WeakPolarHBondContact CD1-O 3.23Å; L77-V85 HydrophobicContact CD2-CG1 4.25Å; N80-V85 PolarHBondContact ND2-O 3.44Å; N80-V85 PolarHBondContact OD1-N 2.93Å; Y83-V85 PolarHBondContact O-N 3.43Å; V85-L94 HydrophobicContact CG1-CB 4.05Å; V85-L94 HydrophobicContact CG1-CD1 4.3Å; V85-L94 HydrophobicContact CG1-CD2 3.9Å; V85-L94 HydrophobicContact CG1-CG 4.31Å; V85-F95 CarbonylContact C-O 3.46Å; V85-F95 WeakPolarHBondContact CA-O 3.05Å; V85-I114 HydrophobicContact CG2-CG2 4.04Å; V85-V116 HydrophobicContact CB-CG1 4.23Å; V85-V116 HydrophobicContact CB-CG2 4.37Å; V85-V116 HydrophobicContact CG1-CG2 4.34Å; V85-V116 HydrophobicContact CG2-CG1 3.71Å; V85-V116 HydrophobicContact CG2-CG2 4.04Å; V85-I135 HydrophobicContact CG2-CD1 4.15Å
86	L	96	Very high	95.1	Very high	85 Å²	85	57.5 Å²	57.5	45%	0.445	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	149.2	166.3	-59.3	173.6	0	0	0	109.7	L94 F95 N97	L86-L94 CarbonylContact O-C 3.51Å; L86-L94 VanDerWaalsContact O-CA 3.26Å; L86-L94 WeakPolarHBondContact O-CA 3.32Å; L86-F95 HydrophobicContact CB-CB 4.41Å; L86-F95 PolarHBondContact N-O 3.46Å; L86-F95 PolarHBondContact O-N 2.98Å; L86-N97 HydrophobicContact CD1-CB 3.92Å; L86-N97 HydrophobicContact CD2-CB 4.31Å; L86-N97 HydrophobicContact CG-CB 3.81Å
87	L	96.3	Very high	95.1	Very high	36 Å²	36	57.2 Å²	57.2	19%	0.188	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.8	-179.8	167.4	64.9	0	0	0	110.1	L75 L77 P89 L94	L75-L87 HydrophobicContact CB-CD2 4.01Å; L77-L87 HydrophobicContact CD1-CB 3.82Å; L77-L87 HydrophobicContact CG-CB 3.93Å; L77-L87 HydrophobicContact CG-CD2 4.28Å; L87-P89 HydrophobicContact CG-CB 4.42Å; L87-P89 WeakPolarHBondContact O-CD 3.46Å; L87-L94 HydrophobicContact CB-CD2 3.74Å; L87-L94 HydrophobicContact CD1-CD2 3.6Å; L87-L94 HydrophobicContact CG-CD2 4.21Å
88	D	95.7	Very high	95	Very high	38 Å²	38	56 Å²	56	20%	0.203	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	103.7	156.5	176.9	-21.8	0	0	0	107.2	V90 K91 Q92 M93 F95	D88-V90 PolarHBondContact O-N 2.82Å; D88-V90 WeakPolarHBondContact OD1-CB 3.48Å; D88-V90 PolarHBondContact OD1-N 2.59Å; D88-K91 HydrophobicContact CB-CB 4.4Å; D88-K91 PolarHBondContact OD1-N 2.84Å; D88-K91 WeakPolarHBondContact OD2-CD 3.3Å; D88-K91 WeakPolarHBondContact OD2-CE 3.09Å; D88-K91 WeakPolarHBondContact OD2-CG 3.34Å; D88-K91 IonicContact OD2-NZ 2.71Å; D88-Q92 WeakPolarHBondContact O-CA 3.34Å; D88-Q92 PolarHBondContact O-N 3.31Å; D88-M93 HydrophobicContact CB-CB 4.5Å; D88-M93 PolarHBondContact N-O 3.07Å; D88-M93 PolarHBondContact O-N 3.45Å; D88-M93 VanDerWaalsContact O-N 3.14Å; D88-F95 HydrophobicContact CB-CE2 3.99Å
89	P	94.4	Very high	94.8	Very high	49 Å²	49	56 Å²	56	32%	0.318	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-22.5	-175.6	29.5	-35.9	0	0	0	112.5	A66 L75 L87	A66-P89 HydrophobicContact CB-CB 4.34Å; A66-P89 VanDerWaalsContact CB-O 3.32Å; A66-P89 WeakPolarHBondContact CB-O 3.31Å; L75-P89 HydrophobicContact CB-CB 4.03Å; L87-P89 HydrophobicContact CG-CB 4.42Å; L87-P89 WeakPolarHBondContact O-CD 3.46Å
90	V	93.3	Very high	94.7	Very high	101 Å²	101	55 Å²	55	61%	0.612	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-42.3	-178.2	-177.1	0	0	0	0	110.4	D88	D88-V90 PolarHBondContact O-N 2.82Å; D88-V90 WeakPolarHBondContact OD1-CB 3.48Å; D88-V90 PolarHBondContact OD1-N 2.59Å
91	K	94.1	Very high	94.7	Very high	119 Å²	119	57.5 Å²	57.5	52%	0.517	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-14.9	173.6	-62.2	-178.9	-165.5	163	0	113.4	D88 M93	D88-K91 HydrophobicContact CB-CB 4.4Å; D88-K91 PolarHBondContact OD1-N 2.84Å; D88-K91 WeakPolarHBondContact OD2-CD 3.3Å; D88-K91 WeakPolarHBondContact OD2-CE 3.09Å; D88-K91 WeakPolarHBondContact OD2-CG 3.34Å; D88-K91 IonicContact OD2-NZ 2.71Å; K91-M93 HydrophobicContact CB-CB 4Å; K91-M93 HydrophobicContact CB-CE 4.37Å; K91-M93 HydrophobicContact CD-CE 3.53Å; K91-M93 PolarHBondContact O-N 2.83Å
92	Q	94.5	Very high	94.7	Very high	17 Å²	17	55.4 Å²	55.4	8%	0.079	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	33.7	-168.6	-41.1	-173.9	1.8	0	0	112.7	M60 I62 L75 D88	M60-Q92 HydrophobicContact CB-CB 4.08Å; M60-Q92 WeakPolarHBondContact CG-O 3.4Å; M60-Q92 PolarHBondContact N-O 2.9Å; I62-Q92 PolarHBondContact O-NE2 2.76Å; I62-Q92 PolarHBondContact O-OE1 2.85Å; L75-Q92 HydrophobicContact CD1-CB 4.27Å; L75-Q92 HydrophobicContact CD1-CG 3.73Å; D88-Q92 WeakPolarHBondContact O-CA 3.34Å; D88-Q92 PolarHBondContact O-N 3.31Å
93	M	96.1	Very high	94.8	Very high	19 Å²	19	50.8 Å²	50.8	9%	0.094	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138.1	-175.6	179.2	161.6	38.4	0	0	110.3	I55 V57 D58 D88 K91 F95	I55-M93 HydrophobicContact CD1-SD 3.86Å; I55-M93 HydrophobicContact CG1-SD 3.96Å; I55-M93 HydrophobicContact CG2-CG 4.11Å; I55-M93 HydrophobicContact CG2-SD 3.9Å; V57-M93 CarbonylContact O-C 3.23Å; V57-M93 VanDerWaalsContact O-CA 3.31Å; V57-M93 WeakPolarHBondContact O-CA 3.44Å; V57-M93 WeakPolarHBondContact O-CG 3.39Å; D58-M93 WeakPolarHBondContact O-CB 3.47Å; D88-M93 HydrophobicContact CB-CB 4.5Å; D88-M93 PolarHBondContact N-O 3.07Å; D88-M93 PolarHBondContact O-N 3.45Å; D88-M93 VanDerWaalsContact O-N 3.14Å; K91-M93 HydrophobicContact CB-CB 4Å; K91-M93 HydrophobicContact CB-CE 4.37Å; K91-M93 HydrophobicContact CD-CE 3.53Å; K91-M93 PolarHBondContact O-N 2.83Å; M93-F95 HydrophobicContact CB-CE2 4.35Å; M93-F95 HydrophobicContact CB-CZ 4.43Å; M93-F95 HydrophobicContact CE-CE1 4Å; M93-F95 HydrophobicContact CE-CE2 4.35Å; M93-F95 HydrophobicContact CE-CZ 3.49Å; M93-F95 VanDerWaalsContact CE-CZ 3.49Å; M93-F95 HydrophobicContact CG-CD2 4.5Å; M93-F95 HydrophobicContact CG-CE1 4.08Å; M93-F95 HydrophobicContact CG-CE2 3.98Å; M93-F95 HydrophobicContact CG-CZ 3.78Å; M93-F95 HydrophobicContact SD-CE1 3.82Å; M93-F95 HydrophobicContact SD-CZ 3.8Å
94	L	96.6	Very high	94.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.3	177.8	-61.3	-179.3	0	0	0	111.2	L56 V57 M60 L77 V85 L86 L87 V118 V133	L56-L94 HydrophobicContact CB-CB 4.1Å; L56-L94 PolarHBondContact N-O 3.3Å; V57-L94 HydrophobicContact CB-CB 4.07Å; V57-L94 HydrophobicContact CB-CD1 4.18Å; V57-L94 HydrophobicContact CB-CG 4.23Å; V57-L94 HydrophobicContact CG2-CB 4.39Å; V57-L94 HydrophobicContact CG2-CD1 3.95Å; V57-L94 PolarHBondContact N-O 2.9Å; V57-L94 PolarHBondContact O-N 2.93Å; M60-L94 HydrophobicContact CG-CD1 4.48Å; M60-L94 HydrophobicContact SD-CD1 4.05Å; L77-L94 HydrophobicContact CD2-CD2 4.11Å; V85-L94 HydrophobicContact CG1-CB 4.05Å; V85-L94 HydrophobicContact CG1-CD1 4.3Å; V85-L94 HydrophobicContact CG1-CD2 3.9Å; V85-L94 HydrophobicContact CG1-CG 4.31Å; L86-L94 CarbonylContact O-C 3.51Å; L86-L94 VanDerWaalsContact O-CA 3.26Å; L86-L94 WeakPolarHBondContact O-CA 3.32Å; L87-L94 HydrophobicContact CB-CD2 3.74Å; L87-L94 HydrophobicContact CD1-CD2 3.6Å; L87-L94 HydrophobicContact CG-CD2 4.21Å; L94-V118 HydrophobicContact CD1-CG2 4.12Å; L94-V118 HydrophobicContact CD2-CG2 4.36Å; L94-V133 HydrophobicContact CD1-CB 4.3Å; L94-V133 HydrophobicContact CD1-CG1 3.97Å; L94-V133 HydrophobicContact CD1-CG2 3.82Å
95	F	96.6	Very high	94.8	Very high	48 Å²	48	44.7 Å²	44.7	21%	0.211	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152	-179.6	-50.9	-94.9	0	0	0	112	T54 I55 V85 L86 D88 M93	T54-F95 CarbonylContact O-C 3.56Å; T54-F95 WeakPolarHBondContact O-CA 3.29Å; I55-F95 HydrophobicContact CG1-CD1 4.03Å; I55-F95 HydrophobicContact CG1-CE1 4.03Å; V85-F95 CarbonylContact C-O 3.46Å; V85-F95 WeakPolarHBondContact CA-O 3.05Å; L86-F95 HydrophobicContact CB-CB 4.41Å; L86-F95 PolarHBondContact N-O 3.46Å; L86-F95 PolarHBondContact O-N 2.98Å; D88-F95 HydrophobicContact CB-CE2 3.99Å; M93-F95 HydrophobicContact CB-CE2 4.35Å; M93-F95 HydrophobicContact CB-CZ 4.43Å; M93-F95 HydrophobicContact CE-CE1 4Å; M93-F95 HydrophobicContact CE-CE2 4.35Å; M93-F95 HydrophobicContact CE-CZ 3.49Å; M93-F95 VanDerWaalsContact CE-CZ 3.49Å; M93-F95 HydrophobicContact CG-CD2 4.5Å; M93-F95 HydrophobicContact CG-CE1 4.08Å; M93-F95 HydrophobicContact CG-CE2 3.98Å; M93-F95 HydrophobicContact CG-CZ 3.78Å; M93-F95 HydrophobicContact SD-CE1 3.82Å; M93-F95 HydrophobicContact SD-CZ 3.8Å
96	L	96.8	Very high	94.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	128	171.3	-177.2	63.7	0	0	0	111.3	I46 S50 G53 T54 L56 W84 L103 I114	I46-L96 HydrophobicContact CD1-CD2 4.03Å; S50-L96 WeakPolarHBondContact O-CD2 3.4Å; G53-L96 PolarHBondContact N-O 2.95Å; T54-L96 PolarHBondContact O-N 2.9Å; L56-L96 HydrophobicContact CD1-CB 4.39Å; L56-L96 HydrophobicContact CD2-CB 4.09Å; L56-L96 HydrophobicContact CG-CB 4.27Å; W84-L96 HydrophobicContact CE3-CD1 3.92Å; W84-L96 WeakPolarHBondContact O-CA 3.18Å; L96-L103 HydrophobicContact CD1-CD2 3.93Å; L96-L103 HydrophobicContact CD2-CB 4.46Å; L96-L103 HydrophobicContact CD2-CD2 4.07Å; L96-I114 HydrophobicContact CD1-CD1 4.44Å
97	N	95.6	Very high	94.6	Very high	33 Å²	33	43.9 Å²	43.9	18%	0.176	26%	0.255	C	S	.	.			trans	-104	93.9	169.4	171.9	36.4	0	0	0	110.9	N52 Y83 W84 L86 T99 R101	N52-N97 WeakPolarHBondContact OD1-CA 3.5Å; Y83-N97 WeakPolarHBondContact O-CB 3.42Å; Y83-N97 PolarHBondContact O-ND2 3.19Å; W84-N97 PolarHBondContact O-N 2.79Å; L86-N97 HydrophobicContact CD1-CB 3.92Å; L86-N97 HydrophobicContact CD2-CB 4.31Å; L86-N97 HydrophobicContact CG-CB 3.81Å; N97-T99 PolarHBondContact OD1-OG1 2.87Å; N97-R101 PolarHBondContact O-NE 2.81Å; N97-R101 PolarHBondContact O-NH2 3.32Å
98	S	93.7	Very high	94.5	Very high	11 Å²	11	47.5 Å²	47.5	8%	0.077	28%	0.28	C	S	.	.			trans	-116.5	35.9	175.7	-152.9	0	0	0	0	110.7	N52 G100 R101 L103	N52-S98 PolarHBondContact OD1-N 2.95Å; S98-G100 PolarHBondContact O-N 3.47Å; S98-R101 PolarHBondContact OG-O 2.89Å; S98-L103 PolarHBondContact OG-N 2.87Å
99	T	91.7	Very high	94.3	Very high	97 Å²	97	49.5 Å²	49.5	60%	0.595	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	114.8	179.6	-56.4	0	0	0	0	109.8	N52 N97 R101	N52-T99 PolarHBondContact ND2-OG1 2.95Å; N52-T99 VanDerWaalsContact ND2-OG1 3.16Å; N52-T99 PolarHBondContact OD1-N 2.81Å; N52-T99 PolarHBondContact OD1-OG1 2.7Å; N97-T99 PolarHBondContact OD1-OG1 2.87Å; T99-R101 VanDerWaalsContact C-N 3.33Å
100	G	91.6	Very high	94.3	Very high	89 Å²	89	51.2 Å²	51.2	92%	0.918	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	14.8	177.9	0	0	0	0	0	115.2	S98	S98-G100 PolarHBondContact O-N 3.47Å
101	R	93.2	Very high	94.4	Very high	83 Å²	83	47.7 Å²	47.7	31%	0.313	27%	0.273	S	S	.	.	S	Bend	trans	-151	171.1	177.2	62.5	-178.1	178.5	-169.9	-2.8	110	D82 Y83 W84 N97 S98 T99	D82-R101 PolarHBondContact O-NH1 2.89Å; D82-R101 PolarHBondContact O-NH2 2.96Å; Y83-R101 PolarHBondContact O-NH2 2.94Å; W84-R101 VanDerWaalsContact CH2-CD 3.41Å; W84-R101 HydrophobicContact CH2-CG 3.77Å; W84-R101 HydrophobicContact CZ3-CG 3.98Å; W84-R101 VanDerWaalsContact CZ3-NE 3.3Å; N97-R101 PolarHBondContact O-NE 2.81Å; N97-R101 PolarHBondContact O-NH2 3.32Å; S98-R101 PolarHBondContact OG-O 2.89Å; T99-R101 VanDerWaalsContact C-N 3.33Å
102	V	93.4	Very high	94.4	Very high	55 Å²	55	46.7 Å²	46.7	33%	0.333	27%	0.27	S	S	.	.			trans	-114.8	139.4	177.7	-179	0	0	0	0	108.7	E49 W84 D104 M109	E49-V102 HydrophobicContact CB-CG1 4.03Å; E49-V102 HydrophobicContact CG-CG1 3.53Å; E49-V102 WeakPolarHBondContact OE1-CG1 3.48Å; W84-V102 VanDerWaalsContact CH2-O 3.31Å; W84-V102 WeakPolarHBondContact CH2-O 3.09Å; V102-D104 HydrophobicContact CB-CB 4.48Å; V102-D104 HydrophobicContact CG1-CB 4.14Å; V102-D104 PolarHBondContact O-N 2.87Å; V102-D104 VanDerWaalsContact O-N 3.12Å; V102-M109 VanDerWaalsContact O-CE 3.3Å; V102-M109 WeakPolarHBondContact O-CE 3.43Å
103	L	94.7	Very high	94.4	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.289	C	S	.	.			trans	-80	82.6	164.9	178.1	61.5	0	0	0	107.6	I46 E48 E49 W84 L96 S98 I111 I114 V137	I46-L103 HydrophobicContact CD1-CD2 3.48Å; I46-L103 VanDerWaalsContact CD1-CD2 3.48Å; I46-L103 HydrophobicContact CG1-CD2 4.39Å; E48-L103 WeakPolarHBondContact CA-O 3.42Å; E48-L103 WeakPolarHBondContact CB-O 3.34Å; E49-L103 PolarHBondContact N-O 2.95Å; W84-L103 HydrophobicContact CD2-CD1 4.39Å; W84-L103 HydrophobicContact CE3-CD1 4.32Å; W84-L103 HydrophobicContact CH2-CB 4.34Å; W84-L103 HydrophobicContact CH2-CD1 4.38Å; W84-L103 HydrophobicContact CZ2-CD1 4.46Å; W84-L103 HydrophobicContact CZ3-CB 4Å; W84-L103 HydrophobicContact CZ3-CD1 4.31Å; L96-L103 HydrophobicContact CD1-CD2 3.93Å; L96-L103 HydrophobicContact CD2-CB 4.46Å; L96-L103 HydrophobicContact CD2-CD2 4.07Å; S98-L103 PolarHBondContact OG-N 2.87Å; L103-I111 HydrophobicContact CD1-CB 4.08Å; L103-I111 HydrophobicContact CD1-CD1 4.17Å; L103-I111 HydrophobicContact CD1-CG2 3.69Å; L103-I114 HydrophobicContact CD1-CD1 3.69Å; L103-I114 HydrophobicContact CD1-CG1 4.39Å; L103-I114 HydrophobicContact CD2-CD1 4.03Å; L103-V137 HydrophobicContact CD1-CG2 4.23Å; L103-V137 HydrophobicContact CD2-CG1 4.4Å; L103-V137 HydrophobicContact CD2-CG2 3.97Å; L103-V137 HydrophobicContact CG-CG1 4.33Å; L103-V137 HydrophobicContact CG-CG2 4.23Å
104	D	95.3	Very high	94.4	Very high	33 Å²	33	48.7 Å²	48.7	18%	0.176	29%	0.287	C	S	.	.			trans	-92.7	123.8	-176.5	168.2	12.5	0	0	0	109.3	V102 D106 M109 I111	V102-D104 HydrophobicContact CB-CB 4.48Å; V102-D104 HydrophobicContact CG1-CB 4.14Å; V102-D104 PolarHBondContact O-N 2.87Å; V102-D104 VanDerWaalsContact O-N 3.12Å; D104-D106 PolarHBondContact OD1-N 3.37Å; D104-M109 HydrophobicContact CB-CB 3.87Å; D104-M109 HydrophobicContact CB-CE 4.2Å; D104-M109 HydrophobicContact CB-CG 4.13Å; D104-M109 HydrophobicContact CB-SD 3.79Å; D104-M109 WeakPolarHBondContact O-CB 3.33Å; D104-M109 WeakPolarHBondContact OD2-CB 3.22Å; D104-M109 WeakPolarHBondContact OD2-CG 3.37Å; D104-I111 WeakPolarHBondContact O-CB 3.47Å; D104-I111 WeakPolarHBondContact O-CG1 3.32Å; D104-I111 PolarHBondContact O-N 2.82Å
105	R	95.4	Very high	94.3	Very high	25 Å²	25	51.6 Å²	51.6	9%	0.094	30%	0.304	C	S	.	.			trans	-87.5	-22.6	-179.3	-165.3	-174.8	166.2	-80.8	4.4	111.5	E48 N110 H112 V137 D139 D181	E48-R105 HydrophobicContact CB-CB 4.06Å; E48-R105 VanDerWaalsContact CD-CB 3.47Å; E48-R105 HydrophobicContact CG-CB 4.5Å; E48-R105 WeakPolarHBondContact OE1-CB 3.25Å; E48-R105 WeakPolarHBondContact OE2-CA 3.33Å; E48-R105 WeakPolarHBondContact OE2-CB 3.22Å; E48-R105 PolarHBondContact OE2-N 2.89Å; R105-N110 CarbonylContact O-C 3.58Å; R105-N110 WeakPolarHBondContact O-CA 3.47Å; R105-H112 PolarHBondContact O-CD2 2.78Å; R105-V137 HydrophobicContact CB-CG1 3.98Å; R105-V137 WeakPolarHBondContact CD-O 3.23Å; R105-V137 HydrophobicContact CG-CB 4.35Å; R105-V137 HydrophobicContact CG-CG1 4.11Å; R105-V137 PolarHBondContact NE-O 3.29Å; R105-D139 IonicContact CZ-OD1 2.61Å; R105-D139 IonicContact NH1-OD1 2.71Å; R105-D139 PolarHBondContact NH1-OD1 3.46Å; R105-D181 IonicContact CZ-OD2 2.7Å; R105-D181 IonicContact NH1-OD2 3.13Å; R105-D181 IonicContact NH2-OD2 3.72Å; R105-D181 PolarHBondContact NH2-OD2 2.88Å
106	D	94.5	Very high	94.3	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	29%	0.294	C	S	.	.	S	Bend	trans	-90.2	170.3	-167.9	-63.9	-31.4	0	0	0	112.3	D104 P108 M109 N110 N143 I179	D104-D106 PolarHBondContact OD1-N 3.37Å; D106-P108 CarbonylContact O-C 3.54Å; D106-M109 PolarHBondContact O-N 2.55Å; D106-N110 PolarHBondContact O-N 2.97Å; D106-N143 PolarHBondContact OD2-ND2 3.34Å; D106-I179 HydrophobicContact CB-CD1 4.29Å; D106-I179 HydrophobicContact CB-CG1 4.46Å
107	P	93.6	Very high	94.3	Very high	66 Å²	66	50.7 Å²	50.7	43%	0.429	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	124.5	170.7	-23.1	34.6	0	0	0	111.3
108	P	93.2	Very high	94.3	Very high	112 Å²	112	49.1 Å²	49.1	73%	0.727	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	cis	-100.6	-8.4	23	37.2	-36.1	0	0	0	115.9	D106 N110	D106-P108 CarbonylContact O-C 3.54Å; P108-N110 PolarHBondContact O-ND2 2.77Å
109	M	92.9	Very high	94.4	Very high	80 Å²	80	50 Å²	50	39%	0.394	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-33.7	-172.5	-71.2	-165.3	41.9	0	0	114.2	W84 V102 D104 D106 I111	W84-M109 HydrophobicContact CH2-CE 4.43Å; W84-M109 HydrophobicContact CZ2-CE 4.15Å; V102-M109 VanDerWaalsContact O-CE 3.3Å; V102-M109 WeakPolarHBondContact O-CE 3.43Å; D104-M109 HydrophobicContact CB-CB 3.87Å; D104-M109 HydrophobicContact CB-CE 4.2Å; D104-M109 HydrophobicContact CB-CG 4.13Å; D104-M109 HydrophobicContact CB-SD 3.79Å; D104-M109 WeakPolarHBondContact O-CB 3.33Å; D104-M109 WeakPolarHBondContact OD2-CB 3.22Å; D104-M109 WeakPolarHBondContact OD2-CG 3.37Å; D106-M109 PolarHBondContact O-N 2.55Å; M109-I111 VanDerWaalsContact C-N 3.28Å; M109-I111 HydrophobicContact CB-CG1 4.27Å; M109-I111 HydrophobicContact CE-CD1 3.47Å; M109-I111 VanDerWaalsContact CE-CD1 3.47Å; M109-I111 HydrophobicContact CE-CG1 4.3Å; M109-I111 PolarHBondContact O-N 3.5Å
110	N	93.6	Very high	94.6	Very high	84 Å²	84	45.4 Å²	45.4	45%	0.449	27%	0.267	S	S	.	.			trans	55.5	31.4	171.8	-61.8	-93.6	0	0	0	114.7	R105 D106 P108 H112	R105-N110 CarbonylContact O-C 3.58Å; R105-N110 WeakPolarHBondContact O-CA 3.47Å; D106-N110 PolarHBondContact O-N 2.97Å; P108-N110 PolarHBondContact O-ND2 2.77Å; N110-H112 VanDerWaalsContact C-N 3.32Å; N110-H112 PolarHBondContact O-CD2 3Å; N110-H112 PolarHBondContact O-N 2.99Å
111	I	94.3	Very high	94.7	Very high	27 Å²	27	42.8 Å²	42.8	14%	0.138	23%	0.234	C	C	.	.			trans	-83.5	73.2	-174.8	-49.5	-176.4	0	0	0	111.2	W84 L103 D104 M109 S113 I114 V137	W84-I111 HydrophobicContact CZ2-CD1 3.61Å; L103-I111 HydrophobicContact CD1-CB 4.08Å; L103-I111 HydrophobicContact CD1-CD1 4.17Å; L103-I111 HydrophobicContact CD1-CG2 3.69Å; D104-I111 WeakPolarHBondContact O-CB 3.47Å; D104-I111 WeakPolarHBondContact O-CG1 3.32Å; D104-I111 PolarHBondContact O-N 2.82Å; M109-I111 VanDerWaalsContact C-N 3.28Å; M109-I111 HydrophobicContact CB-CG1 4.27Å; M109-I111 HydrophobicContact CE-CD1 3.47Å; M109-I111 VanDerWaalsContact CE-CD1 3.47Å; M109-I111 HydrophobicContact CE-CG1 4.3Å; M109-I111 PolarHBondContact O-N 3.5Å; I111-S113 VanDerWaalsContact C-N 3.28Å; I111-S113 PolarHBondContact O-N 2.84Å; I111-I114 HydrophobicContact CG2-CG1 4.03Å; I111-V137 VanDerWaalsContact O-CB 3.26Å; I111-V137 WeakPolarHBondContact O-CB 3.12Å; I111-V137 WeakPolarHBondContact O-CG2 2.98Å
112	H	94.6	Very high	94.7	Very high	99 Å²	99	38.9 Å²	38.9	46%	0.458	22%	0.219	S	C	.	.			trans	-68	-26.2	-179	-56.7	-179.1	0	0	0	113.5	R105 N110 V137	R105-H112 PolarHBondContact O-CD2 2.78Å; N110-H112 VanDerWaalsContact C-N 3.32Å; N110-H112 PolarHBondContact O-CD2 3Å; N110-H112 PolarHBondContact O-N 2.99Å; H112-V137 PolarHBondContact O-N 3.44Å
113	S	95.3	Very high	94.5	Very high	66 Å²	66	41.1 Å²	41.1	46%	0.462	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	147.7	175.8	68.1	0	0	0	0	112.7	I111 I135	I111-S113 VanDerWaalsContact C-N 3.28Å; I111-S113 PolarHBondContact O-N 2.84Å; S113-I135 CarbonylContact C-O 3.57Å; S113-I135 WeakPolarHBondContact CA-O 3.41Å; S113-I135 WeakPolarHBondContact CB-O 3.46Å
114	I	94.8	Very high	94.1	Very high	11 Å²	11	45.7 Å²	45.7	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.2	168.5	-60.5	154.5	0	0	0	107.8	W84 V85 L96 L103 I111 V116 I135	W84-I114 HydrophobicContact CB-CD1 3.75Å; W84-I114 HydrophobicContact CB-CG1 4.28Å; W84-I114 HydrophobicContact CB-CG2 4.15Å; W84-I114 HydrophobicContact CD2-CD1 4.35Å; W84-I114 HydrophobicContact CG-CD1 3.9Å; W84-I114 HydrophobicContact CG-CG1 4.27Å; V85-I114 HydrophobicContact CG2-CG2 4.04Å; L96-I114 HydrophobicContact CD1-CD1 4.44Å; L103-I114 HydrophobicContact CD1-CD1 3.69Å; L103-I114 HydrophobicContact CD1-CG1 4.39Å; L103-I114 HydrophobicContact CD2-CD1 4.03Å; I111-I114 HydrophobicContact CG2-CG1 4.03Å; I114-V116 HydrophobicContact CG2-CG1 4.03Å; I114-I135 HydrophobicContact CB-CB 4.24Å; I114-I135 HydrophobicContact CB-CD1 4.22Å; I114-I135 HydrophobicContact CG2-CD1 4.18Å; I114-I135 PolarHBondContact N-O 2.77Å; I114-I135 WeakPolarHBondContact O-CD1 3.24Å; I114-I135 PolarHBondContact O-N 3.37Å
115	V	96.2	Very high	93.8	Very high	61 Å²	61	47.9 Å²	47.9	37%	0.37	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.8	175.3	-176	0	0	0	0	109	E132 V133 R134	V115-E132 HydrophobicContact CG1-CG 4.08Å; V115-V133 WeakPolarHBondContact CA-O 3.25Å; V115-R134 HydrophobicContact CG1-CG 4.38Å; V115-R134 HydrophobicContact CG2-CG 4.24Å
116	V	96	Very high	93.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	156.7	176.6	-57.1	0	0	0	0	110.7	L77 N80 V85 I114 V133 I135	L77-V116 HydrophobicContact CD2-CB 4.41Å; L77-V116 HydrophobicContact CD2-CG2 4.01Å; N80-V116 HydrophobicContact CB-CG1 4.19Å; V85-V116 HydrophobicContact CB-CG1 4.23Å; V85-V116 HydrophobicContact CB-CG2 4.37Å; V85-V116 HydrophobicContact CG1-CG2 4.34Å; V85-V116 HydrophobicContact CG2-CG1 3.71Å; V85-V116 HydrophobicContact CG2-CG2 4.04Å; I114-V116 HydrophobicContact CG2-CG1 4.03Å; V116-V133 HydrophobicContact CG2-CB 3.92Å; V116-V133 HydrophobicContact CG2-CG2 4.49Å; V116-V133 PolarHBondContact N-O 2.96Å; V116-V133 PolarHBondContact O-N 3.2Å; V116-I135 HydrophobicContact CG2-CD1 4.48Å
117	Q	95.8	Very high	93.2	Very high	30 Å²	30	52 Å²	52	14%	0.14	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	117.8	177.5	-61.3	-67.8	-18.4	0	0	109.4	K78 D79 Q119 Y130 E132	K78-Q117 HydrophobicContact CB-CB 4.09Å; K78-Q117 PolarHBondContact N-O 2.96Å; K78-Q117 PolarHBondContact O-N 3.46Å; D79-Q117 WeakPolarHBondContact OD2-CG 3.38Å; Q117-Q119 PolarHBondContact O-N 2.75Å; Q117-Y130 HydrophobicContact CB-CD1 4.26Å; Q117-E132 PolarHBondContact NE2-OE2 3.29Å
118	V	95.8	Very high	93.2	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	99.6	169.1	179.1	0	0	0	0	107.7	M60 I62 L75 S76 L77 L94 C120 H131 V133	M60-V118 HydrophobicContact CE-CB 4.04Å; M60-V118 HydrophobicContact CE-CG2 3.89Å; M60-V118 HydrophobicContact SD-CG2 4.32Å; I62-V118 HydrophobicContact CD1-CG1 3.9Å; L75-V118 HydrophobicContact CD2-CG1 4.2Å; S76-V118 CarbonylContact O-C 3.56Å; L77-V118 HydrophobicContact CD2-CG2 3.89Å; L94-V118 HydrophobicContact CD1-CG2 4.12Å; L94-V118 HydrophobicContact CD2-CG2 4.36Å; V118-C120 PolarHBondContact O-N 2.92Å; V118-H131 HydrophobicContact CB-CB 4.31Å; V118-H131 PolarHBondContact N-O 2.9Å; V118-H131 PolarHBondContact O-N 2.77Å; V118-V133 HydrophobicContact CG2-CG2 3.91Å
119	Q	96.4	Very high	93.2	Very high	29 Å²	29	49.1 Å²	49.1	14%	0.136	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	119.2	174.1	-178.9	-173.3	-37.1	0	0	109.3	L75 S76 K78 Q117 V121 V128 Y130	L75-Q119 WeakPolarHBondContact CA-O 3.28Å; S76-Q119 PolarHBondContact N-O 3.07Å; S76-Q119 PolarHBondContact O-N 2.9Å; K78-Q119 HydrophobicContact CG-CB 4.02Å; Q117-Q119 PolarHBondContact O-N 2.75Å; Q119-V121 HydrophobicContact CG-CG2 4.33Å; Q119-V121 VanDerWaalsContact NE2-CG2 3.31Å; Q119-V128 HydrophobicContact CG-CG1 3.58Å; Q119-Y130 HydrophobicContact CB-CD1 3.81Å; Q119-Y130 HydrophobicContact CB-CE1 3.69Å; Q119-Y130 HydrophobicContact CG-CD1 4.04Å; Q119-Y130 HydrophobicContact CG-CE1 3.57Å
120	C	95.5	Very high	93.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.8	169.5	-169.7	0	0	0	0	110.6	C32 I62 E74 L75 V118 V128 I129	C32-C120 WeakPolarHBondContact CA-SG 3.38Å; C32-C120 HydrophobicContact CB-CB 3.68Å; C32-C120 WeakPolarHBondContact CB-SG 3.37Å; C32-C120 WeakPolarHBondContact SG-CB 3.48Å; C32-C120 CovalentContact SG-SG 2.03Å; C32-C120 PolarHBondContact SG-SG 3.09Å; I62-C120 HydrophobicContact CG2-CB 4.37Å; E74-C120 CarbonylContact O-C 3.59Å; E74-C120 VanDerWaalsContact O-CA 3.32Å; E74-C120 WeakPolarHBondContact O-CA 3.44Å; L75-C120 HydrophobicContact CD2-CB 3.59Å; L75-C120 VanDerWaalsContact CD2-SG 3.53Å; V118-C120 PolarHBondContact O-N 2.92Å; C120-V128 WeakPolarHBondContact O-CA 3.46Å; C120-I129 PolarHBondContact N-O 2.88Å; C120-I129 PolarHBondContact O-N 3.25Å
121	V	94.7	Very high	93.4	Very high	35 Å²	35	47.9 Å²	47.9	21%	0.212	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.6	172.2	-173.2	0	0	0	0	109.1	I73 E74 Q119 K123 T127 V128	I73-V121 CarbonylContact C-O 3.53Å; I73-V121 VanDerWaalsContact CA-O 3.27Å; I73-V121 WeakPolarHBondContact CA-O 3.4Å; E74-V121 HydrophobicContact CB-CB 4.19Å; E74-V121 PolarHBondContact N-O 3.47Å; E74-V121 PolarHBondContact O-N 3.17Å; Q119-V121 HydrophobicContact CG-CG2 4.33Å; Q119-V121 VanDerWaalsContact NE2-CG2 3.31Å; V121-K123 PolarHBondContact O-N 3.19Å; V121-T127 WeakPolarHBondContact CA-O 3.33Å; V121-V128 HydrophobicContact CG1-CG2 4.41Å; V121-V128 HydrophobicContact CG2-CG1 4.46Å; V121-V128 HydrophobicContact CG2-CG2 4.22Å
122	N	92.9	Very high	93.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	110.9	174.8	178.2	-29.8	0	0	0	108.9	Y28 D31 C32 K124 V125 G126 T127	Y28-N122 PolarHBondContact O-ND2 2.96Å; D31-N122 VanDerWaalsContact CB-ND2 3.26Å; D31-N122 WeakPolarHBondContact CB-ND2 3.44Å; D31-N122 PolarHBondContact O-ND2 2.66Å; D31-N122 VanDerWaalsContact O-ND2 3.12Å; C32-N122 HydrophobicContact CB-CB 4.42Å; C32-N122 PolarHBondContact SG-N 3.06Å; C32-N122 VanDerWaalsContact SG-N 3.39Å; N122-K124 PolarHBondContact O-N 3.46Å; N122-K124 VanDerWaalsContact O-N 3.16Å; N122-K124 WeakPolarHBondContact OD1-CB 3.09Å; N122-K124 PolarHBondContact OD1-N 2.64Å; N122-V125 HydrophobicContact CB-CG2 4.04Å; N122-V125 VanDerWaalsContact CG-CG2 3.45Å; N122-V125 WeakPolarHBondContact ND2-CG2 3.45Å; N122-V125 PolarHBondContact OD1-N 3.49Å; N122-G126 WeakPolarHBondContact O-CA 3.47Å; N122-G126 PolarHBondContact O-N 3.23Å; N122-T127 WeakPolarHBondContact CB-OG1 3.18Å; N122-T127 PolarHBondContact N-O 2.75Å
123	K	90.1	Very high	93.5	Very high	103 Å²	103	44.2 Å²	44.2	45%	0.448	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.7	-172.8	-65.5	-160.3	175.7	-162.7	0	114.2	P71 T72 E74 V121	P71-K123 HydrophobicContact CG-CD 4.46Å; T72-K123 PolarHBondContact O-N 3.2Å; E74-K123 WeakPolarHBondContact OE2-CE 3.44Å; E74-K123 IonicContact OE2-NZ 2.68Å; E74-K123 PolarHBondContact OE2-NZ 3.46Å; V121-K123 PolarHBondContact O-N 3.19Å
124	K	86.1	Confident	93.6	Very high	95 Å²	95	46.8 Å²	46.8	41%	0.413	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-36.7	-176.1	-59.1	172.3	-174.3	155.9	0	112.7	Y28 D31 N122	Y28-K124 HydrophobicContact CD1-CD 3.44Å; Y28-K124 VanDerWaalsContact CD1-CD 3.44Å; Y28-K124 HydrophobicContact CE1-CD 3.97Å; Y28-K124 HydrophobicContact CG-CD 4.32Å; D31-K124 IonicContact OD2-NZ 3.41Å; D31-K124 PolarHBondContact OD2-NZ 2.86Å; N122-K124 PolarHBondContact O-N 3.46Å; N122-K124 VanDerWaalsContact O-N 3.16Å; N122-K124 WeakPolarHBondContact OD1-CB 3.09Å; N122-K124 PolarHBondContact OD1-N 2.64Å
125	V	88.3	Confident	93.6	Very high	80 Å²	80	46.2 Å²	46.2	49%	0.485	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-6.3	-177.7	-64.1	0	0	0	0	114.1	N122 T127	N122-V125 HydrophobicContact CB-CG2 4.04Å; N122-V125 VanDerWaalsContact CG-CG2 3.45Å; N122-V125 WeakPolarHBondContact ND2-CG2 3.45Å; N122-V125 PolarHBondContact OD1-N 3.49Å; V125-T127 HydrophobicContact CG2-CG2 3.85Å; V125-T127 WeakPolarHBondContact CG2-OG1 3.12Å; V125-T127 PolarHBondContact O-N 2.83Å
126	G	86.6	Confident	93.6	Very high	54 Å²	54	46.4 Å²	46.4	56%	0.557	24%	0.24	S	C	*	.			trans	73.2	10.2	178.4	0	0	0	0	0	114.9	N122	N122-G126 WeakPolarHBondContact O-CA 3.47Å; N122-G126 PolarHBondContact O-N 3.23Å
127	T	91.5	Very high	93.6	Very high	59 Å²	59	46.6 Å²	46.6	36%	0.362	24%	0.241	S	C	.	.			trans	-71.4	144.4	176.2	54.4	0	0	0	0	110.9	V121 N122 V125	V121-T127 WeakPolarHBondContact CA-O 3.33Å; N122-T127 WeakPolarHBondContact CB-OG1 3.18Å; N122-T127 PolarHBondContact N-O 2.75Å; V125-T127 HydrophobicContact CG2-CG2 3.85Å; V125-T127 WeakPolarHBondContact CG2-OG1 3.12Å; V125-T127 PolarHBondContact O-N 2.83Å
128	V	93.4	Very high	93.6	Very high	65 Å²	65	50.3 Å²	50.3	39%	0.394	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.8	177.6	-173.6	0	0	0	0	108.4	Q119 C120 V121 Y130	Q119-V128 HydrophobicContact CG-CG1 3.58Å; C120-V128 WeakPolarHBondContact O-CA 3.46Å; V121-V128 HydrophobicContact CG1-CG2 4.41Å; V121-V128 HydrophobicContact CG2-CG1 4.46Å; V121-V128 HydrophobicContact CG2-CG2 4.22Å; V128-Y130 HydrophobicContact CG1-CE1 4.33Å; V128-Y130 HydrophobicContact CG1-CE2 3.98Å
129	I	93.6	Very high	93.6	Very high	53 Å²	53	52.1 Å²	52.1	27%	0.272	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	177.4	-59.7	-179.9	0	0	0	107.9	C32 K33 C120	C32-I129 HydrophobicContact CB-CB 4.33Å; C32-I129 HydrophobicContact CB-CD1 3.94Å; C32-I129 HydrophobicContact CB-CG1 4.3Å; K33-I129 HydrophobicContact CG-CD1 4.31Å; C120-I129 PolarHBondContact N-O 2.88Å; C120-I129 PolarHBondContact O-N 3.25Å
130	Y	95	Very high	93.4	Very high	129 Å²	129	55.6 Å²	55.6	51%	0.506	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	123.3	174.4	-60.8	-81.1	0	0	0	109.3	K78 Q117 Q119 V128	K78-Y130 HydrophobicContact CG-CE1 4.23Å; Q117-Y130 HydrophobicContact CB-CD1 4.26Å; Q119-Y130 HydrophobicContact CB-CD1 3.81Å; Q119-Y130 HydrophobicContact CB-CE1 3.69Å; Q119-Y130 HydrophobicContact CG-CD1 4.04Å; Q119-Y130 HydrophobicContact CG-CE1 3.57Å; V128-Y130 HydrophobicContact CG1-CE1 4.33Å; V128-Y130 HydrophobicContact CG1-CE2 3.98Å
131	H	95.1	Very high	93.4	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.046	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	105.9	173.8	-61.1	-74.4	0	0	0	108.8	C32 M60 V118	C32-H131 PolarHBondContact O-CE1 2.69Å; C32-H131 VanDerWaalsContact O-CE1 3.23Å; C32-H131 PolarHBondContact O-NE2 3.45Å; M60-H131 HydrophobicContact CE-CB 3.62Å; V118-H131 HydrophobicContact CB-CB 4.31Å; V118-H131 PolarHBondContact N-O 2.9Å; V118-H131 PolarHBondContact O-N 2.77Å
132	E	96	Very high	93.4	Very high	48 Å²	48	56.4 Å²	56.4	22%	0.224	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	133.1	-179.9	-174.8	170.6	98.9	0	0	111	A41 T42 V115 Q117 R134	A41-E132 CarbonylContact C-O 3.4Å; A41-E132 WeakPolarHBondContact CA-O 3.34Å; A41-E132 HydrophobicContact CB-CB 4.3Å; A41-E132 HydrophobicContact CB-CG 4.48Å; T42-E132 PolarHBondContact N-O 2.84Å; V115-E132 HydrophobicContact CG1-CG 4.08Å; Q117-E132 PolarHBondContact NE2-OE2 3.29Å; E132-R134 HydrophobicContact CG-CG 4.25Å; E132-R134 IonicContact OE1-CZ 2.92Å; E132-R134 IonicContact OE1-NE 2.64Å; E132-R134 PolarHBondContact OE1-NE 3.36Å; E132-R134 IonicContact OE1-NH2 2.88Å; E132-R134 PolarHBondContact OE1-NH2 3.27Å
133	V	95.6	Very high	93.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120	174.1	-172.7	0	0	0	0	108.2	T42 V57 M60 L94 V115 V116 V118 I135	T42-V133 CarbonylContact O-C 3.48Å; T42-V133 VanDerWaalsContact O-CA 3.31Å; T42-V133 WeakPolarHBondContact O-CA 3.49Å; V57-V133 HydrophobicContact CG2-CG1 3.9Å; M60-V133 HydrophobicContact CE-CG2 3.63Å; M60-V133 HydrophobicContact SD-CG2 3.64Å; L94-V133 HydrophobicContact CD1-CB 4.3Å; L94-V133 HydrophobicContact CD1-CG1 3.97Å; L94-V133 HydrophobicContact CD1-CG2 3.82Å; V115-V133 WeakPolarHBondContact CA-O 3.25Å; V116-V133 HydrophobicContact CG2-CB 3.92Å; V116-V133 HydrophobicContact CG2-CG2 4.49Å; V116-V133 PolarHBondContact N-O 2.96Å; V116-V133 PolarHBondContact O-N 3.2Å; V118-V133 HydrophobicContact CG2-CG2 3.91Å; V133-I135 HydrophobicContact CG1-CD1 3.83Å; V133-I135 HydrophobicContact CG1-CG1 4.31Å
134	R	96.2	Very high	93.8	Very high	120 Å²	120	55.8 Å²	55.8	45%	0.453	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114.1	174.7	-56.7	-173.2	-173.6	-162	-3.6	108.5	T42 I43 V44 V115 E132	T42-R134 PolarHBondContact O-N 3.04Å; I43-R134 WeakPolarHBondContact CA-O 3.32Å; I43-R134 HydrophobicContact CG1-CB 4.34Å; V44-R134 PolarHBondContact N-O 2.86Å; V115-R134 HydrophobicContact CG1-CG 4.38Å; V115-R134 HydrophobicContact CG2-CG 4.24Å; E132-R134 HydrophobicContact CG-CG 4.25Å; E132-R134 IonicContact OE1-CZ 2.92Å; E132-R134 IonicContact OE1-NE 2.64Å; E132-R134 PolarHBondContact OE1-NE 3.36Å; E132-R134 IonicContact OE1-NH2 2.88Å; E132-R134 PolarHBondContact OE1-NH2 3.27Å
135	I	95.8	Very high	94.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	108.3	172.4	-54.8	92	0	0	0	106.7	V44 I46 L56 V85 S113 I114 V116 V133	V44-I135 HydrophobicContact CG2-CB 4.28Å; V44-I135 HydrophobicContact CG2-CG1 3.79Å; V44-I135 HydrophobicContact CG2-CG2 4.39Å; V44-I135 WeakPolarHBondContact O-CA 3.42Å; I46-I135 HydrophobicContact CD1-CG2 4.01Å; I46-I135 HydrophobicContact CG1-CG2 3.72Å; L56-I135 HydrophobicContact CB-CG1 4.48Å; L56-I135 HydrophobicContact CD1-CG1 4.25Å; L56-I135 HydrophobicContact CD2-CG1 4.36Å; L56-I135 HydrophobicContact CD2-CG2 4Å; V85-I135 HydrophobicContact CG2-CD1 4.15Å; S113-I135 CarbonylContact C-O 3.57Å; S113-I135 WeakPolarHBondContact CA-O 3.41Å; S113-I135 WeakPolarHBondContact CB-O 3.46Å; I114-I135 HydrophobicContact CB-CB 4.24Å; I114-I135 HydrophobicContact CB-CD1 4.22Å; I114-I135 HydrophobicContact CG2-CD1 4.18Å; I114-I135 PolarHBondContact N-O 2.77Å; I114-I135 WeakPolarHBondContact O-CD1 3.24Å; I114-I135 PolarHBondContact O-N 3.37Å; V116-I135 HydrophobicContact CG2-CD1 4.48Å; V133-I135 HydrophobicContact CG1-CD1 3.83Å; V133-I135 HydrophobicContact CG1-CG1 4.31Å
136	V	96.4	Very high	94.7	Very high	65 Å²	65	51.2 Å²	51.2	39%	0.394	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	127.5	172	-178.2	0	0	0	0	108.2	I43 V44 A45 I46	I43-V136 HydrophobicContact CG2-CG2 4.41Å; V44-V136 PolarHBondContact O-N 2.98Å; A45-V136 VanDerWaalsContact CA-O 3.24Å; A45-V136 WeakPolarHBondContact CA-O 3.33Å; A45-V136 HydrophobicContact CB-CB 4.14Å; I46-V136 PolarHBondContact N-O 2.69Å; I46-V136 VanDerWaalsContact N-O 3.12Å
137	V	95.7	Very high	95.2	Very high	3 Å²	3	50 Å²	50	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120.8	174.7	-172.6	0	0	0	0	107.6	E48 L103 R105 I111 H112	E48-V137 HydrophobicContact CB-CG1 3.61Å; L103-V137 HydrophobicContact CD1-CG2 4.23Å; L103-V137 HydrophobicContact CD2-CG1 4.4Å; L103-V137 HydrophobicContact CD2-CG2 3.97Å; L103-V137 HydrophobicContact CG-CG1 4.33Å; L103-V137 HydrophobicContact CG-CG2 4.23Å; R105-V137 HydrophobicContact CB-CG1 3.98Å; R105-V137 WeakPolarHBondContact CD-O 3.23Å; R105-V137 HydrophobicContact CG-CB 4.35Å; R105-V137 HydrophobicContact CG-CG1 4.11Å; R105-V137 PolarHBondContact NE-O 3.29Å; I111-V137 VanDerWaalsContact O-CB 3.26Å; I111-V137 WeakPolarHBondContact O-CB 3.12Å; I111-V137 WeakPolarHBondContact O-CG2 2.98Å; H112-V137 PolarHBondContact O-N 3.44Å
138	R	95	Very high	95.4	Very high	109 Å²	109	53 Å²	53	41%	0.411	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.7	175.6	-67.5	-172.3	-65.2	-92.1	-3.2	109.5	A45 I46 D47 E48	A45-R138 HydrophobicContact CB-CG 4.34Å; A45-R138 VanDerWaalsContact CB-NH1 3.29Å; A45-R138 PolarHBondContact O-NH1 3.06Å; I46-R138 WeakPolarHBondContact O-CB 3.37Å; I46-R138 PolarHBondContact O-N 3.46Å; D47-R138 IonicContact OD1-CZ 2.63Å; D47-R138 IonicContact OD1-NE 3.18Å; D47-R138 PolarHBondContact OD1-NE 2.85Å; D47-R138 IonicContact OD1-NH2 3.98Å; D47-R138 PolarHBondContact OD1-NH2 3.19Å; E48-R138 PolarHBondContact N-O 3.37Å
139	D	95.2	Very high	95.5	Very high	37 Å²	37	53.7 Å²	53.7	20%	0.198	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-50.3	135.6	167.7	-159.3	87	0	0	0	112	E48 R105 D181 N184	E48-D139 WeakPolarHBondContact OE1-CA 3.36Å; R105-D139 IonicContact CZ-OD1 2.61Å; R105-D139 IonicContact NH1-OD1 2.71Å; R105-D139 PolarHBondContact NH1-OD1 3.46Å; D139-D181 WeakPolarHBondContact OD1-CA 3.33Å; D139-D181 WeakPolarHBondContact OD1-CB 3.22Å; D139-D181 PolarHBondContact OD1-N 2.87Å; D139-D181 PolarHBondContact OD2-N 2.96Å; D139-N184 WeakPolarHBondContact OD2-CB 3.39Å; D139-N184 PolarHBondContact OD2-ND2 2.77Å
140	R	94	Very high	95.5	Very high	102 Å²	102	60.4 Å²	60.4	39%	0.385	28%	0.28	S	S	.	.			trans	-119.5	156.2	167.8	-72.1	-169.2	76.9	87	17.7	109.3	D47 E48 D142	D47-R140 HydrophobicContact CB-CG 4.03Å; D47-R140 IonicContact OD2-NH1 3.77Å; D47-R140 PolarHBondContact OD2-NH1 2.96Å; E48-R140 HydrophobicContact CG-CB 3.97Å; E48-R140 HydrophobicContact CG-CG 3.97Å; E48-R140 PolarHBondContact OE1-N 3.49Å; R140-D142 VanDerWaalsContact C-N 3.28Å; R140-D142 WeakPolarHBondContact CB-OD1 3.16Å; R140-D142 PolarHBondContact O-N 3.18Å; R140-D142 VanDerWaalsContact O-N 3.12Å
141	N	95.3	Very high	95.5	Very high	14 Å²	14	58 Å²	58	8%	0.075	28%	0.282	C	S	.	.	S	Bend	trans	-87.1	69.3	175.9	-157.4	78.9	0	0	0	109.7	D180 N184 D236 A238 E243 R245	N141-D180 VanDerWaalsContact CA-OD2 3.24Å; N141-D180 WeakPolarHBondContact CA-OD2 3.46Å; N141-N184 HydrophobicContact CB-CB 4.32Å; N141-N184 PolarHBondContact N-ND2 2.77Å; N141-N184 WeakPolarHBondContact OD1-CA 3.46Å; N141-N184 WeakPolarHBondContact OD1-CB 3.36Å; N141-N184 VanDerWaalsContact OD1-CG 3.28Å; N141-N184 PolarHBondContact OD1-OD1 3.46Å; N141-D236 VanDerWaalsContact ND2-CG 3.33Å; N141-D236 PolarHBondContact ND2-OD2 3.29Å; N141-D236 PolarHBondContact OD1-OD2 3.47Å; N141-A238 HydrophobicContact CB-CB 4.08Å; N141-E243 PolarHBondContact ND2-O 3.31Å; N141-R245 PolarHBondContact O-NE 2.71Å
142	D	94	Very high	95.7	Very high	39 Å²	39	58.2 Å²	58.2	21%	0.209	28%	0.283	C	S	.	.			trans	-107.1	-11.5	-178.8	60	-90.3	0	0	0	117.7	R140 D180 R245	R140-D142 VanDerWaalsContact C-N 3.28Å; R140-D142 WeakPolarHBondContact CB-OD1 3.16Å; R140-D142 PolarHBondContact O-N 3.18Å; R140-D142 VanDerWaalsContact O-N 3.12Å; D142-D180 PolarHBondContact N-OD2 3Å; D142-R245 VanDerWaalsContact C-CZ 3.47Å; D142-R245 VanDerWaalsContact CA-NH2 3.3Å; D142-R245 PolarHBondContact O-NH1 2.63Å; D142-R245 PolarHBondContact O-NH2 3.17Å
143	N	95.3	Very high	95.8	Very high	50 Å²	50	62.1 Å²	62.1	27%	0.267	30%	0.296	S	S	.	.	S	Bend	trans	-93.6	175.4	163.2	-57.9	-80.7	0	0	0	111.2	D106 I179 D180 R245	D106-N143 PolarHBondContact OD2-ND2 3.34Å; N143-I179 HydrophobicContact CB-CD1 4.21Å; N143-I179 HydrophobicContact CB-CG1 3.58Å; N143-I179 WeakPolarHBondContact ND2-CG1 3.47Å; N143-D180 WeakPolarHBondContact CB-OD1 3.18Å; N143-D180 PolarHBondContact N-OD1 3.02Å; N143-D180 PolarHBondContact N-OD2 3.48Å; N143-D180 PolarHBondContact ND2-OD1 3.06Å; N143-R245 WeakPolarHBondContact O-CD 2.84Å
144	S	95.8	Very high	95.8	Very high	40 Å²	40	62.6 Å²	62.6	28%	0.28	30%	0.3	S	S	.	.			trans	-138.2	151	-176.4	-56.2	0	0	0	0	109.3	T146 D178 R245	S144-T146 PolarHBondContact O-N 2.84Å; S144-D178 WeakPolarHBondContact CA-OD2 3.27Å; S144-R245 WeakPolarHBondContact OG-CD 3.25Å; S144-R245 PolarHBondContact OG-NH1 2.86Å; S144-R245 VanDerWaalsContact OG-NH1 3.09Å
145	P	96.7	Very high	95.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.299	C	S	.	.			trans	-57.9	128.6	-176	-29.7	37.1	0	0	0	111.1	A176 D178 I187 A234 D236 T247	P145-A176 HydrophobicContact CB-CB 4.24Å; P145-D178 WeakPolarHBondContact CA-OD2 2.95Å; P145-D178 WeakPolarHBondContact CD-OD2 3.12Å; P145-D178 WeakPolarHBondContact CG-OD2 3.06Å; P145-I187 HydrophobicContact CB-CD1 3.61Å; P145-I187 HydrophobicContact CG-CD1 3.61Å; P145-A234 HydrophobicContact CB-CB 3.83Å; P145-D236 HydrophobicContact CG-CB 4.38Å; P145-T247 WeakPolarHBondContact O-CB 3.15Å; P145-T247 WeakPolarHBondContact O-CG2 3.22Å; P145-T247 PolarHBondContact O-OG1 3.45Å
146	T	96.6	Very high	95.9	Very high	78 Å²	78	60.5 Å²	60.5	48%	0.479	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117	179.8	51.4	0	0	0	0	110.4	S144 A176 T177	S144-T146 PolarHBondContact O-N 2.84Å; T146-A176 CarbonylContact O-C 3.59Å; T146-A176 VanDerWaalsContact O-CA 3.23Å; T146-A176 WeakPolarHBondContact O-CA 3.19Å; T146-T177 PolarHBondContact N-O 2.81Å; T146-T177 PolarHBondContact O-N 2.8Å; T146-T177 PolarHBondContact OG1-O 3.16Å
147	F	97.1	Very high	95.9	Very high	30 Å²	30	59.9 Å²	59.9	13%	0.132	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	134.9	170.2	-77.7	-79.2	0	0	0	110.3	H149 Y152 F170 G175 A176 Y189 A234 T247 T249	F147-H149 VanDerWaalsContact C-N 3.29Å; F147-H149 PolarHBondContact O-N 3Å; F147-Y152 HydrophobicContact CB-CE2 4.4Å; F147-Y152 AromaticContact CD1-CE2 3.75Å; F147-Y152 HydrophobicContact CD1-CE2 3.75Å; F147-Y152 HydrophobicContact CE1-CE2 4.4Å; F147-Y152 HydrophobicContact CG-CE2 4.33Å; F147-F170 HydrophobicContact CD1-CE1 4.29Å; F147-F170 HydrophobicContact CE1-CD1 4.31Å; F147-F170 AromaticContact CE1-CE1 3.81Å; F147-F170 HydrophobicContact CE1-CE1 3.81Å; F147-F170 HydrophobicContact CE1-CZ 4.1Å; F147-G175 WeakPolarHBondContact CA-O 3.39Å; F147-A176 HydrophobicContact CD1-CB 3.86Å; F147-A176 HydrophobicContact CD2-CB 4.35Å; F147-A176 HydrophobicContact CE1-CB 3.91Å; F147-A176 HydrophobicContact CE2-CB 4.38Å; F147-A176 HydrophobicContact CG-CB 4.09Å; F147-A176 HydrophobicContact CZ-CB 4.17Å; F147-Y189 HydrophobicContact CE1-CD1 4.31Å; F147-Y189 AromaticContact CE1-CE1 3.76Å; F147-Y189 HydrophobicContact CE1-CE1 3.76Å; F147-Y189 HydrophobicContact CZ-CD1 4.29Å; F147-Y189 HydrophobicContact CZ-CE1 4.08Å; F147-A234 HydrophobicContact CE1-CB 4.49Å; F147-A234 HydrophobicContact CE2-CB 3.77Å; F147-A234 HydrophobicContact CZ-CB 3.67Å; F147-T247 HydrophobicContact CD2-CG2 4.04Å; F147-T249 HydrophobicContact CD1-CG2 3.81Å; F147-T249 HydrophobicContact CD2-CG2 4.04Å; F147-T249 HydrophobicContact CE1-CG2 3.49Å; F147-T249 VanDerWaalsContact CE1-CG2 3.49Å; F147-T249 HydrophobicContact CE2-CG2 3.74Å; F147-T249 HydrophobicContact CG-CG2 4.07Å; F147-T249 HydrophobicContact CZ-CG2 3.46Å; F147-T249 VanDerWaalsContact CZ-CG2 3.46Å
148	K	95.6	Very high	96	Very high	122 Å²	122	59.8 Å²	59.8	53%	0.53	30%	0.295	S	S	.	.	S	Bend	trans	-65.9	-28.9	177.9	-173	-179.6	-170.3	173.8	0	114.4	D173 N174 G175	K148-D173 VanDerWaalsContact CD-O 3.28Å; K148-D173 WeakPolarHBondContact CD-O 3.45Å; K148-D173 PolarHBondContact NZ-O 2.71Å; K148-N174 HydrophobicContact CD-CB 4.46Å; K148-N174 WeakPolarHBondContact CD-OD1 3.07Å; K148-N174 PolarHBondContact NZ-OD1 2.93Å; K148-N174 VanDerWaalsContact NZ-OD1 3.13Å; K148-G175 PolarHBondContact N-O 2.99Å
149	H	95.9	Very high	96.1	Very high	79 Å²	79	58.4 Å²	58.4	37%	0.366	30%	0.295	S	S	.	.	S	Bend	trans	-123.5	142.5	179	-52.8	-81.2	0	0	0	109.5	F147 S151 Y152 N174	F147-H149 VanDerWaalsContact C-N 3.29Å; F147-H149 PolarHBondContact O-N 3Å; H149-S151 PolarHBondContact O-N 2.84Å; H149-Y152 HydrophobicContact CB-CE1 4.17Å; H149-Y152 HydrophobicContact CB-CE2 4.15Å; H149-Y152 AromaticContact CD2-CE1 3.61Å; H149-Y152 AromaticContact CD2-CZ 3.85Å; H149-Y152 PolarHBondContact N-OH 3Å; H149-Y152 WeakPolarHBondContact O-CE2 3.41Å; H149-N174 PolarHBondContact NE2-OD1 2.87Å
150	E	94.2	Very high	96.1	Very high	194 Å²	194	58 Å²	58	91%	0.907	29%	0.294	S	S	*	.	S	Bend	trans	-63.2	-32.5	178.2	-62.4	-177.2	164.1	0	0	112.3	T249	E150-T249 PolarHBondContact O-OG1 3.24Å; E150-T249 VanDerWaalsContact O-OG1 3.05Å
151	S	95.4	Very high	96.2	Very high	79 Å²	79	57.5 Å²	57.5	55%	0.552	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.8	156	-179.8	61.9	0	0	0	0	111.3	H149	H149-S151 PolarHBondContact O-N 2.84Å
152	Y	97.8	Very high	96.3	Very high	14 Å²	14	60.7 Å²	60.7	6%	0.055	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	156.8	176.9	-63.8	-97.4	0	0	0	110.7	F147 H149 F167 F170 N174 G175 T249 T250 L251 T252	F147-Y152 HydrophobicContact CB-CE2 4.4Å; F147-Y152 AromaticContact CD1-CE2 3.75Å; F147-Y152 HydrophobicContact CD1-CE2 3.75Å; F147-Y152 HydrophobicContact CE1-CE2 4.4Å; F147-Y152 HydrophobicContact CG-CE2 4.33Å; H149-Y152 HydrophobicContact CB-CE1 4.17Å; H149-Y152 HydrophobicContact CB-CE2 4.15Å; H149-Y152 AromaticContact CD2-CE1 3.61Å; H149-Y152 AromaticContact CD2-CZ 3.85Å; H149-Y152 PolarHBondContact N-OH 3Å; H149-Y152 WeakPolarHBondContact O-CE2 3.41Å; Y152-F167 HydrophobicContact CD1-CE2 4.35Å; Y152-F167 AromaticContact CD1-CZ 3.66Å; Y152-F167 HydrophobicContact CD1-CZ 3.66Å; Y152-F167 AromaticContact CG-CZ 3.99Å; Y152-F167 HydrophobicContact CG-CZ 3.99Å; Y152-F170 HydrophobicContact CD1-CD1 4.19Å; Y152-F170 AromaticContact CD1-CE1 3.89Å; Y152-F170 HydrophobicContact CD1-CE1 3.89Å; Y152-F170 AromaticContact CD2-CE1 3.76Å; Y152-F170 HydrophobicContact CD2-CE1 3.76Å; Y152-F170 AromaticContact CE1-CD1 3.83Å; Y152-F170 HydrophobicContact CE1-CD1 3.83Å; Y152-F170 AromaticContact CE1-CE1 3.81Å; Y152-F170 HydrophobicContact CE1-CE1 3.81Å; Y152-F170 HydrophobicContact CE2-CD1 4.43Å; Y152-F170 AromaticContact CE2-CE1 3.74Å; Y152-F170 HydrophobicContact CE2-CE1 3.74Å; Y152-F170 AromaticContact CG-CE1 3.85Å; Y152-F170 HydrophobicContact CG-CE1 3.85Å; Y152-F170 AromaticContact CZ-CD1 3.98Å; Y152-F170 AromaticContact CZ-CE1 3.76Å; Y152-N174 WeakPolarHBondContact CE1-O 3.28Å; Y152-N174 PolarHBondContact OH-O 2.78Å; Y152-G175 PolarHBondContact OH-O 3.01Å; Y152-T249 HydrophobicContact CD2-CG2 3.73Å; Y152-T249 WeakPolarHBondContact CD2-OG1 3.49Å; Y152-T249 HydrophobicContact CE2-CG2 3.81Å; Y152-T250 PolarHBondContact N-O 3.15Å; Y152-L251 WeakPolarHBondContact O-CA 3.44Å; Y152-T252 PolarHBondContact O-N 3.44Å
153	Y	97.7	Very high	96.4	Very high	129 Å²	129	61.3 Å²	61.3	51%	0.506	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.9	-176.4	-177.8	-103.9	0	0	0	111.4	T155 T252 D254	Y153-T155 HydrophobicContact CE1-CG2 3.63Å; Y153-T155 WeakPolarHBondContact OH-CG2 3.27Å; Y153-T252 WeakPolarHBondContact CA-O 3.4Å; Y153-T252 HydrophobicContact CD2-CG2 4.18Å; Y153-T252 HydrophobicContact CE2-CG2 4.35Å; Y153-D254 HydrophobicContact CE2-CB 4.23Å; Y153-D254 PolarHBondContact OH-OD2 3.11Å
154	A	97.3	Very high	96.5	Very high	11 Å²	11	61.5 Å²	61.5	9%	0.091	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	155.4	173	0	0	0	0	0	110.9	F167 L251 T252 V253 D254	A154-F167 HydrophobicContact CB-CB 4.34Å; A154-F167 HydrophobicContact CB-CD2 4.08Å; A154-L251 HydrophobicContact CB-CD1 4.08Å; A154-T252 PolarHBondContact N-O 2.87Å; A154-V253 HydrophobicContact CB-CG2 4.48Å; A154-V253 WeakPolarHBondContact O-CA 3.39Å; A154-D254 PolarHBondContact O-N 2.89Å
155	T	96.8	Very high	96.5	Very high	71 Å²	71	62.9 Å²	62.9	44%	0.436	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.1	172.3	52.5	0	0	0	0	109.7	Y153 D254 L256	Y153-T155 HydrophobicContact CE1-CG2 3.63Å; Y153-T155 WeakPolarHBondContact OH-CG2 3.27Å; T155-D254 CarbonylContact C-O 3.55Å; T155-D254 VanDerWaalsContact CA-O 3.3Å; T155-D254 WeakPolarHBondContact CA-O 3.42Å; T155-D254 HydrophobicContact CG2-CB 4.42Å; T155-L256 HydrophobicContact CG2-CD2 4.25Å
156	V	97.4	Very high	96.5	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.024	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	121.1	-177.3	-174.8	0	0	0	0	109	T160 I166 L220 V253 D254 V255 L256	V156-T160 HydrophobicContact CG1-CG2 4.05Å; V156-T160 WeakPolarHBondContact CG1-OG1 3Å; V156-I166 HydrophobicContact CB-CG2 4.49Å; V156-I166 HydrophobicContact CG1-CG2 3.79Å; V156-I166 HydrophobicContact CG2-CB 3.6Å; V156-I166 HydrophobicContact CG2-CD1 4.4Å; V156-I166 HydrophobicContact CG2-CG1 4.15Å; V156-I166 HydrophobicContact CG2-CG2 3.79Å; V156-L220 HydrophobicContact CB-CD1 4.04Å; V156-L220 HydrophobicContact CG1-CD1 3.62Å; V156-V253 HydrophobicContact CB-CG1 4.34Å; V156-V253 HydrophobicContact CG2-CG1 3.61Å; V156-D254 PolarHBondContact N-O 3.09Å; V156-V255 CarbonylContact O-C 3.57Å; V156-V255 VanDerWaalsContact O-CA 3.25Å; V156-V255 WeakPolarHBondContact O-CA 3.05Å; V156-L256 PolarHBondContact O-N 3.06Å
157	N	96.3	Very high	96.6	Very high	53 Å²	53	61.3 Å²	61.3	28%	0.283	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140.3	172.3	179.8	-82.8	0	0	0	110.1	L159 T160 L256 D257 G258	N157-L159 PolarHBondContact O-N 3.48Å; N157-L159 VanDerWaalsContact OD1-CB 3.24Å; N157-L159 WeakPolarHBondContact OD1-CB 3.21Å; N157-L159 PolarHBondContact OD1-N 2.94Å; N157-T160 WeakPolarHBondContact O-CB 3.37Å; N157-T160 PolarHBondContact O-N 3.38Å; N157-T160 PolarHBondContact O-OG1 3.24Å; N157-L256 WeakPolarHBondContact CA-O 3.24Å; N157-L256 HydrophobicContact CB-CB 4.35Å; N157-L256 PolarHBondContact ND2-O 2.91Å; N157-D257 PolarHBondContact ND2-O 2.89Å; N157-G258 WeakPolarHBondContact ND2-CA 3.21Å
158	E	97.2	Very high	96.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.9	-172.4	74.8	-166.1	101.1	0	0	115	T160 L220 N221 Y222 V255 L256 D257 G258	E158-T160 PolarHBondContact O-N 3.26Å; E158-L220 HydrophobicContact CB-CB 3.98Å; E158-N221 VanDerWaalsContact OE2-CA 3.29Å; E158-N221 WeakPolarHBondContact OE2-CA 3.31Å; E158-Y222 WeakPolarHBondContact OE1-CB 3.45Å; E158-Y222 WeakPolarHBondContact OE2-CB 3.43Å; E158-Y222 PolarHBondContact OE2-N 3.34Å; E158-V255 HydrophobicContact CB-CG1 3.74Å; E158-L256 PolarHBondContact N-O 2.76Å; E158-D257 WeakPolarHBondContact OE1-CA 3.48Å; E158-G258 PolarHBondContact OE1-N 2.94Å
159	L	95.9	Very high	96.5	Very high	81 Å²	81	58.6 Å²	58.6	42%	0.424	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-4.4	174.6	-57.2	172.3	0	0	0	112.6	N157 P161 D259 D260	N157-L159 PolarHBondContact O-N 3.48Å; N157-L159 VanDerWaalsContact OD1-CB 3.24Å; N157-L159 WeakPolarHBondContact OD1-CB 3.21Å; N157-L159 PolarHBondContact OD1-N 2.94Å; L159-P161 WeakPolarHBondContact O-CD 3.49Å; L159-D259 WeakPolarHBondContact CD1-O 3.05Å; L159-D260 HydrophobicContact CD2-CB 4.03Å
160	T	95.9	Very high	96.5	Very high	28 Å²	28	55.2 Å²	55.2	17%	0.172	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-56.8	121.9	177.8	-62.7	0	0	0	0	110.5	V156 N157 E158 T164 I166 L216	V156-T160 HydrophobicContact CG1-CG2 4.05Å; V156-T160 WeakPolarHBondContact CG1-OG1 3Å; N157-T160 WeakPolarHBondContact O-CB 3.37Å; N157-T160 PolarHBondContact O-N 3.38Å; N157-T160 PolarHBondContact O-OG1 3.24Å; E158-T160 PolarHBondContact O-N 3.26Å; T160-T164 HydrophobicContact CG2-CG2 3.76Å; T160-I166 HydrophobicContact CG2-CG2 4.16Å; T160-L216 HydrophobicContact CG2-CD2 3.96Å; T160-L216 VanDerWaalsContact O-CD2 3.27Å; T160-L216 WeakPolarHBondContact O-CD2 3.42Å
161	P	97.1	Very high	96.5	Very high	91 Å²	91	49.4 Å²	49.4	59%	0.591	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-62.5	142	179.5	-25.3	35.4	0	0	0	112.9	L159 G163 T164	L159-P161 WeakPolarHBondContact O-CD 3.49Å; P161-G163 PolarHBondContact O-N 2.78Å; P161-T164 VanDerWaalsContact O-CB 3.25Å; P161-T164 WeakPolarHBondContact O-CB 3.25Å; P161-T164 PolarHBondContact O-N 2.93Å; P161-T164 VanDerWaalsContact O-N 3.12Å; P161-T164 PolarHBondContact O-OG1 3.03Å
162	V	96.9	Very high	96.2	Very high	81 Å²	81	49 Å²	49	49%	0.491	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	136.5	169.5	175.8	0	0	0	0	109.9	R217 R219	V162-R217 WeakPolarHBondContact CG1-O 3.46Å; V162-R219 HydrophobicContact CG2-CB 4.29Å; V162-R219 VanDerWaalsContact CG2-N 3.35Å
163	G	95.2	Very high	95.9	Very high	52 Å²	52	54.4 Å²	54.4	54%	0.536	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-7.4	-171.6	0	0	0	0	0	114.5	P161 L216	P161-G163 PolarHBondContact O-N 2.78Å; G163-L216 PolarHBondContact N-O 2.94Å
164	T	96.8	Very high	95.7	Very high	54 Å²	54	50.5 Å²	50.5	33%	0.331	33%	0.328	S	S	.	.			trans	-71.1	134.1	174.5	-54.8	0	0	0	0	110.9	T160 P161 I166 V215 L216	T160-T164 HydrophobicContact CG2-CG2 3.76Å; P161-T164 VanDerWaalsContact O-CB 3.25Å; P161-T164 WeakPolarHBondContact O-CB 3.25Å; P161-T164 PolarHBondContact O-N 2.93Å; P161-T164 VanDerWaalsContact O-N 3.12Å; P161-T164 PolarHBondContact O-OG1 3.03Å; T164-I166 PolarHBondContact O-N 3.43Å; T164-V215 WeakPolarHBondContact O-CA 3.5Å; T164-L216 PolarHBondContact O-N 3.06Å
165	T	97.4	Very high	95.6	Very high	69 Å²	69	50 Å²	50	42%	0.423	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	114.4	168.6	-54.3	0	0	0	0	109.6	T168 N213 V214	T165-T168 HydrophobicContact CG2-CG2 3.7Å; T165-N213 HydrophobicContact CG2-CB 3.97Å; T165-V214 CarbonylContact C-O 3.54Å
166	I	96.7	Very high	95.5	Very high	26 Å²	26	47 Å²	47	13%	0.133	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-14.3	-174.3	57.9	74.6	0	0	0	113.8	V156 T160 T164 F204 V214 L216	V156-I166 HydrophobicContact CB-CG2 4.49Å; V156-I166 HydrophobicContact CG1-CG2 3.79Å; V156-I166 HydrophobicContact CG2-CB 3.6Å; V156-I166 HydrophobicContact CG2-CD1 4.4Å; V156-I166 HydrophobicContact CG2-CG1 4.15Å; V156-I166 HydrophobicContact CG2-CG2 3.79Å; T160-I166 HydrophobicContact CG2-CG2 4.16Å; T164-I166 PolarHBondContact O-N 3.43Å; I166-F204 HydrophobicContact CD1-CD1 4.01Å; I166-F204 HydrophobicContact CD1-CE1 4.12Å; I166-F204 HydrophobicContact CG1-CD1 4.02Å; I166-F204 HydrophobicContact CG1-CE1 4.07Å; I166-V214 HydrophobicContact CD1-CB 3.91Å; I166-V214 HydrophobicContact CD1-CG1 3.73Å; I166-V214 HydrophobicContact CG1-CG1 4.37Å; I166-V214 PolarHBondContact N-O 2.97Å; I166-L216 HydrophobicContact CG2-CB 4.02Å
167	F	97.4	Very high	95.5	Very high	19 Å²	19	49.5 Å²	49.5	8%	0.083	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	130.9	178.1	175.4	-95	0	0	0	111.7	Y152 A154 F170 N213 V214 L251	Y152-F167 HydrophobicContact CD1-CE2 4.35Å; Y152-F167 AromaticContact CD1-CZ 3.66Å; Y152-F167 HydrophobicContact CD1-CZ 3.66Å; Y152-F167 AromaticContact CG-CZ 3.99Å; Y152-F167 HydrophobicContact CG-CZ 3.99Å; A154-F167 HydrophobicContact CB-CB 4.34Å; A154-F167 HydrophobicContact CB-CD2 4.08Å; F167-F170 HydrophobicContact CD1-CE2 4.41Å; F167-F170 AromaticContact CE1-CD1 3.82Å; F167-F170 HydrophobicContact CE1-CD1 3.82Å; F167-F170 AromaticContact CE1-CD2 3.87Å; F167-F170 HydrophobicContact CE1-CD2 3.87Å; F167-F170 AromaticContact CE1-CE1 3.75Å; F167-F170 HydrophobicContact CE1-CE1 3.75Å; F167-F170 AromaticContact CE1-CE2 3.78Å; F167-F170 HydrophobicContact CE1-CE2 3.78Å; F167-F170 AromaticContact CE1-CG 3.91Å; F167-F170 HydrophobicContact CE1-CG 3.91Å; F167-F170 AromaticContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CZ-CD1 4.15Å; F167-F170 HydrophobicContact CZ-CE1 4.05Å; F167-F170 HydrophobicContact CZ-CZ 4.4Å; F167-N213 WeakPolarHBondContact O-CA 3.35Å; F167-V214 HydrophobicContact CB-CB 4.19Å; F167-V214 HydrophobicContact CD1-CG2 4.11Å; F167-V214 PolarHBondContact N-O 2.73Å; F167-V214 PolarHBondContact O-N 2.71Å; F167-L251 HydrophobicContact CB-CD2 4.16Å; F167-L251 HydrophobicContact CD1-CD2 4Å; F167-L251 HydrophobicContact CD2-CD1 3.86Å; F167-L251 HydrophobicContact CD2-CD2 4.48Å; F167-L251 HydrophobicContact CE1-CD2 4.49Å; F167-L251 HydrophobicContact CE2-CD1 3.88Å; F167-L251 HydrophobicContact CG-CD1 4.19Å; F167-L251 HydrophobicContact CG-CD2 3.98Å; F167-L251 HydrophobicContact CZ-CD1 4.24Å
168	T	96.5	Very high	95.5	Very high	74 Å²	74	47.9 Å²	47.9	45%	0.454	31%	0.313	S	S	.	.			trans	-126.9	16	178	60.3	0	0	0	0	112.1	T165 F170 S171	T165-T168 HydrophobicContact CG2-CG2 3.7Å; T168-F170 PolarHBondContact O-N 2.79Å; T168-S171 WeakPolarHBondContact O-CB 3.41Å; T168-S171 PolarHBondContact O-N 3.47Å; T168-S171 VanDerWaalsContact O-N 3.12Å; T168-S171 PolarHBondContact O-OG 3.33Å
169	G	94.5	Very high	95.5	Very high	21 Å²	21	51.2 Å²	51.2	22%	0.216	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-3.1	-168.8	0	0	0	0	0	115.8	N174	G169-N174 WeakPolarHBondContact O-CB 3.33Å; G169-N174 PolarHBondContact O-ND2 2.72Å
170	F	95.5	Very high	95.5	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.035	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-12.5	172.1	-58.6	-36	0	0	0	114.1	F147 Y152 F167 T168 G175 Y189 G212 I232 T249	F147-F170 HydrophobicContact CD1-CE1 4.29Å; F147-F170 HydrophobicContact CE1-CD1 4.31Å; F147-F170 AromaticContact CE1-CE1 3.81Å; F147-F170 HydrophobicContact CE1-CE1 3.81Å; F147-F170 HydrophobicContact CE1-CZ 4.1Å; Y152-F170 HydrophobicContact CD1-CD1 4.19Å; Y152-F170 AromaticContact CD1-CE1 3.89Å; Y152-F170 HydrophobicContact CD1-CE1 3.89Å; Y152-F170 AromaticContact CD2-CE1 3.76Å; Y152-F170 HydrophobicContact CD2-CE1 3.76Å; Y152-F170 AromaticContact CE1-CD1 3.83Å; Y152-F170 HydrophobicContact CE1-CD1 3.83Å; Y152-F170 AromaticContact CE1-CE1 3.81Å; Y152-F170 HydrophobicContact CE1-CE1 3.81Å; Y152-F170 HydrophobicContact CE2-CD1 4.43Å; Y152-F170 AromaticContact CE2-CE1 3.74Å; Y152-F170 HydrophobicContact CE2-CE1 3.74Å; Y152-F170 AromaticContact CG-CE1 3.85Å; Y152-F170 HydrophobicContact CG-CE1 3.85Å; Y152-F170 AromaticContact CZ-CD1 3.98Å; Y152-F170 AromaticContact CZ-CE1 3.76Å; F167-F170 HydrophobicContact CD1-CE2 4.41Å; F167-F170 AromaticContact CE1-CD1 3.82Å; F167-F170 HydrophobicContact CE1-CD1 3.82Å; F167-F170 AromaticContact CE1-CD2 3.87Å; F167-F170 HydrophobicContact CE1-CD2 3.87Å; F167-F170 AromaticContact CE1-CE1 3.75Å; F167-F170 HydrophobicContact CE1-CE1 3.75Å; F167-F170 AromaticContact CE1-CE2 3.78Å; F167-F170 HydrophobicContact CE1-CE2 3.78Å; F167-F170 AromaticContact CE1-CG 3.91Å; F167-F170 HydrophobicContact CE1-CG 3.91Å; F167-F170 AromaticContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CE1-CZ 3.74Å; F167-F170 HydrophobicContact CZ-CD1 4.15Å; F167-F170 HydrophobicContact CZ-CE1 4.05Å; F167-F170 HydrophobicContact CZ-CZ 4.4Å; T168-F170 PolarHBondContact O-N 2.79Å; F170-G175 PolarHBondContact O-N 2.94Å; F170-G175 VanDerWaalsContact O-N 3.13Å; F170-Y189 HydrophobicContact CB-CE1 4.48Å; F170-Y189 HydrophobicContact CD2-CD1 4.1Å; F170-Y189 HydrophobicContact CD2-CE1 4.07Å; F170-Y189 HydrophobicContact CD2-CG 4.46Å; F170-Y189 HydrophobicContact CE2-CD1 4.2Å; F170-Y189 HydrophobicContact CE2-CE1 4.43Å; F170-Y189 HydrophobicContact CG-CE1 4.17Å; F170-G212 VanDerWaalsContact CD2-O 3.3Å; F170-G212 WeakPolarHBondContact CD2-O 3.35Å; F170-I232 HydrophobicContact CE2-CD1 3.77Å; F170-I232 HydrophobicContact CE2-CG2 3.87Å; F170-I232 HydrophobicContact CZ-CB 4.34Å; F170-I232 HydrophobicContact CZ-CD1 3.69Å; F170-I232 HydrophobicContact CZ-CG2 3.98Å; F170-T249 HydrophobicContact CE1-CG2 4.41Å; F170-T249 HydrophobicContact CZ-CG2 4.32Å
171	S	93.7	Very high	95.4	Very high	73 Å²	73	50.6 Å²	50.6	51%	0.51	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	149.3	179	59.1	0	0	0	0	112.9	T168 N174	T168-S171 WeakPolarHBondContact O-CB 3.41Å; T168-S171 PolarHBondContact O-N 3.47Å; T168-S171 VanDerWaalsContact O-N 3.12Å; T168-S171 PolarHBondContact O-OG 3.33Å; S171-N174 VanDerWaalsContact O-CB 3.31Å; S171-N174 WeakPolarHBondContact O-CB 3.38Å
172	G	90.6	Very high	95.2	Very high	70 Å²	70	47.5 Å²	47.5	72%	0.722	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	55.7	173.8	0	0	0	0	0	114	N174	G172-N174 PolarHBondContact O-N 3.31Å; G172-N174 VanDerWaalsContact O-N 3.1Å
173	D	90.2	Very high	95.1	Very high	127 Å²	127	45.9 Å²	45.9	68%	0.679	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	38	179.4	-46.6	-25.8	0	0	0	112.3	K148 T177	K148-D173 VanDerWaalsContact CD-O 3.28Å; K148-D173 WeakPolarHBondContact CD-O 3.45Å; K148-D173 PolarHBondContact NZ-O 2.71Å; D173-T177 HydrophobicContact CB-CG2 4.35Å
174	N	94.6	Very high	95	Very high	47 Å²	47	44.4 Å²	44.4	25%	0.251	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-6.3	177.5	-158.3	68.3	0	0	0	113.3	K148 H149 Y152 G169 S171 G172	K148-N174 HydrophobicContact CD-CB 4.46Å; K148-N174 WeakPolarHBondContact CD-OD1 3.07Å; K148-N174 PolarHBondContact NZ-OD1 2.93Å; K148-N174 VanDerWaalsContact NZ-OD1 3.13Å; H149-N174 PolarHBondContact NE2-OD1 2.87Å; Y152-N174 WeakPolarHBondContact CE1-O 3.28Å; Y152-N174 PolarHBondContact OH-O 2.78Å; G169-N174 WeakPolarHBondContact O-CB 3.33Å; G169-N174 PolarHBondContact O-ND2 2.72Å; S171-N174 VanDerWaalsContact O-CB 3.31Å; S171-N174 WeakPolarHBondContact O-CB 3.38Å; G172-N174 PolarHBondContact O-N 3.31Å; G172-N174 VanDerWaalsContact O-N 3.1Å
175	G	94.7	Very high	94.9	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.01	28%	0.277	C	S	.	.	S	Bend	trans	-94.9	-127.6	170.3	0	0	0	0	0	112.6	F147 K148 Y152 F170	F147-G175 WeakPolarHBondContact CA-O 3.39Å; K148-G175 PolarHBondContact N-O 2.99Å; Y152-G175 PolarHBondContact OH-O 3.01Å; F170-G175 PolarHBondContact O-N 2.94Å; F170-G175 VanDerWaalsContact O-N 3.13Å
176	A	95.9	Very high	94.8	Very high	7 Å²	7	43.5 Å²	43.5	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	142.8	171.6	0	0	0	0	0	112	P145 T146 F147 I187 Y189 A234	P145-A176 HydrophobicContact CB-CB 4.24Å; T146-A176 CarbonylContact O-C 3.59Å; T146-A176 VanDerWaalsContact O-CA 3.23Å; T146-A176 WeakPolarHBondContact O-CA 3.19Å; F147-A176 HydrophobicContact CD1-CB 3.86Å; F147-A176 HydrophobicContact CD2-CB 4.35Å; F147-A176 HydrophobicContact CE1-CB 3.91Å; F147-A176 HydrophobicContact CE2-CB 4.38Å; F147-A176 HydrophobicContact CG-CB 4.09Å; F147-A176 HydrophobicContact CZ-CB 4.17Å; A176-I187 HydrophobicContact CB-CG2 4.39Å; A176-Y189 HydrophobicContact CB-CE1 3.97Å; A176-Y189 PolarHBondContact N-OH 3Å; A176-Y189 PolarHBondContact O-OH 3.04Å; A176-A234 HydrophobicContact CB-CB 3.46Å; A176-A234 VanDerWaalsContact CB-CB 3.46Å
177	T	96.3	Very high	94.8	Very high	57 Å²	57	43.2 Å²	43.2	35%	0.35	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.7	171.8	48.5	0	0	0	0	109.3	T146 D173	T146-T177 PolarHBondContact N-O 2.81Å; T146-T177 PolarHBondContact O-N 2.8Å; T146-T177 PolarHBondContact OG1-O 3.16Å; D173-T177 HydrophobicContact CB-CG2 4.35Å
178	D	96.8	Very high	94.7	Very high	19 Å²	19	43.8 Å²	43.8	10%	0.102	28%	0.277	C	S	.	.			trans	-109.2	154.6	166	-146.4	-43.4	0	0	0	109.3	S144 P145 I187	S144-D178 WeakPolarHBondContact CA-OD2 3.27Å; P145-D178 WeakPolarHBondContact CA-OD2 2.95Å; P145-D178 WeakPolarHBondContact CD-OD2 3.12Å; P145-D178 WeakPolarHBondContact CG-OD2 3.06Å; D178-I187 HydrophobicContact CB-CD1 3.93Å
179	I	96.1	Very high	94.8	Very high	71 Å²	71	40.9 Å²	40.9	36%	0.364	26%	0.258	S	S	.	.			trans	-104.1	-15.5	-174.9	68.3	167.5	0	0	0	113.7	D106 N143	D106-I179 HydrophobicContact CB-CD1 4.29Å; D106-I179 HydrophobicContact CB-CG1 4.46Å; N143-I179 HydrophobicContact CB-CD1 4.21Å; N143-I179 HydrophobicContact CB-CG1 3.58Å; N143-I179 WeakPolarHBondContact ND2-CG1 3.47Å
180	D	95.8	Very high	94.9	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.037	26%	0.259	C	S	.	.	S	Bend	trans	-61.1	163.9	170	-56.4	-8.5	0	0	0	110.5	N141 D142 N143 N184 G185	N141-D180 VanDerWaalsContact CA-OD2 3.24Å; N141-D180 WeakPolarHBondContact CA-OD2 3.46Å; D142-D180 PolarHBondContact N-OD2 3Å; N143-D180 WeakPolarHBondContact CB-OD1 3.18Å; N143-D180 PolarHBondContact N-OD1 3.02Å; N143-D180 PolarHBondContact N-OD2 3.48Å; N143-D180 PolarHBondContact ND2-OD1 3.06Å; D180-N184 HydrophobicContact CB-CB 3.46Å; D180-N184 VanDerWaalsContact CB-CB 3.46Å; D180-G185 WeakPolarHBondContact O-CA 3.26Å; D180-G185 PolarHBondContact O-N 2.94Å
181	D	94.1	Very high	95	Very high	88 Å²	88	42.6 Å²	42.6	47%	0.471	26%	0.264	S	S	.	.			trans	-97.3	162.4	-177	-173.6	25.2	0	0	0	114	R105 D139 N184 G185	R105-D181 IonicContact CZ-OD2 2.7Å; R105-D181 IonicContact NH1-OD2 3.13Å; R105-D181 IonicContact NH2-OD2 3.72Å; R105-D181 PolarHBondContact NH2-OD2 2.88Å; D139-D181 WeakPolarHBondContact OD1-CA 3.33Å; D139-D181 WeakPolarHBondContact OD1-CB 3.22Å; D139-D181 PolarHBondContact OD1-N 2.87Å; D139-D181 PolarHBondContact OD2-N 2.96Å; D181-N184 WeakPolarHBondContact O-CB 3.42Å; D181-N184 PolarHBondContact O-N 2.91Å; D181-N184 VanDerWaalsContact O-N 3.1Å; D181-G185 PolarHBondContact O-N 2.72Å
182	G	93	Very high	95.1	Very high	27 Å²	27	42.7 Å²	42.7	28%	0.278	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	-126.9	170.1	0	0	0	0	0	112.6	N184 Q186	G182-N184 VanDerWaalsContact C-N 3.34Å; G182-Q186 VanDerWaalsContact O-CD 3.31Å; G182-Q186 WeakPolarHBondContact O-CG 3.18Å; G182-Q186 PolarHBondContact O-N 2.86Å; G182-Q186 PolarHBondContact O-NE2 2.86Å
183	P	94.6	Very high	95.4	Very high	46 Å²	46	45.3 Å²	45.3	30%	0.299	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-28.8	176.8	-19.5	33.5	0	0	0	114.2	Q186 R237	P183-Q186 PolarHBondContact O-N 2.83Å; P183-R237 HydrophobicContact CB-CB 4.35Å; P183-R237 VanDerWaalsContact CB-O 3.3Å; P183-R237 WeakPolarHBondContact CB-O 3.3Å; P183-R237 CarbonylContact O-C 3.29Å; P183-R237 VanDerWaalsContact O-C 3.24Å; P183-R237 VanDerWaalsContact O-CA 3.23Å; P183-R237 WeakPolarHBondContact O-CA 3.07Å; P183-R237 VanDerWaalsContact O-CB 3.25Å; P183-R237 WeakPolarHBondContact O-CB 3.48Å; P183-R237 PolarHBondContact O-N 2.8Å
184	N	94.7	Very high	95.7	Very high	21 Å²	21	39.6 Å²	39.6	11%	0.112	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-41	178.3	-62.3	-6.6	0	0	0	109.1	D139 N141 D180 D181 G182 Q186 D236 A238	D139-N184 WeakPolarHBondContact OD2-CB 3.39Å; D139-N184 PolarHBondContact OD2-ND2 2.77Å; N141-N184 HydrophobicContact CB-CB 4.32Å; N141-N184 PolarHBondContact N-ND2 2.77Å; N141-N184 WeakPolarHBondContact OD1-CA 3.46Å; N141-N184 WeakPolarHBondContact OD1-CB 3.36Å; N141-N184 VanDerWaalsContact OD1-CG 3.28Å; N141-N184 PolarHBondContact OD1-OD1 3.46Å; D180-N184 HydrophobicContact CB-CB 3.46Å; D180-N184 VanDerWaalsContact CB-CB 3.46Å; D181-N184 WeakPolarHBondContact O-CB 3.42Å; D181-N184 PolarHBondContact O-N 2.91Å; D181-N184 VanDerWaalsContact O-N 3.1Å; G182-N184 VanDerWaalsContact C-N 3.34Å; N184-Q186 VanDerWaalsContact C-N 3.28Å; N184-Q186 PolarHBondContact O-N 2.92Å; N184-D236 VanDerWaalsContact O-CB 3.23Å; N184-D236 WeakPolarHBondContact O-CB 3.42Å; N184-A238 WeakPolarHBondContact OD1-CA 3.43Å
185	G	93.4	Very high	95.8	Very high	23 Å²	23	42 Å²	42	24%	0.237	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.5	171.1	0	0	0	0	0	117.6	D180 D181	D180-G185 WeakPolarHBondContact O-CA 3.26Å; D180-G185 PolarHBondContact O-N 2.94Å; D181-G185 PolarHBondContact O-N 2.72Å
186	Q	95.3	Very high	95.8	Very high	81 Å²	81	50.2 Å²	50.2	38%	0.379	27%	0.27	S	S	.	.			trans	-95.2	132.7	-171.3	-80.3	164.6	34.2	0	0	112.5	G182 P183 N184 D236 R237	G182-Q186 VanDerWaalsContact O-CD 3.31Å; G182-Q186 WeakPolarHBondContact O-CG 3.18Å; G182-Q186 PolarHBondContact O-N 2.86Å; G182-Q186 PolarHBondContact O-NE2 2.86Å; P183-Q186 PolarHBondContact O-N 2.83Å; N184-Q186 VanDerWaalsContact C-N 3.28Å; N184-Q186 PolarHBondContact O-N 2.92Å; Q186-D236 CarbonylContact O-C 3.55Å; Q186-D236 VanDerWaalsContact O-CA 3.28Å; Q186-D236 WeakPolarHBondContact O-CA 3.4Å; Q186-R237 HydrophobicContact CB-CB 4.29Å; Q186-R237 HydrophobicContact CB-CG 4.08Å; Q186-R237 WeakPolarHBondContact O-CG 3.38Å; Q186-R237 PolarHBondContact O-N 2.86Å; Q186-R237 VanDerWaalsContact O-N 3.12Å
187	I	96.2	Very high	95.8	Very high	20 Å²	20	50.2 Å²	50.2	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.6	-177.9	-54.1	-52.9	0	0	0	113	P145 A176 D178 Y189 A234	P145-I187 HydrophobicContact CB-CD1 3.61Å; P145-I187 HydrophobicContact CG-CD1 3.61Å; A176-I187 HydrophobicContact CB-CG2 4.39Å; D178-I187 HydrophobicContact CB-CD1 3.93Å; I187-Y189 HydrophobicContact CB-CE2 4.33Å; I187-Y189 HydrophobicContact CG2-CD1 4.19Å; I187-Y189 HydrophobicContact CG2-CD2 3.97Å; I187-Y189 HydrophobicContact CG2-CE1 3.9Å; I187-Y189 HydrophobicContact CG2-CE2 3.67Å; I187-Y189 HydrophobicContact CG2-CG 4.22Å; I187-A234 HydrophobicContact CG2-CB 3.8Å
188	E	96.6	Very high	95.8	Very high	32 Å²	32	50.6 Å²	50.6	15%	0.15	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.7	159.3	-79.2	168.9	176.8	0	0	109.3	M209 L210 N235 R237 R244	E188-M209 HydrophobicContact CB-CB 4.26Å; E188-M209 HydrophobicContact CG-CB 4.26Å; E188-L210 HydrophobicContact CG-CD2 3.98Å; E188-N235 WeakPolarHBondContact CB-ND2 3.02Å; E188-N235 PolarHBondContact N-O 3.05Å; E188-N235 PolarHBondContact O-N 2.88Å; E188-N235 PolarHBondContact O-ND2 2.9Å; E188-R237 HydrophobicContact CB-CG 4.49Å; E188-R237 HydrophobicContact CG-CG 3.77Å; E188-R237 IonicContact OE1-CZ 2.67Å; E188-R237 IonicContact OE1-NE 3.46Å; E188-R237 PolarHBondContact OE1-NE 2.88Å; E188-R237 IonicContact OE1-NH2 2.81Å; E188-R237 PolarHBondContact OE1-NH2 2.84Å; E188-R244 IonicContact OE2-CZ 2.72Å; E188-R244 IonicContact OE2-NH1 3.13Å; E188-R244 PolarHBondContact OE2-NH1 2.76Å; E188-R244 IonicContact OE2-NH2 2.93Å; E188-R244 PolarHBondContact OE2-NH2 3.15Å
189	Y	97.6	Very high	95.7	Very high	12 Å²	12	52.7 Å²	52.7	5%	0.047	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.9	175.5	-63.3	-84	0	0	0	111.3	F147 F170 A176 I187 M209 G212 I232 Q233 A234	F147-Y189 HydrophobicContact CE1-CD1 4.31Å; F147-Y189 AromaticContact CE1-CE1 3.76Å; F147-Y189 HydrophobicContact CE1-CE1 3.76Å; F147-Y189 HydrophobicContact CZ-CD1 4.29Å; F147-Y189 HydrophobicContact CZ-CE1 4.08Å; F170-Y189 HydrophobicContact CB-CE1 4.48Å; F170-Y189 HydrophobicContact CD2-CD1 4.1Å; F170-Y189 HydrophobicContact CD2-CE1 4.07Å; F170-Y189 HydrophobicContact CD2-CG 4.46Å; F170-Y189 HydrophobicContact CE2-CD1 4.2Å; F170-Y189 HydrophobicContact CE2-CE1 4.43Å; F170-Y189 HydrophobicContact CG-CE1 4.17Å; A176-Y189 HydrophobicContact CB-CE1 3.97Å; A176-Y189 PolarHBondContact N-OH 3Å; A176-Y189 PolarHBondContact O-OH 3.04Å; I187-Y189 HydrophobicContact CB-CE2 4.33Å; I187-Y189 HydrophobicContact CG2-CD1 4.19Å; I187-Y189 HydrophobicContact CG2-CD2 3.97Å; I187-Y189 HydrophobicContact CG2-CE1 3.9Å; I187-Y189 HydrophobicContact CG2-CE2 3.67Å; I187-Y189 HydrophobicContact CG2-CG 4.22Å; Y189-M209 VanDerWaalsContact CD2-O 3.31Å; Y189-M209 WeakPolarHBondContact CD2-O 3.31Å; Y189-M209 PolarHBondContact N-O 3.36Å; Y189-M209 WeakPolarHBondContact O-CG 3.41Å; Y189-G212 VanDerWaalsContact CD2-CA 3.44Å; Y189-I232 HydrophobicContact CD1-CG2 4.22Å; Y189-Q233 WeakPolarHBondContact CA-O 3.45Å; Y189-A234 HydrophobicContact CD1-CB 4.19Å; Y189-A234 HydrophobicContact CE1-CB 4.12Å
190	V	97.2	Very high	95.7	Very high	41 Å²	41	49.3 Å²	49.3	25%	0.248	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	133.9	-179.4	-178.6	0	0	0	0	109.9	M209 Q233	V190-M209 HydrophobicContact CG2-CE 4.36Å; V190-M209 HydrophobicContact CG2-SD 4.28Å; V190-Q233 PolarHBondContact N-O 2.84Å; V190-Q233 PolarHBondContact O-N 3.29Å
191	I	97.4	Very high	95.7	Very high	25 Å²	25	51.1 Å²	51.1	13%	0.128	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.2	169.7	-70.1	172.3	0	0	0	109.1	N201 F204 I206 V214 V230 I231 I232	I191-N201 HydrophobicContact CG2-CB 3.64Å; I191-F204 HydrophobicContact CD1-CB 4.02Å; I191-I206 HydrophobicContact CD1-CD1 4.31Å; I191-I206 HydrophobicContact CD1-CG1 3.9Å; I191-I206 HydrophobicContact CG1-CD1 3.82Å; I191-I206 HydrophobicContact CG1-CG1 3.92Å; I191-V214 HydrophobicContact CD1-CG1 4.1Å; I191-V230 HydrophobicContact CB-CG1 4.38Å; I191-V230 HydrophobicContact CD1-CG1 3.71Å; I191-V230 HydrophobicContact CG1-CG1 3.75Å; I191-V230 HydrophobicContact CG2-CG1 3.72Å; I191-I231 WeakPolarHBondContact CA-O 3.38Å; I191-I232 HydrophobicContact CG1-CG1 4.14Å
192	Q	96.3	Very high	95.8	Very high	74 Å²	74	50 Å²	50	35%	0.346	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	154	175.8	-72.7	-64.5	-17.6	0	0	111.2	N194 I231 Q233	Q192-N194 PolarHBondContact O-N 2.84Å; Q192-I231 HydrophobicContact CB-CB 4.26Å; Q192-I231 HydrophobicContact CB-CG2 3.99Å; Q192-I231 PolarHBondContact N-O 2.77Å; Q192-Q233 HydrophobicContact CG-CB 3.85Å
193	Y	97.1	Very high	96	Very high	125 Å²	125	49 Å²	49	49%	0.49	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-64.6	125.3	169.4	173.2	-100.5	0	0	0	109.7	P195 P198	Y193-P195 HydrophobicContact CD1-CG 4.21Å; Y193-P195 HydrophobicContact CE1-CB 4.2Å; Y193-P195 HydrophobicContact CE1-CG 4.02Å; Y193-P195 WeakPolarHBondContact O-CD 3.41Å; Y193-P198 HydrophobicContact CE2-CB 3.8Å; Y193-P198 WeakPolarHBondContact OH-CB 3.14Å
194	N	96.8	Very high	96.1	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.043	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-96.5	114.2	173.5	-174.3	-4.2	0	0	0	110.1	Q192 E196 D197 P198 Y229 I231	Q192-N194 PolarHBondContact O-N 2.84Å; N194-E196 PolarHBondContact O-N 3.45Å; N194-E196 WeakPolarHBondContact OD1-CB 3.17Å; N194-E196 PolarHBondContact OD1-N 3.48Å; N194-D197 HydrophobicContact CB-CB 4.35Å; N194-D197 CarbonylContact O-C 3.54Å; N194-D197 PolarHBondContact O-N 3.36Å; N194-D197 VanDerWaalsContact O-N 3.12Å; N194-P198 WeakPolarHBondContact O-CA 3.43Å; N194-P198 VanDerWaalsContact O-N 3.16Å; N194-Y229 PolarHBondContact ND2-O 2.98Å; N194-I231 HydrophobicContact CB-CD1 3.78Å; N194-I231 HydrophobicContact CB-CG1 3.95Å
195	P	95.9	Very high	96.3	Very high	96 Å²	96	49.4 Å²	49.4	62%	0.623	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.5	175.5	-22.3	34.3	0	0	0	114.1	Y193	Y193-P195 HydrophobicContact CD1-CG 4.21Å; Y193-P195 HydrophobicContact CE1-CB 4.2Å; Y193-P195 HydrophobicContact CE1-CG 4.02Å; Y193-P195 WeakPolarHBondContact O-CD 3.41Å
196	E	95.2	Very high	96.5	Very high	174 Å²	174	49.2 Å²	49.2	81%	0.813	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.4	176.8	-57.3	-173	165.5	0	0	112.5	N194	N194-E196 PolarHBondContact O-N 3.45Å; N194-E196 WeakPolarHBondContact OD1-CB 3.17Å; N194-E196 PolarHBondContact OD1-N 3.48Å
197	D	95.6	Very high	96.5	Very high	7 Å²	7	49 Å²	49	4%	0.037	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-138.8	75.1	173.8	-168.4	4.4	0	0	0	112	N194 T199 S200 K225 Y228 Y229	N194-D197 HydrophobicContact CB-CB 4.35Å; N194-D197 CarbonylContact O-C 3.54Å; N194-D197 PolarHBondContact O-N 3.36Å; N194-D197 VanDerWaalsContact O-N 3.12Å; D197-T199 PolarHBondContact O-N 2.66Å; D197-T199 PolarHBondContact OD1-OG1 3.41Å; D197-S200 WeakPolarHBondContact O-CB 3.32Å; D197-S200 PolarHBondContact O-N 3Å; D197-S200 PolarHBondContact O-OG 3.1Å; D197-K225 WeakPolarHBondContact OD1-CE 3.44Å; D197-K225 IonicContact OD1-NZ 2.76Å; D197-K225 PolarHBondContact OD1-NZ 2.76Å; D197-K225 WeakPolarHBondContact OD2-CE 3.27Å; D197-K225 IonicContact OD2-NZ 3.23Å; D197-K225 PolarHBondContact OD2-NZ 2.79Å; D197-Y228 WeakPolarHBondContact OD2-CA 3.5Å; D197-Y229 PolarHBondContact OD2-N 3.12Å
198	P	95.3	Very high	96.5	Very high	65 Å²	65	53.5 Å²	53.5	42%	0.422	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-11.7	-171.2	-28.7	38.2	0	0	0	116	Y193 N194 N201	Y193-P198 HydrophobicContact CE2-CB 3.8Å; Y193-P198 WeakPolarHBondContact OH-CB 3.14Å; N194-P198 WeakPolarHBondContact O-CA 3.43Å; N194-P198 VanDerWaalsContact O-N 3.16Å; P198-N201 PolarHBondContact O-OD1 2.97Å
199	T	95.7	Very high	96.4	Very high	63 Å²	63	56.4 Å²	56.4	39%	0.387	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-9.9	-179.2	63.5	0	0	0	0	113.2	D197 D202 T203 K225	D197-T199 PolarHBondContact O-N 2.66Å; D197-T199 PolarHBondContact OD1-OG1 3.41Å; T199-D202 CarbonylContact O-C 3.56Å; T199-D202 PolarHBondContact O-N 2.9Å; T199-T203 WeakPolarHBondContact O-CB 3.38Å; T199-T203 PolarHBondContact O-N 2.81Å; T199-T203 PolarHBondContact O-OG1 2.73Å; T199-K225 WeakPolarHBondContact OG1-CE 3.42Å
200	S	96.7	Very high	96.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-55.6	-175.4	56.5	0	0	0	0	113.2	D197 D202 T203 F204	D197-S200 WeakPolarHBondContact O-CB 3.32Å; D197-S200 PolarHBondContact O-N 3Å; D197-S200 PolarHBondContact O-OG 3.1Å; S200-D202 PolarHBondContact O-N 2.92Å; S200-T203 PolarHBondContact O-N 3.14Å; S200-T203 VanDerWaalsContact O-N 3.09Å; S200-F204 WeakPolarHBondContact O-CD2 3.45Å; S200-F204 PolarHBondContact O-N 2.65Å
201	N	94.8	Very high	96.1	Very high	45 Å²	45	61.8 Å²	61.8	24%	0.241	33%	0.325	C	S	.	.	H	α-helix	trans	-66.6	-14.6	176.4	72	-50.3	0	0	0	113.9	I191 P198	I191-N201 HydrophobicContact CG2-CB 3.64Å; P198-N201 PolarHBondContact O-OD1 2.97Å
202	D	95.9	Very high	96	Very high	66 Å²	66	60.6 Å²	60.6	35%	0.353	32%	0.319	S	S	.	.	H	α-helix	trans	-91.4	-22.1	176.4	-126.6	30.5	0	0	0	112.1	T199 S200 R217 K218	T199-D202 CarbonylContact O-C 3.56Å; T199-D202 PolarHBondContact O-N 2.9Å; S200-D202 PolarHBondContact O-N 2.92Å; D202-R217 IonicContact OD1-NH1 2.79Å; D202-R217 PolarHBondContact OD1-NH1 2.77Å; D202-K218 VanDerWaalsContact CG-NZ 3.35Å; D202-K218 VanDerWaalsContact O-CD 3.3Å; D202-K218 WeakPolarHBondContact O-CD 3.48Å; D202-K218 WeakPolarHBondContact O-CE 3.32Å; D202-K218 WeakPolarHBondContact O-CG 3.47Å; D202-K218 IonicContact OD2-NZ 3.43Å; D202-K218 PolarHBondContact OD2-NZ 3.14Å
203	T	97.4	Very high	96	Very high	6 Å²	6	59.1 Å²	59.1	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-97.8	-26.4	-178.6	-54.6	0	0	0	0	112.5	T199 S200 L216 R217 K218 L220 Y228	T199-T203 WeakPolarHBondContact O-CB 3.38Å; T199-T203 PolarHBondContact O-N 2.81Å; T199-T203 PolarHBondContact O-OG1 2.73Å; S200-T203 PolarHBondContact O-N 3.14Å; S200-T203 VanDerWaalsContact O-N 3.09Å; T203-L216 HydrophobicContact CG2-CD1 4.21Å; T203-R217 WeakPolarHBondContact O-CA 3.42Å; T203-R217 VanDerWaalsContact O-CB 3.31Å; T203-R217 WeakPolarHBondContact O-CB 3.34Å; T203-R217 PolarHBondContact O-N 3.15Å; T203-K218 HydrophobicContact CG2-CB 4.41Å; T203-K218 PolarHBondContact O-N 3.19Å; T203-L220 HydrophobicContact CG2-CD2 3.61Å; T203-Y228 HydrophobicContact CG2-CE1 3.89Å; T203-Y228 WeakPolarHBondContact OG1-CE1 3.5Å
204	F	98	Very high	96	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.2	179.9	-56.6	-78.9	0	0	0	111.7	I166 I191 S200 V214 V215 L216 L220 Y228 V230 V253	I166-F204 HydrophobicContact CD1-CD1 4.01Å; I166-F204 HydrophobicContact CD1-CE1 4.12Å; I166-F204 HydrophobicContact CG1-CD1 4.02Å; I166-F204 HydrophobicContact CG1-CE1 4.07Å; I191-F204 HydrophobicContact CD1-CB 4.02Å; S200-F204 WeakPolarHBondContact O-CD2 3.45Å; S200-F204 PolarHBondContact O-N 2.65Å; F204-V214 HydrophobicContact CB-CG1 3.75Å; F204-V214 HydrophobicContact CD1-CG1 4.2Å; F204-V214 HydrophobicContact CG-CG1 4.29Å; F204-V215 WeakPolarHBondContact CA-O 3.24Å; F204-L216 HydrophobicContact CD1-CD1 4.08Å; F204-L216 HydrophobicContact CE1-CD1 3.65Å; F204-L216 HydrophobicContact CZ-CD1 4.33Å; F204-L220 HydrophobicContact CZ-CD2 4.39Å; F204-Y228 AromaticContact CE2-CD1 3.82Å; F204-Y228 HydrophobicContact CE2-CD1 3.82Å; F204-Y228 HydrophobicContact CE2-CD2 4.08Å; F204-Y228 HydrophobicContact CE2-CE1 4.41Å; F204-Y228 AromaticContact CE2-CG 3.63Å; F204-Y228 HydrophobicContact CE2-CG 3.63Å; F204-Y228 HydrophobicContact CZ-CD2 4.31Å; F204-Y228 HydrophobicContact CZ-CG 4.29Å; F204-V230 HydrophobicContact CB-CG2 4.41Å; F204-V230 HydrophobicContact CD2-CG2 3.51Å; F204-V230 HydrophobicContact CE2-CG2 4.05Å; F204-V230 HydrophobicContact CG-CG2 4.12Å; F204-V253 HydrophobicContact CE1-CG1 4.1Å; F204-V253 HydrophobicContact CE1-CG2 4.46Å; F204-V253 HydrophobicContact CE2-CB 4.42Å; F204-V253 HydrophobicContact CE2-CG2 4.4Å; F204-V253 HydrophobicContact CZ-CB 4.02Å; F204-V253 HydrophobicContact CZ-CG1 3.78Å; F204-V253 HydrophobicContact CZ-CG2 4.18Å
205	E	97.3	Very high	96.1	Very high	74 Å²	74	53.3 Å²	53.3	35%	0.346	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	158.9	174.6	59.9	-177.8	-149.5	0	0	112.6	V214 V215 R217	E205-V214 WeakPolarHBondContact O-CA 3.36Å; E205-V215 HydrophobicContact CG-CB 4.33Å; E205-V215 PolarHBondContact N-O 3Å; E205-V215 PolarHBondContact O-N 3.36Å; E205-R217 HydrophobicContact CG-CB 4.1Å; E205-R217 HydrophobicContact CG-CG 4.22Å; E205-R217 WeakPolarHBondContact OE2-CD 3.17Å; E205-R217 WeakPolarHBondContact OE2-CG 3.36Å; E205-R217 IonicContact OE2-NE 3.06Å; E205-R217 PolarHBondContact OE2-NE 3.38Å; E205-R217 VanDerWaalsContact OE2-NE 3.16Å
206	I	97.6	Very high	96.2	Very high	18 Å²	18	48.8 Å²	48.8	9%	0.092	26%	0.262	C	S	.	.			trans	-112.9	97.5	167.5	-65.2	173.1	0	0	0	106.8	I191 L208 V214 I232	I191-I206 HydrophobicContact CD1-CD1 4.31Å; I191-I206 HydrophobicContact CD1-CG1 3.9Å; I191-I206 HydrophobicContact CG1-CD1 3.82Å; I191-I206 HydrophobicContact CG1-CG1 3.92Å; I206-L208 VanDerWaalsContact C-N 3.3Å; I206-L208 PolarHBondContact O-N 3.16Å; I206-V214 HydrophobicContact CD1-CG2 4.15Å; I206-V214 HydrophobicContact CG1-CG2 3.89Å; I206-I232 HydrophobicContact CD1-CG2 4.05Å
207	P	96	Very high	96.3	Very high	77 Å²	77	45.8 Å²	45.8	50%	0.5	24%	0.244	S	C	.	.	S	Bend	trans	-75	-21.2	-177.4	29	-34.3	0	0	0	112.8	V215	P207-V215 HydrophobicContact CG-CB 4.33Å; P207-V215 HydrophobicContact CG-CG2 3.73Å
208	L	95.4	Very high	96.3	Very high	114 Å²	114	49.8 Å²	49.8	60%	0.597	26%	0.26	S	S	*	.			trans	-123.9	88.3	179.1	-68.1	177.5	0	0	0	110.2	I206 L210 T211 G212	I206-L208 VanDerWaalsContact C-N 3.3Å; I206-L208 PolarHBondContact O-N 3.16Å; L208-L210 PolarHBondContact O-N 2.72Å; L208-L210 VanDerWaalsContact O-N 3.1Å; L208-T211 HydrophobicContact CB-CG2 4.15Å; L208-T211 WeakPolarHBondContact CB-OG1 3.38Å; L208-T211 PolarHBondContact O-N 3.25Å; L208-T211 PolarHBondContact O-OG1 3.44Å; L208-G212 PolarHBondContact O-N 3.35Å
209	M	95.3	Very high	96.3	Very high	93 Å²	93	54.6 Å²	54.6	46%	0.458	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-32.7	-174.2	-62.9	177.3	177.7	0	0	114	E188 Y189 V190 T211	E188-M209 HydrophobicContact CB-CB 4.26Å; E188-M209 HydrophobicContact CG-CB 4.26Å; Y189-M209 VanDerWaalsContact CD2-O 3.31Å; Y189-M209 WeakPolarHBondContact CD2-O 3.31Å; Y189-M209 PolarHBondContact N-O 3.36Å; Y189-M209 WeakPolarHBondContact O-CG 3.41Å; V190-M209 HydrophobicContact CG2-CE 4.36Å; V190-M209 HydrophobicContact CG2-SD 4.28Å; M209-T211 VanDerWaalsContact C-N 3.26Å; M209-T211 PolarHBondContact O-N 2.82Å
210	L	94.4	Very high	96.4	Very high	115 Å²	115	51.7 Å²	51.7	60%	0.602	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.2	178	-60.8	177.1	0	0	0	114.2	E188 L208	E188-L210 HydrophobicContact CG-CD2 3.98Å; L208-L210 PolarHBondContact O-N 2.72Å; L208-L210 VanDerWaalsContact O-N 3.1Å
211	T	94.7	Very high	96.4	Very high	51 Å²	51	53.5 Å²	53.5	31%	0.313	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-29.3	179.5	66.8	0	0	0	0	112.7	L208 M209 N213	L208-T211 HydrophobicContact CB-CG2 4.15Å; L208-T211 WeakPolarHBondContact CB-OG1 3.38Å; L208-T211 PolarHBondContact O-N 3.25Å; L208-T211 PolarHBondContact O-OG1 3.44Å; M209-T211 VanDerWaalsContact C-N 3.26Å; M209-T211 PolarHBondContact O-N 2.82Å; T211-N213 PolarHBondContact O-N 3.07Å; T211-N213 PolarHBondContact OG1-N 3.41Å
212	G	94.4	Very high	96.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.			trans	65.6	8.4	-171.9	0	0	0	0	0	114.9	F170 Y189 L208 V214	F170-G212 VanDerWaalsContact CD2-O 3.3Å; F170-G212 WeakPolarHBondContact CD2-O 3.35Å; Y189-G212 VanDerWaalsContact CD2-CA 3.44Å; L208-G212 PolarHBondContact O-N 3.35Å; G212-V214 PolarHBondContact O-N 2.82Å
213	N	96.6	Very high	96.4	Very high	44 Å²	44	53.2 Å²	53.2	24%	0.235	26%	0.256	C	S	.	.			trans	-61.9	122.2	176.5	-73.7	-10.9	0	0	0	110.1	T165 F167 T211	T165-N213 HydrophobicContact CG2-CB 3.97Å; F167-N213 WeakPolarHBondContact O-CA 3.35Å; T211-N213 PolarHBondContact O-N 3.07Å; T211-N213 PolarHBondContact OG1-N 3.41Å
214	V	97.5	Very high	96.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.7	-179.5	-175	0	0	0	0	109.6	T165 I166 F167 I191 F204 E205 I206 G212 I232 L251	T165-V214 CarbonylContact C-O 3.54Å; I166-V214 HydrophobicContact CD1-CB 3.91Å; I166-V214 HydrophobicContact CD1-CG1 3.73Å; I166-V214 HydrophobicContact CG1-CG1 4.37Å; I166-V214 PolarHBondContact N-O 2.97Å; F167-V214 HydrophobicContact CB-CB 4.19Å; F167-V214 HydrophobicContact CD1-CG2 4.11Å; F167-V214 PolarHBondContact N-O 2.73Å; F167-V214 PolarHBondContact O-N 2.71Å; I191-V214 HydrophobicContact CD1-CG1 4.1Å; F204-V214 HydrophobicContact CB-CG1 3.75Å; F204-V214 HydrophobicContact CD1-CG1 4.2Å; F204-V214 HydrophobicContact CG-CG1 4.29Å; E205-V214 WeakPolarHBondContact O-CA 3.36Å; I206-V214 HydrophobicContact CD1-CG2 4.15Å; I206-V214 HydrophobicContact CG1-CG2 3.89Å; G212-V214 PolarHBondContact O-N 2.82Å; V214-I232 HydrophobicContact CG2-CD1 3.89Å; V214-L251 HydrophobicContact CB-CD2 4.4Å; V214-L251 HydrophobicContact CG2-CD2 3.89Å
215	V	97.6	Very high	96.1	Very high	11 Å²	11	61 Å²	61	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	141.3	-176.4	175.1	0	0	0	0	109.8	T164 F204 E205 P207 R217	T164-V215 WeakPolarHBondContact O-CA 3.5Å; F204-V215 WeakPolarHBondContact CA-O 3.24Å; E205-V215 HydrophobicContact CG-CB 4.33Å; E205-V215 PolarHBondContact N-O 3Å; E205-V215 PolarHBondContact O-N 3.36Å; P207-V215 HydrophobicContact CG-CB 4.33Å; P207-V215 HydrophobicContact CG-CG2 3.73Å; V215-R217 PolarHBondContact O-N 3.14Å
216	L	98.1	Very high	96.1	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	120.8	175.7	-174.7	66.6	0	0	0	110.6	T160 G163 T164 I166 T203 F204 K218 L220	T160-L216 HydrophobicContact CG2-CD2 3.96Å; T160-L216 VanDerWaalsContact O-CD2 3.27Å; T160-L216 WeakPolarHBondContact O-CD2 3.42Å; G163-L216 PolarHBondContact N-O 2.94Å; T164-L216 PolarHBondContact O-N 3.06Å; I166-L216 HydrophobicContact CG2-CB 4.02Å; T203-L216 HydrophobicContact CG2-CD1 4.21Å; F204-L216 HydrophobicContact CD1-CD1 4.08Å; F204-L216 HydrophobicContact CE1-CD1 3.65Å; F204-L216 HydrophobicContact CZ-CD1 4.33Å; L216-K218 VanDerWaalsContact CD1-O 3.24Å; L216-K218 WeakPolarHBondContact CD1-O 3.39Å; L216-K218 VanDerWaalsContact CG-O 3.27Å; L216-K218 WeakPolarHBondContact CG-O 3.46Å; L216-L220 HydrophobicContact CD1-CD1 4.02Å; L216-L220 HydrophobicContact CD1-CD2 3.89Å; L216-L220 HydrophobicContact CD1-CG 3.83Å; L216-L220 HydrophobicContact CD2-CD1 4.29Å; L216-L220 HydrophobicContact CD2-CG 4.29Å
217	R	97.1	Very high	96.1	Very high	111 Å²	111	64.9 Å²	64.9	42%	0.419	31%	0.312	S	S	.	.			trans	-102.4	-27.9	-173.7	-167.7	-176.8	-177.4	-138	-10.9	113.8	V162 D202 T203 E205 V215	V162-R217 WeakPolarHBondContact CG1-O 3.46Å; D202-R217 IonicContact OD1-NH1 2.79Å; D202-R217 PolarHBondContact OD1-NH1 2.77Å; T203-R217 WeakPolarHBondContact O-CA 3.42Å; T203-R217 VanDerWaalsContact O-CB 3.31Å; T203-R217 WeakPolarHBondContact O-CB 3.34Å; T203-R217 PolarHBondContact O-N 3.15Å; E205-R217 HydrophobicContact CG-CB 4.1Å; E205-R217 HydrophobicContact CG-CG 4.22Å; E205-R217 WeakPolarHBondContact OE2-CD 3.17Å; E205-R217 WeakPolarHBondContact OE2-CG 3.36Å; E205-R217 IonicContact OE2-NE 3.06Å; E205-R217 PolarHBondContact OE2-NE 3.38Å; E205-R217 VanDerWaalsContact OE2-NE 3.16Å; V215-R217 PolarHBondContact O-N 3.14Å
218	K	96.4	Very high	96.2	Very high	90 Å²	90	62 Å²	62	39%	0.391	29%	0.292	S	S	.	.	S	Bend	trans	-126.2	150.3	174.3	-69	-179.8	-177.2	177.2	0	110	D202 T203 L216	D202-K218 VanDerWaalsContact CG-NZ 3.35Å; D202-K218 VanDerWaalsContact O-CD 3.3Å; D202-K218 WeakPolarHBondContact O-CD 3.48Å; D202-K218 WeakPolarHBondContact O-CE 3.32Å; D202-K218 WeakPolarHBondContact O-CG 3.47Å; D202-K218 IonicContact OD2-NZ 3.43Å; D202-K218 PolarHBondContact OD2-NZ 3.14Å; T203-K218 HydrophobicContact CG2-CB 4.41Å; T203-K218 PolarHBondContact O-N 3.19Å; L216-K218 VanDerWaalsContact CD1-O 3.24Å; L216-K218 WeakPolarHBondContact CD1-O 3.39Å; L216-K218 VanDerWaalsContact CG-O 3.27Å; L216-K218 WeakPolarHBondContact CG-O 3.46Å
219	R	96.5	Very high	96.3	Very high	166 Å²	166	61.1 Å²	61.1	63%	0.626	28%	0.281	S	S	*	.			trans	-63.2	140.3	171.5	-178.8	174.8	174.4	-175.6	-2.7	108.7	V162 D260	V162-R219 HydrophobicContact CG2-CB 4.29Å; V162-R219 VanDerWaalsContact CG2-N 3.35Å; R219-D260 IonicContact CZ-OD2 3.8Å; R219-D260 IonicContact NH2-OD2 3.68Å; R219-D260 PolarHBondContact NH2-OD2 2.95Å
220	L	97.1	Very high	96.4	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	26%	0.259	C	S	.	.			trans	-88.6	160.4	176.6	-58.8	171.7	0	0	0	109.9	V156 E158 T203 F204 L216 Y228 V255	V156-L220 HydrophobicContact CB-CD1 4.04Å; V156-L220 HydrophobicContact CG1-CD1 3.62Å; E158-L220 HydrophobicContact CB-CB 3.98Å; T203-L220 HydrophobicContact CG2-CD2 3.61Å; F204-L220 HydrophobicContact CZ-CD2 4.39Å; L216-L220 HydrophobicContact CD1-CD1 4.02Å; L216-L220 HydrophobicContact CD1-CD2 3.89Å; L216-L220 HydrophobicContact CD1-CG 3.83Å; L216-L220 HydrophobicContact CD2-CD1 4.29Å; L216-L220 HydrophobicContact CD2-CG 4.29Å; L220-Y228 HydrophobicContact CD2-CE2 3.89Å; L220-V255 HydrophobicContact CB-CG1 4.24Å; L220-V255 HydrophobicContact CD1-CG1 4.19Å; L220-V255 HydrophobicContact CD1-CG2 4.14Å; L220-V255 HydrophobicContact CD2-CG2 4.36Å
221	N	96.4	Very high	96.6	Very high	38 Å²	38	53 Å²	53	20%	0.203	24%	0.239	C	C	.	.			trans	-146.4	127.1	165.4	171.9	-103.9	0	0	0	108.1	E158 E223 D224 K225	E158-N221 VanDerWaalsContact OE2-CA 3.29Å; E158-N221 WeakPolarHBondContact OE2-CA 3.31Å; N221-E223 PolarHBondContact ND2-OE2 2.74Å; N221-E223 PolarHBondContact OD1-N 3.41Å; N221-E223 PolarHBondContact OD1-OE2 3.39Å; N221-D224 HydrophobicContact CB-CB 4.3Å; N221-D224 PolarHBondContact O-N 3.19Å; N221-D224 WeakPolarHBondContact OD1-CB 3.3Å; N221-D224 VanDerWaalsContact OD1-CG 3.23Å; N221-D224 PolarHBondContact OD1-N 3.09Å; N221-D224 PolarHBondContact OD1-OD1 3.29Å; N221-K225 PolarHBondContact O-N 2.67Å; N221-K225 VanDerWaalsContact O-N 3.13Å
222	Y	96.9	Very high	96.7	Very high	45 Å²	45	50.6 Å²	50.6	18%	0.176	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-33.2	-172.6	-177.8	-95.3	0	0	0	111.9	E158 D224 T226 V255 D257 N312	E158-Y222 WeakPolarHBondContact OE1-CB 3.45Å; E158-Y222 WeakPolarHBondContact OE2-CB 3.43Å; E158-Y222 PolarHBondContact OE2-N 3.34Å; Y222-D224 PolarHBondContact O-N 3.19Å; Y222-T226 HydrophobicContact CD1-CG2 4.23Å; Y222-T226 HydrophobicContact CD2-CG2 3.6Å; Y222-T226 HydrophobicContact CE1-CG2 4.12Å; Y222-T226 HydrophobicContact CE2-CG2 3.47Å; Y222-T226 VanDerWaalsContact CE2-CG2 3.47Å; Y222-T226 HydrophobicContact CG-CG2 3.96Å; Y222-T226 WeakPolarHBondContact O-CG2 3.41Å; Y222-V255 HydrophobicContact CD2-CB 4.26Å; Y222-V255 HydrophobicContact CD2-CG1 4.21Å; Y222-V255 WeakPolarHBondContact CD2-O 3.14Å; Y222-V255 WeakPolarHBondContact CE2-O 3.09Å; Y222-D257 HydrophobicContact CD1-CB 3.83Å; Y222-D257 WeakPolarHBondContact CD1-OD2 3.26Å; Y222-D257 HydrophobicContact CD2-CB 3.95Å; Y222-D257 HydrophobicContact CE1-CB 3.74Å; Y222-D257 WeakPolarHBondContact CE1-OD2 3.25Å; Y222-D257 HydrophobicContact CE2-CB 3.87Å; Y222-D257 HydrophobicContact CG-CB 3.95Å; Y222-N312 HydrophobicContact CE1-CB 4.41Å; Y222-N312 WeakPolarHBondContact OH-CB 3.31Å; Y222-N312 PolarHBondContact OH-ND2 2.81Å
223	E	94.2	Very high	96.9	Very high	60 Å²	60	52.4 Å²	52.4	28%	0.28	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.5	177.7	-62.6	57.7	-106.6	0	0	112.7	N221 L261 R275	N221-E223 PolarHBondContact ND2-OE2 2.74Å; N221-E223 PolarHBondContact OD1-N 3.41Å; N221-E223 PolarHBondContact OD1-OE2 3.39Å; E223-L261 HydrophobicContact CG-CD1 4.26Å; E223-R275 PolarHBondContact O-NH2 2.88Å
224	D	94	Very high	96.9	Very high	113 Å²	113	50.3 Å²	50.3	60%	0.604	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-49.3	177.1	-78	-2	0	0	0	112.2	N221 Y222 R275	N221-D224 HydrophobicContact CB-CB 4.3Å; N221-D224 PolarHBondContact O-N 3.19Å; N221-D224 WeakPolarHBondContact OD1-CB 3.3Å; N221-D224 VanDerWaalsContact OD1-CG 3.23Å; N221-D224 PolarHBondContact OD1-N 3.09Å; N221-D224 PolarHBondContact OD1-OD1 3.29Å; Y222-D224 PolarHBondContact O-N 3.19Å; D224-R275 IonicContact OD1-CZ 3.34Å; D224-R275 IonicContact OD1-NH1 2.71Å; D224-R275 PolarHBondContact OD1-NH1 3.35Å; D224-R275 IonicContact OD1-NH2 3.35Å; D224-R275 PolarHBondContact OD1-NH2 3.28Å
225	K	95.4	Very high	96.8	Very high	57 Å²	57	51.1 Å²	51.1	25%	0.248	23%	0.226	C	C	.	.			trans	-158.3	110.4	-177.1	-175.4	166.9	157.9	73.1	0	113.7	D197 T199 N221 R227 Y228 V255	D197-K225 WeakPolarHBondContact OD1-CE 3.44Å; D197-K225 IonicContact OD1-NZ 2.76Å; D197-K225 PolarHBondContact OD1-NZ 2.76Å; D197-K225 WeakPolarHBondContact OD2-CE 3.27Å; D197-K225 IonicContact OD2-NZ 3.23Å; D197-K225 PolarHBondContact OD2-NZ 2.79Å; T199-K225 WeakPolarHBondContact OG1-CE 3.42Å; N221-K225 PolarHBondContact O-N 2.67Å; N221-K225 VanDerWaalsContact O-N 3.13Å; K225-R227 WeakPolarHBondContact CE-O 3.23Å; K225-R227 PolarHBondContact NZ-O 2.9Å; K225-Y228 HydrophobicContact CB-CE2 4.29Å; K225-Y228 HydrophobicContact CD-CD1 4.15Å; K225-Y228 HydrophobicContact CD-CE1 3.69Å; K225-Y228 HydrophobicContact CD-CE2 4.09Å; K225-Y228 HydrophobicContact CG-CD2 4.34Å; K225-Y228 HydrophobicContact CG-CE1 4.38Å; K225-Y228 HydrophobicContact CG-CE2 3.86Å; K225-V255 WeakPolarHBondContact O-CG2 3.33Å
226	T	96.7	Very high	96.7	Very high	67 Å²	67	50.6 Å²	50.6	41%	0.411	22%	0.223	S	C	.	.	S	Bend	trans	-87.1	-13.5	-176.5	60	0	0	0	0	115.8	Y222 V255	Y222-T226 HydrophobicContact CD1-CG2 4.23Å; Y222-T226 HydrophobicContact CD2-CG2 3.6Å; Y222-T226 HydrophobicContact CE1-CG2 4.12Å; Y222-T226 HydrophobicContact CE2-CG2 3.47Å; Y222-T226 VanDerWaalsContact CE2-CG2 3.47Å; Y222-T226 HydrophobicContact CG-CG2 3.96Å; Y222-T226 WeakPolarHBondContact O-CG2 3.41Å; T226-V255 PolarHBondContact O-N 2.75Å
227	R	97.7	Very high	96.6	Very high	106 Å²	106	54.3 Å²	54.3	40%	0.4	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	136.3	-178	177.6	170.1	-71	-179	-4.4	112.5	K225 Y229 T252 V253 D254	K225-R227 WeakPolarHBondContact CE-O 3.23Å; K225-R227 PolarHBondContact NZ-O 2.9Å; R227-Y229 VanDerWaalsContact CD-OH 3.24Å; R227-Y229 WeakPolarHBondContact CD-OH 3.14Å; R227-Y229 HydrophobicContact CG-CE1 4.41Å; R227-Y229 HydrophobicContact CG-CE2 4.24Å; R227-T252 HydrophobicContact CG-CG2 4.07Å; R227-V253 WeakPolarHBondContact CA-O 3.38Å; R227-D254 WeakPolarHBondContact CG-OD1 3.17Å; R227-D254 IonicContact CZ-OD1 3.47Å; R227-D254 IonicContact CZ-OD2 3.16Å; R227-D254 IonicContact NE-OD1 3.49Å; R227-D254 PolarHBondContact NE-OD1 2.93Å; R227-D254 IonicContact NE-OD2 3.59Å; R227-D254 IonicContact NH2-OD1 2.77Å; R227-D254 PolarHBondContact NH2-OD1 3.18Å; R227-D254 IonicContact NH2-OD2 2.72Å; R227-D254 PolarHBondContact NH2-OD2 2.67Å
228	Y	98	Very high	96.4	Very high	18 Å²	18	49.1 Å²	49.1	7%	0.071	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.1	175.2	-67	-103.5	0	0	0	112.3	D197 T203 F204 L220 K225 T252 V253 V255	D197-Y228 WeakPolarHBondContact OD2-CA 3.5Å; T203-Y228 HydrophobicContact CG2-CE1 3.89Å; T203-Y228 WeakPolarHBondContact OG1-CE1 3.5Å; F204-Y228 AromaticContact CE2-CD1 3.82Å; F204-Y228 HydrophobicContact CE2-CD1 3.82Å; F204-Y228 HydrophobicContact CE2-CD2 4.08Å; F204-Y228 HydrophobicContact CE2-CE1 4.41Å; F204-Y228 AromaticContact CE2-CG 3.63Å; F204-Y228 HydrophobicContact CE2-CG 3.63Å; F204-Y228 HydrophobicContact CZ-CD2 4.31Å; F204-Y228 HydrophobicContact CZ-CG 4.29Å; L220-Y228 HydrophobicContact CD2-CE2 3.89Å; K225-Y228 HydrophobicContact CB-CE2 4.29Å; K225-Y228 HydrophobicContact CD-CD1 4.15Å; K225-Y228 HydrophobicContact CD-CE1 3.69Å; K225-Y228 HydrophobicContact CD-CE2 4.09Å; K225-Y228 HydrophobicContact CG-CD2 4.34Å; K225-Y228 HydrophobicContact CG-CE1 4.38Å; K225-Y228 HydrophobicContact CG-CE2 3.86Å; Y228-T252 WeakPolarHBondContact O-CA 3.49Å; Y228-V253 PolarHBondContact N-O 2.84Å; Y228-V253 PolarHBondContact O-N 3.23Å; Y228-V255 HydrophobicContact CD2-CG2 4.14Å; Y228-V255 HydrophobicContact CE2-CG2 3.9Å
229	Y	98	Very high	96.2	Very high	95 Å²	95	53.3 Å²	53.3	37%	0.373	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	93.7	174.9	-62.1	-74.1	0	0	0	110.2	N194 D197 R227 T250 T252	N194-Y229 PolarHBondContact ND2-O 2.98Å; D197-Y229 PolarHBondContact OD2-N 3.12Å; R227-Y229 VanDerWaalsContact CD-OH 3.24Å; R227-Y229 WeakPolarHBondContact CD-OH 3.14Å; R227-Y229 HydrophobicContact CG-CE1 4.41Å; R227-Y229 HydrophobicContact CG-CE2 4.24Å; Y229-T250 HydrophobicContact CD1-CG2 4.19Å; Y229-T252 HydrophobicContact CD1-CG2 4.37Å; Y229-T252 HydrophobicContact CE1-CG2 4.1Å
230	V	97.6	Very high	95.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	115.1	-177.5	-171.9	0	0	0	0	109.1	I191 F204 I232 T250 L251 V253	I191-V230 HydrophobicContact CB-CG1 4.38Å; I191-V230 HydrophobicContact CD1-CG1 3.71Å; I191-V230 HydrophobicContact CG1-CG1 3.75Å; I191-V230 HydrophobicContact CG2-CG1 3.72Å; F204-V230 HydrophobicContact CB-CG2 4.41Å; F204-V230 HydrophobicContact CD2-CG2 3.51Å; F204-V230 HydrophobicContact CE2-CG2 4.05Å; F204-V230 HydrophobicContact CG-CG2 4.12Å; V230-I232 HydrophobicContact CG1-CD1 4.34Å; V230-I232 HydrophobicContact CG1-CG1 3.97Å; V230-T250 WeakPolarHBondContact O-CA 3.27Å; V230-L251 HydrophobicContact CB-CB 4.28Å; V230-L251 PolarHBondContact N-O 3.36Å; V230-L251 PolarHBondContact O-N 3.07Å; V230-V253 HydrophobicContact CG2-CG2 4.12Å
231	I	97.6	Very high	95.6	Very high	37 Å²	37	54.4 Å²	54.4	19%	0.19	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.4	172.4	-61.1	177.8	0	0	0	108.4	I191 Q192 N194 T248	I191-I231 WeakPolarHBondContact CA-O 3.38Å; Q192-I231 HydrophobicContact CB-CB 4.26Å; Q192-I231 HydrophobicContact CB-CG2 3.99Å; Q192-I231 PolarHBondContact N-O 2.77Å; N194-I231 HydrophobicContact CB-CD1 3.78Å; N194-I231 HydrophobicContact CB-CG1 3.95Å; I231-T248 HydrophobicContact CG2-CG2 4.1Å
232	I	97.6	Very high	95.5	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.5	180	-58.5	178.3	0	0	0	108.3	F170 Y189 I191 I206 V214 V230 T248 T249 L251	F170-I232 HydrophobicContact CE2-CD1 3.77Å; F170-I232 HydrophobicContact CE2-CG2 3.87Å; F170-I232 HydrophobicContact CZ-CB 4.34Å; F170-I232 HydrophobicContact CZ-CD1 3.69Å; F170-I232 HydrophobicContact CZ-CG2 3.98Å; Y189-I232 HydrophobicContact CD1-CG2 4.22Å; I191-I232 HydrophobicContact CG1-CG1 4.14Å; I206-I232 HydrophobicContact CD1-CG2 4.05Å; V214-I232 HydrophobicContact CG2-CD1 3.89Å; V230-I232 HydrophobicContact CG1-CD1 4.34Å; V230-I232 HydrophobicContact CG1-CG1 3.97Å; I232-T248 CarbonylContact O-C 3.59Å; I232-T248 VanDerWaalsContact O-CA 3.32Å; I232-T248 WeakPolarHBondContact O-CA 3.47Å; I232-T249 HydrophobicContact CB-CG2 4.22Å; I232-T249 PolarHBondContact N-O 2.93Å; I232-T249 PolarHBondContact O-N 3.41Å; I232-L251 HydrophobicContact CD1-CB 3.74Å; I232-L251 HydrophobicContact CD1-CD2 3.9Å; I232-L251 HydrophobicContact CD1-CG 4.48Å
233	Q	97.1	Very high	95.3	Very high	39 Å²	39	62.3 Å²	62.3	18%	0.182	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.5	175.3	-172.8	179.3	43.9	0	0	109.5	Y189 V190 Q192 T246 T247 T248	Y189-Q233 WeakPolarHBondContact CA-O 3.45Å; V190-Q233 PolarHBondContact N-O 2.84Å; V190-Q233 PolarHBondContact O-N 3.29Å; Q192-Q233 HydrophobicContact CG-CB 3.85Å; Q233-T246 HydrophobicContact CG-CG2 4.36Å; Q233-T246 PolarHBondContact NE2-OG1 2.97Å; Q233-T247 CarbonylContact C-O 3.55Å; Q233-T247 WeakPolarHBondContact CA-O 2.93Å; Q233-T248 HydrophobicContact CB-CG2 3.96Å; Q233-T248 HydrophobicContact CG-CG2 4.09Å
234	A	97.2	Very high	95.3	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.8	159.3	0	0	0	0	0	107.9	P145 F147 A176 I187 Y189 T246 T247	P145-A234 HydrophobicContact CB-CB 3.83Å; F147-A234 HydrophobicContact CE1-CB 4.49Å; F147-A234 HydrophobicContact CE2-CB 3.77Å; F147-A234 HydrophobicContact CZ-CB 3.67Å; A176-A234 HydrophobicContact CB-CB 3.46Å; A176-A234 VanDerWaalsContact CB-CB 3.46Å; I187-A234 HydrophobicContact CG2-CB 3.8Å; Y189-A234 HydrophobicContact CD1-CB 4.19Å; Y189-A234 HydrophobicContact CE1-CB 4.12Å; A234-T246 CarbonylContact O-C 3.55Å; A234-T246 VanDerWaalsContact O-CA 3.23Å; A234-T246 WeakPolarHBondContact O-CA 3.31Å; A234-T247 PolarHBondContact N-O 3.3Å; A234-T247 PolarHBondContact O-N 3.07Å
235	N	95.7	Very high	95.4	Very high	17 Å²	17	61.6 Å²	61.6	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.3	170.6	71.4	119	0	0	0	109.5	E188 R244 R245 T246	E188-N235 WeakPolarHBondContact CB-ND2 3.02Å; E188-N235 PolarHBondContact N-O 3.05Å; E188-N235 PolarHBondContact O-N 2.88Å; E188-N235 PolarHBondContact O-ND2 2.9Å; N235-R244 PolarHBondContact OD1-NH1 2.87Å; N235-R245 WeakPolarHBondContact CA-O 3.43Å; N235-T246 HydrophobicContact CB-CG2 3.71Å
236	D	95.9	Very high	95.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	175	170	66.4	60.2	0	0	0	111.4	N141 P145 N184 Q186 A238 R244 R245	N141-D236 VanDerWaalsContact ND2-CG 3.33Å; N141-D236 PolarHBondContact ND2-OD2 3.29Å; N141-D236 PolarHBondContact OD1-OD2 3.47Å; P145-D236 HydrophobicContact CG-CB 4.38Å; N184-D236 VanDerWaalsContact O-CB 3.23Å; N184-D236 WeakPolarHBondContact O-CB 3.42Å; Q186-D236 CarbonylContact O-C 3.55Å; Q186-D236 VanDerWaalsContact O-CA 3.28Å; Q186-D236 WeakPolarHBondContact O-CA 3.4Å; D236-A238 WeakPolarHBondContact OD1-CB 3.38Å; D236-A238 PolarHBondContact OD1-N 2.78Å; D236-R244 WeakPolarHBondContact O-CD 3.46Å; D236-R244 PolarHBondContact O-NE 2.7Å; D236-R244 PolarHBondContact O-NH1 3.48Å; D236-R244 WeakPolarHBondContact OD1-CA 3.26Å; D236-R244 WeakPolarHBondContact OD1-CG 3.41Å; D236-R245 PolarHBondContact N-O 2.87Å; D236-R245 WeakPolarHBondContact OD2-CA 3.46Å; D236-R245 WeakPolarHBondContact OD2-CB 3.18Å; D236-R245 PolarHBondContact OD2-N 3.05Å
237	R	95.1	Very high	95.4	Very high	79 Å²	79	61.2 Å²	61.2	30%	0.298	29%	0.287	S	S	.	.			trans	-111.1	32.2	178.6	-56.7	173.7	82.7	-113.7	-13	112.6	P183 Q186 E188 Q239	P183-R237 HydrophobicContact CB-CB 4.35Å; P183-R237 VanDerWaalsContact CB-O 3.3Å; P183-R237 WeakPolarHBondContact CB-O 3.3Å; P183-R237 CarbonylContact O-C 3.29Å; P183-R237 VanDerWaalsContact O-C 3.24Å; P183-R237 VanDerWaalsContact O-CA 3.23Å; P183-R237 WeakPolarHBondContact O-CA 3.07Å; P183-R237 VanDerWaalsContact O-CB 3.25Å; P183-R237 WeakPolarHBondContact O-CB 3.48Å; P183-R237 PolarHBondContact O-N 2.8Å; Q186-R237 HydrophobicContact CB-CB 4.29Å; Q186-R237 HydrophobicContact CB-CG 4.08Å; Q186-R237 WeakPolarHBondContact O-CG 3.38Å; Q186-R237 PolarHBondContact O-N 2.86Å; Q186-R237 VanDerWaalsContact O-N 3.12Å; E188-R237 HydrophobicContact CB-CG 4.49Å; E188-R237 HydrophobicContact CG-CG 3.77Å; E188-R237 IonicContact OE1-CZ 2.67Å; E188-R237 IonicContact OE1-NE 3.46Å; E188-R237 PolarHBondContact OE1-NE 2.88Å; E188-R237 IonicContact OE1-NH2 2.81Å; E188-R237 PolarHBondContact OE1-NH2 2.84Å; R237-Q239 PolarHBondContact O-N 2.96Å
238	A	94	Very high	95.3	Very high	2 Å²	2	60.1 Å²	60.1	2%	0.017	29%	0.293	C	S	.	.			trans	-48.6	138	173.9	0	0	0	0	0	111.3	N141 N184 D236 N240 E243 R244	N141-A238 HydrophobicContact CB-CB 4.08Å; N184-A238 WeakPolarHBondContact OD1-CA 3.43Å; D236-A238 WeakPolarHBondContact OD1-CB 3.38Å; D236-A238 PolarHBondContact OD1-N 2.78Å; A238-N240 VanDerWaalsContact C-N 3.26Å; A238-N240 PolarHBondContact O-N 2.8Å; A238-E243 HydrophobicContact CB-CB 4.43Å; A238-R244 HydrophobicContact CB-CG 3.91Å; A238-R244 PolarHBondContact O-NE 2.61Å
239	Q	91.8	Very high	95.3	Very high	178 Å²	178	59.5 Å²	59.5	83%	0.832	29%	0.291	S	S	*	.	S	Bend	trans	-65.8	-31.6	-172.8	-64.4	-172.4	4.3	0	0	112.3	R237	R237-Q239 PolarHBondContact O-N 2.96Å
240	N	90.7	Very high	95.3	Very high	60 Å²	60	57.5 Å²	57.5	32%	0.321	29%	0.288	S	S	.	.	S	Bend	trans	-91.7	116.7	172.1	-178.3	2.4	0	0	0	109.2	A238 N242 E243 R244	A238-N240 VanDerWaalsContact C-N 3.26Å; A238-N240 PolarHBondContact O-N 2.8Å; N240-N242 PolarHBondContact O-N 2.85Å; N240-N242 PolarHBondContact OD1-N 3.36Å; N240-N242 VanDerWaalsContact OD1-N 3.15Å; N240-E243 HydrophobicContact CB-CB 4.12Å; N240-E243 HydrophobicContact CB-CG 4.09Å; N240-E243 VanDerWaalsContact ND2-CD 3.33Å; N240-E243 PolarHBondContact ND2-OE1 3.15Å; N240-E243 PolarHBondContact O-N 3.12Å; N240-R244 PolarHBondContact O-N 3.46Å
241	L	90.7	Very high	95.3	Very high	132 Å²	132	57.5 Å²	57.5	69%	0.691	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.1	179.8	-65.2	175.7	0	0	0	113.7
242	N	92.8	Very high	95.3	Very high	154 Å²	154	56.9 Å²	56.9	82%	0.824	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.5	177	-59.9	-44.4	0	0	0	113.5	N240	N240-N242 PolarHBondContact O-N 2.85Å; N240-N242 PolarHBondContact OD1-N 3.36Å; N240-N242 VanDerWaalsContact OD1-N 3.15Å
243	E	93	Very high	95.3	Very high	95 Å²	95	56.9 Å²	56.9	44%	0.444	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-15.8	175.9	-72.7	164.1	-149.3	0	0	111.8	N141 A238 N240 R245	N141-E243 PolarHBondContact ND2-O 3.31Å; A238-E243 HydrophobicContact CB-CB 4.43Å; N240-E243 HydrophobicContact CB-CB 4.12Å; N240-E243 HydrophobicContact CB-CG 4.09Å; N240-E243 VanDerWaalsContact ND2-CD 3.33Å; N240-E243 PolarHBondContact ND2-OE1 3.15Å; N240-E243 PolarHBondContact O-N 3.12Å; E243-R245 PolarHBondContact O-N 3.34Å
244	R	94.4	Very high	95.4	Very high	65 Å²	65	56.1 Å²	56.1	25%	0.245	28%	0.284	C	S	.	.			trans	-57	130.3	173.3	-70.4	-165.3	175.1	-155	-2	111.3	E188 N235 D236 A238 N240	E188-R244 IonicContact OE2-CZ 2.72Å; E188-R244 IonicContact OE2-NH1 3.13Å; E188-R244 PolarHBondContact OE2-NH1 2.76Å; E188-R244 IonicContact OE2-NH2 2.93Å; E188-R244 PolarHBondContact OE2-NH2 3.15Å; N235-R244 PolarHBondContact OD1-NH1 2.87Å; D236-R244 WeakPolarHBondContact O-CD 3.46Å; D236-R244 PolarHBondContact O-NE 2.7Å; D236-R244 PolarHBondContact O-NH1 3.48Å; D236-R244 WeakPolarHBondContact OD1-CA 3.26Å; D236-R244 WeakPolarHBondContact OD1-CG 3.41Å; A238-R244 HydrophobicContact CB-CG 3.91Å; A238-R244 PolarHBondContact O-NE 2.61Å; N240-R244 PolarHBondContact O-N 3.46Å
245	R	95.9	Very high	95.4	Very high	93 Å²	93	56.4 Å²	56.4	35%	0.351	29%	0.285	S	S	.	.			trans	-109.4	155.2	176.6	-66.8	160.6	166.5	-117.7	11.5	109.1	N141 D142 N143 S144 N235 D236 E243	N141-R245 PolarHBondContact O-NE 2.71Å; D142-R245 VanDerWaalsContact C-CZ 3.47Å; D142-R245 VanDerWaalsContact CA-NH2 3.3Å; D142-R245 PolarHBondContact O-NH1 2.63Å; D142-R245 PolarHBondContact O-NH2 3.17Å; N143-R245 WeakPolarHBondContact O-CD 2.84Å; S144-R245 WeakPolarHBondContact OG-CD 3.25Å; S144-R245 PolarHBondContact OG-NH1 2.86Å; S144-R245 VanDerWaalsContact OG-NH1 3.09Å; N235-R245 WeakPolarHBondContact CA-O 3.43Å; D236-R245 PolarHBondContact N-O 2.87Å; D236-R245 WeakPolarHBondContact OD2-CA 3.46Å; D236-R245 WeakPolarHBondContact OD2-CB 3.18Å; D236-R245 PolarHBondContact OD2-N 3.05Å; E243-R245 PolarHBondContact O-N 3.34Å
246	T	95.7	Very high	95.4	Very high	68 Å²	68	58.8 Å²	58.8	42%	0.417	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	144.7	-171.1	78	0	0	0	0	111.3	Q233 A234 N235	Q233-T246 HydrophobicContact CG-CG2 4.36Å; Q233-T246 PolarHBondContact NE2-OG1 2.97Å; A234-T246 CarbonylContact O-C 3.55Å; A234-T246 VanDerWaalsContact O-CA 3.23Å; A234-T246 WeakPolarHBondContact O-CA 3.31Å; N235-T246 HydrophobicContact CB-CG2 3.71Å
247	T	96.7	Very high	95.5	Very high	47 Å²	47	59 Å²	59	29%	0.288	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.6	173	-59.7	0	0	0	0	108.8	P145 F147 Q233 A234	P145-T247 WeakPolarHBondContact O-CB 3.15Å; P145-T247 WeakPolarHBondContact O-CG2 3.22Å; P145-T247 PolarHBondContact O-OG1 3.45Å; F147-T247 HydrophobicContact CD2-CG2 4.04Å; Q233-T247 CarbonylContact C-O 3.55Å; Q233-T247 WeakPolarHBondContact CA-O 2.93Å; A234-T247 PolarHBondContact N-O 3.3Å; A234-T247 PolarHBondContact O-N 3.07Å
248	T	96.9	Very high	95.5	Very high	83 Å²	83	55.4 Å²	55.4	51%	0.509	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	147.6	179.8	49.7	0	0	0	0	111.9	I231 I232 Q233	I231-T248 HydrophobicContact CG2-CG2 4.1Å; I232-T248 CarbonylContact O-C 3.59Å; I232-T248 VanDerWaalsContact O-CA 3.32Å; I232-T248 WeakPolarHBondContact O-CA 3.47Å; Q233-T248 HydrophobicContact CB-CG2 3.96Å; Q233-T248 HydrophobicContact CG-CG2 4.09Å
249	T	97.1	Very high	95.5	Very high	6 Å²	6	56.9 Å²	56.9	4%	0.037	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	165.4	166.2	-169.8	0	0	0	0	109.5	F147 E150 Y152 F170 I232	F147-T249 HydrophobicContact CD1-CG2 3.81Å; F147-T249 HydrophobicContact CD2-CG2 4.04Å; F147-T249 HydrophobicContact CE1-CG2 3.49Å; F147-T249 VanDerWaalsContact CE1-CG2 3.49Å; F147-T249 HydrophobicContact CE2-CG2 3.74Å; F147-T249 HydrophobicContact CG-CG2 4.07Å; F147-T249 HydrophobicContact CZ-CG2 3.46Å; F147-T249 VanDerWaalsContact CZ-CG2 3.46Å; E150-T249 PolarHBondContact O-OG1 3.24Å; E150-T249 VanDerWaalsContact O-OG1 3.05Å; Y152-T249 HydrophobicContact CD2-CG2 3.73Å; Y152-T249 WeakPolarHBondContact CD2-OG1 3.49Å; Y152-T249 HydrophobicContact CE2-CG2 3.81Å; F170-T249 HydrophobicContact CE1-CG2 4.41Å; F170-T249 HydrophobicContact CZ-CG2 4.32Å; I232-T249 HydrophobicContact CB-CG2 4.22Å; I232-T249 PolarHBondContact N-O 2.93Å; I232-T249 PolarHBondContact O-N 3.41Å
250	T	97.3	Very high	95.7	Very high	52 Å²	52	50.3 Å²	50.3	32%	0.319	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.2	171.3	-55.6	0	0	0	0	109.7	Y152 Y229 V230	Y152-T250 PolarHBondContact N-O 3.15Å; Y229-T250 HydrophobicContact CD1-CG2 4.19Å; V230-T250 WeakPolarHBondContact O-CA 3.27Å
251	L	98	Very high	95.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	111.4	163.3	170.8	64	0	0	0	108.1	Y152 A154 F167 V214 V230 I232 V253	Y152-L251 WeakPolarHBondContact O-CA 3.44Å; A154-L251 HydrophobicContact CB-CD1 4.08Å; F167-L251 HydrophobicContact CB-CD2 4.16Å; F167-L251 HydrophobicContact CD1-CD2 4Å; F167-L251 HydrophobicContact CD2-CD1 3.86Å; F167-L251 HydrophobicContact CD2-CD2 4.48Å; F167-L251 HydrophobicContact CE1-CD2 4.49Å; F167-L251 HydrophobicContact CE2-CD1 3.88Å; F167-L251 HydrophobicContact CG-CD1 4.19Å; F167-L251 HydrophobicContact CG-CD2 3.98Å; F167-L251 HydrophobicContact CZ-CD1 4.24Å; V214-L251 HydrophobicContact CB-CD2 4.4Å; V214-L251 HydrophobicContact CG2-CD2 3.89Å; V230-L251 HydrophobicContact CB-CB 4.28Å; V230-L251 PolarHBondContact N-O 3.36Å; V230-L251 PolarHBondContact O-N 3.07Å; I232-L251 HydrophobicContact CD1-CB 3.74Å; I232-L251 HydrophobicContact CD1-CD2 3.9Å; I232-L251 HydrophobicContact CD1-CG 4.48Å; L251-V253 HydrophobicContact CD2-CG2 4.09Å; L251-V253 HydrophobicContact CG-CG2 3.85Å
252	T	98	Very high	96.1	Very high	24 Å²	24	44.1 Å²	44.1	15%	0.147	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.7	169.2	-63.4	0	0	0	0	108.9	Y152 Y153 A154 R227 Y228 Y229	Y152-T252 PolarHBondContact O-N 3.44Å; Y153-T252 WeakPolarHBondContact CA-O 3.4Å; Y153-T252 HydrophobicContact CD2-CG2 4.18Å; Y153-T252 HydrophobicContact CE2-CG2 4.35Å; A154-T252 PolarHBondContact N-O 2.87Å; R227-T252 HydrophobicContact CG-CG2 4.07Å; Y228-T252 WeakPolarHBondContact O-CA 3.49Å; Y229-T252 HydrophobicContact CD1-CG2 4.37Å; Y229-T252 HydrophobicContact CE1-CG2 4.1Å
253	V	98	Very high	96.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.9	176.7	-170.6	0	0	0	0	108.9	A154 V156 F204 R227 Y228 V230 L251	A154-V253 HydrophobicContact CB-CG2 4.48Å; A154-V253 WeakPolarHBondContact O-CA 3.39Å; V156-V253 HydrophobicContact CB-CG1 4.34Å; V156-V253 HydrophobicContact CG2-CG1 3.61Å; F204-V253 HydrophobicContact CE1-CG1 4.1Å; F204-V253 HydrophobicContact CE1-CG2 4.46Å; F204-V253 HydrophobicContact CE2-CB 4.42Å; F204-V253 HydrophobicContact CE2-CG2 4.4Å; F204-V253 HydrophobicContact CZ-CB 4.02Å; F204-V253 HydrophobicContact CZ-CG1 3.78Å; F204-V253 HydrophobicContact CZ-CG2 4.18Å; R227-V253 WeakPolarHBondContact CA-O 3.38Å; Y228-V253 PolarHBondContact N-O 2.84Å; Y228-V253 PolarHBondContact O-N 3.23Å; V230-V253 HydrophobicContact CG2-CG2 4.12Å; L251-V253 HydrophobicContact CD2-CG2 4.09Å; L251-V253 HydrophobicContact CG-CG2 3.85Å
254	D	97.8	Very high	96.4	Very high	23 Å²	23	33.8 Å²	33.8	12%	0.123	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.8	173.1	-77.4	2.5	0	0	0	110.1	Y153 A154 T155 V156 R227	Y153-D254 HydrophobicContact CE2-CB 4.23Å; Y153-D254 PolarHBondContact OH-OD2 3.11Å; A154-D254 PolarHBondContact O-N 2.89Å; T155-D254 CarbonylContact C-O 3.55Å; T155-D254 VanDerWaalsContact CA-O 3.3Å; T155-D254 WeakPolarHBondContact CA-O 3.42Å; T155-D254 HydrophobicContact CG2-CB 4.42Å; V156-D254 PolarHBondContact N-O 3.09Å; R227-D254 WeakPolarHBondContact CG-OD1 3.17Å; R227-D254 IonicContact CZ-OD1 3.47Å; R227-D254 IonicContact CZ-OD2 3.16Å; R227-D254 IonicContact NE-OD1 3.49Å; R227-D254 PolarHBondContact NE-OD1 2.93Å; R227-D254 IonicContact NE-OD2 3.59Å; R227-D254 IonicContact NH2-OD1 2.77Å; R227-D254 PolarHBondContact NH2-OD1 3.18Å; R227-D254 IonicContact NH2-OD2 2.72Å; R227-D254 PolarHBondContact NH2-OD2 2.67Å
255	V	97.5	Very high	96.5	Very high	6 Å²	6	31.3 Å²	31.3	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.9	172.9	-171.4	0	0	0	0	108.2	V156 E158 L220 Y222 K225 T226 Y228	V156-V255 CarbonylContact O-C 3.57Å; V156-V255 VanDerWaalsContact O-CA 3.25Å; V156-V255 WeakPolarHBondContact O-CA 3.05Å; E158-V255 HydrophobicContact CB-CG1 3.74Å; L220-V255 HydrophobicContact CB-CG1 4.24Å; L220-V255 HydrophobicContact CD1-CG1 4.19Å; L220-V255 HydrophobicContact CD1-CG2 4.14Å; L220-V255 HydrophobicContact CD2-CG2 4.36Å; Y222-V255 HydrophobicContact CD2-CB 4.26Å; Y222-V255 HydrophobicContact CD2-CG1 4.21Å; Y222-V255 WeakPolarHBondContact CD2-O 3.14Å; Y222-V255 WeakPolarHBondContact CE2-O 3.09Å; K225-V255 WeakPolarHBondContact O-CG2 3.33Å; T226-V255 PolarHBondContact O-N 2.75Å; Y228-V255 HydrophobicContact CD2-CG2 4.14Å; Y228-V255 HydrophobicContact CE2-CG2 3.9Å
256	L	96.6	Very high	96.5	Very high	67 Å²	67	28.7 Å²	28.7	35%	0.351	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.2	171.3	-52.5	178.3	0	0	0	108.9	T155 V156 N157 E158 G258	T155-L256 HydrophobicContact CG2-CD2 4.25Å; V156-L256 PolarHBondContact O-N 3.06Å; N157-L256 WeakPolarHBondContact CA-O 3.24Å; N157-L256 HydrophobicContact CB-CB 4.35Å; N157-L256 PolarHBondContact ND2-O 2.91Å; E158-L256 PolarHBondContact N-O 2.76Å; L256-G258 PolarHBondContact O-N 2.86Å
257	D	97.1	Very high	96.5	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.027	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-48.6	124.6	169.5	-159.7	-33.2	0	0	0	109.7	N157 E158 Y222 D310 R311 N312	N157-D257 PolarHBondContact ND2-O 2.89Å; E158-D257 WeakPolarHBondContact OE1-CA 3.48Å; Y222-D257 HydrophobicContact CD1-CB 3.83Å; Y222-D257 WeakPolarHBondContact CD1-OD2 3.26Å; Y222-D257 HydrophobicContact CD2-CB 3.95Å; Y222-D257 HydrophobicContact CE1-CB 3.74Å; Y222-D257 WeakPolarHBondContact CE1-OD2 3.25Å; Y222-D257 HydrophobicContact CE2-CB 3.87Å; Y222-D257 HydrophobicContact CG-CB 3.95Å; D257-D310 WeakPolarHBondContact OD1-CB 3.4Å; D257-R311 PolarHBondContact OD2-N 2.79Å; D257-N312 HydrophobicContact CB-CB 4.2Å; D257-N312 WeakPolarHBondContact OD2-CA 3.26Å; D257-N312 VanDerWaalsContact OD2-CB 3.24Å; D257-N312 WeakPolarHBondContact OD2-CB 3.34Å; D257-N312 PolarHBondContact OD2-N 2.67Å
258	G	94.7	Very high	96.3	Very high	3 Å²	3	28.5 Å²	28.5	3%	0.031	17%	0.166	C	C	.	.			trans	-127.3	155.1	-178.4	0	0	0	0	0	112	N157 E158 L256 D260 D310	N157-G258 WeakPolarHBondContact ND2-CA 3.21Å; E158-G258 PolarHBondContact OE1-N 2.94Å; L256-G258 PolarHBondContact O-N 2.86Å; G258-D260 WeakPolarHBondContact O-CB 3.16Å; G258-D260 PolarHBondContact O-N 3.22Å; G258-D310 VanDerWaalsContact O-OD2 3.1Å
259	D	95.5	Very high	96.1	Very high	34 Å²	34	28.5 Å²	28.5	18%	0.182	17%	0.166	C	C	.	.	S	Bend	trans	-63.4	92.8	177.8	176.8	17.7	0	0	0	111.7	L159 D310 I313 Q369 N371	L159-D259 WeakPolarHBondContact CD1-O 3.05Å; D259-D310 WeakPolarHBondContact CA-OD2 3.37Å; D259-I313 HydrophobicContact CB-CD1 4.37Å; D259-Q369 PolarHBondContact OD1-NE2 3.47Å; D259-N371 PolarHBondContact OD2-ND2 3.02Å
260	D	95.1	Very high	95.9	Very high	39 Å²	39	33.1 Å²	33.1	21%	0.209	19%	0.19	C	C	.	.			trans	-131.6	-30	-169.6	172.2	-86	0	0	0	110.5	L159 R219 G258 D310	L159-D260 HydrophobicContact CD2-CB 4.03Å; R219-D260 IonicContact CZ-OD2 3.8Å; R219-D260 IonicContact NH2-OD2 3.68Å; R219-D260 PolarHBondContact NH2-OD2 2.95Å; G258-D260 WeakPolarHBondContact O-CB 3.16Å; G258-D260 PolarHBondContact O-N 3.22Å; D260-D310 PolarHBondContact N-OD2 3.04Å
261	L	95.5	Very high	95.7	Very high	53 Å²	53	33.1 Å²	33.1	28%	0.277	19%	0.19	S	C	.	.	S	Bend	trans	-115.9	155.4	178	-50.8	177	0	0	0	112.2	E223 Q309 D310 Q369 L375	E223-L261 HydrophobicContact CG-CD1 4.26Å; L261-Q309 HydrophobicContact CB-CB 3.63Å; L261-Q309 HydrophobicContact CD1-CB 3.92Å; L261-Q309 HydrophobicContact CG-CB 4.44Å; L261-D310 WeakPolarHBondContact CB-OD1 3.33Å; L261-D310 WeakPolarHBondContact CD1-OD1 3.49Å; L261-D310 WeakPolarHBondContact CG-OD1 3.37Å; L261-D310 PolarHBondContact N-OD2 3.35Å; L261-Q369 PolarHBondContact O-OE1 2.7Å; L261-Q369 VanDerWaalsContact O-OE1 3.05Å; L261-L375 WeakPolarHBondContact O-CD1 3.23Å
262	G	94.7	Very high	95.4	Very high	10 Å²	10	37.2 Å²	37.2	10%	0.103	22%	0.216	C	C	.	.			trans	-84.8	-179.9	179.1	0	0	0	0	0	115.1	Q309 Q369 L375	G262-Q309 VanDerWaalsContact O-CB 3.25Å; G262-Q309 WeakPolarHBondContact O-CB 3.49Å; G262-Q309 WeakPolarHBondContact O-CG 3.49Å; G262-Q309 PolarHBondContact O-N 2.86Å; G262-Q309 PolarHBondContact O-NE2 2.88Å; G262-Q369 VanDerWaalsContact CA-OE1 3.29Å; G262-L375 VanDerWaalsContact CA-CB 3.41Å; G262-L375 WeakPolarHBondContact CA-O 3.47Å
263	P	96.3	Very high	95	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.013	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	150.9	167.8	-20.6	35	0	0	0	112.4	A306 I307 I322 A367 Q369 L375 A377	P263-A306 HydrophobicContact CB-CB 4.11Å; P263-I307 CarbonylContact C-O 3.58Å; P263-I307 WeakPolarHBondContact CA-O 3.39Å; P263-I322 HydrophobicContact CB-CD1 4.06Å; P263-I322 HydrophobicContact CB-CG1 4.38Å; P263-I322 HydrophobicContact CG-CD1 4.35Å; P263-I322 HydrophobicContact CG-CG1 4.13Å; P263-A367 HydrophobicContact CB-CB 4.38Å; P263-Q369 HydrophobicContact CG-CG 4.04Å; P263-L375 WeakPolarHBondContact CD-O 3.13Å; P263-A377 WeakPolarHBondContact O-CB 3.2Å
264	M	95.5	Very high	94.7	Very high	30 Å²	30	47.1 Å²	47.1	15%	0.148	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.6	166.5	56.9	155.1	80.3	0	0	110.9	L266 C268 A306 I307 Q309 R311	M264-L266 HydrophobicContact SD-CD2 4.26Å; M264-C268 HydrophobicContact SD-CB 3.96Å; M264-A306 CarbonylContact O-C 3.43Å; M264-A306 WeakPolarHBondContact O-CA 3.36Å; M264-A306 WeakPolarHBondContact O-CB 3.3Å; M264-I307 HydrophobicContact CG-CG1 3.92Å; M264-I307 VanDerWaalsContact CG-O 3.28Å; M264-I307 WeakPolarHBondContact CG-O 3.11Å; M264-I307 PolarHBondContact N-O 2.79Å; M264-I307 PolarHBondContact O-N 2.85Å; M264-I307 HydrophobicContact SD-CG1 4.29Å; M264-Q309 HydrophobicContact CB-CG 3.82Å; M264-Q309 HydrophobicContact CE-CG 3.68Å; M264-Q309 HydrophobicContact CG-CG 3.83Å; M264-R311 VanDerWaalsContact CE-NH2 3.29Å; M264-R311 PolarHBondContact SD-NH2 2.03Å
265	F	96.9	Very high	94.3	Very high	13 Å²	13	53 Å²	53	6%	0.057	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	148	171.9	-78.5	-72.2	0	0	0	112.1	L280 Y282 I304 A306 Y324 I365 A367 A377 F378 A379	F265-L280 HydrophobicContact CB-CD2 4.42Å; F265-Y282 HydrophobicContact CD1-CE2 4.06Å; F265-Y282 WeakPolarHBondContact CD1-OH 3.43Å; F265-Y282 HydrophobicContact CE1-CE2 4.39Å; F265-I304 HydrophobicContact CD1-CG2 4.47Å; F265-I304 HydrophobicContact CE1-CG2 4.02Å; F265-A306 HydrophobicContact CD1-CB 3.99Å; F265-A306 HydrophobicContact CE1-CB 4.29Å; F265-A306 HydrophobicContact CG-CB 4.46Å; F265-Y324 HydrophobicContact CE1-CD1 4.34Å; F265-Y324 HydrophobicContact CE1-CE1 4.22Å; F265-I365 HydrophobicContact CE1-CG2 4.29Å; F265-I365 HydrophobicContact CZ-CB 4.32Å; F265-I365 HydrophobicContact CZ-CG2 3.98Å; F265-A367 HydrophobicContact CE1-CB 3.87Å; F265-A367 HydrophobicContact CE2-CB 3.97Å; F265-A367 HydrophobicContact CZ-CB 3.49Å; F265-A367 VanDerWaalsContact CZ-CB 3.49Å; F265-A377 HydrophobicContact CD2-CB 4.18Å; F265-A377 HydrophobicContact CE2-CB 4.26Å; F265-F378 VanDerWaalsContact CE2-C 3.49Å; F265-A379 HydrophobicContact CB-CB 4.46Å; F265-A379 HydrophobicContact CD1-CB 4.3Å; F265-A379 HydrophobicContact CD2-CB 3.53Å; F265-A379 HydrophobicContact CE1-CB 4.4Å; F265-A379 HydrophobicContact CE2-CB 3.67Å; F265-A379 HydrophobicContact CG-CB 3.85Å; F265-A379 HydrophobicContact CZ-CB 4.11Å
266	L	95.3	Very high	93.9	Very high	38 Å²	38	57.4 Å²	57.4	20%	0.199	32%	0.315	C	S	.	.	S	Bend	trans	-111.5	143.8	176.2	-59.1	-178	0	0	0	112.7	M264 C268 L280 Y282 Q305 I307	M264-L266 HydrophobicContact SD-CD2 4.26Å; L266-C268 HydrophobicContact CD2-CB 4.27Å; L266-L280 VanDerWaalsContact O-CD2 3.32Å; L266-L280 WeakPolarHBondContact O-CD2 3.46Å; L266-Y282 PolarHBondContact O-OH 2.9Å; L266-Q305 HydrophobicContact CB-CG 3.75Å; L266-Q305 HydrophobicContact CD1-CG 3.93Å; L266-Q305 HydrophobicContact CG-CG 4.17Å; L266-Q305 PolarHBondContact N-O 3.24Å; L266-I307 HydrophobicContact CD1-CD1 3.79Å; L266-I307 HydrophobicContact CD1-CG1 4.12Å; L266-I307 HydrophobicContact CD1-CG2 4.29Å; L266-I307 HydrophobicContact CD2-CD1 3.9Å; L266-I307 HydrophobicContact CD2-CG1 4.09Å; L266-I307 HydrophobicContact CG-CD1 4.19Å; L266-I307 HydrophobicContact CG-CG1 4.16Å
267	P	95.5	Very high	93.7	Very high	72 Å²	72	56 Å²	56	47%	0.468	31%	0.31	S	S	.	.	S	Bend	cis	-76.1	129.1	1.3	29.7	-35	0	0	0	113.2	L280 P302	P267-L280 HydrophobicContact CG-CD1 4.36Å; P267-P302 HydrophobicContact CG-CG 4.41Å
268	C	92.5	Very high	93.4	Very high	38 Å²	38	62.5 Å²	62.5	26%	0.257	33%	0.334	S	S	.	.			trans	-83.6	116.7	170.1	175	0	0	0	0	109.8	M264 L266 C277	M264-C268 HydrophobicContact SD-CB 3.96Å; L266-C268 HydrophobicContact CD2-CB 4.27Å; C268-C277 HydrophobicContact CB-CB 3.9Å; C268-C277 WeakPolarHBondContact CB-SG 3.37Å; C268-C277 WeakPolarHBondContact SG-CB 3.35Å; C268-C277 CovalentContact SG-SG 2.03Å; C268-C277 PolarHBondContact SG-SG 2.83Å
269	V	93.1	Very high	93.2	Very high	83 Å²	83	68.6 Å²	68.6	50%	0.503	37%	0.373	S	S	.	.			trans	-110.5	112.7	169.3	178.9	0	0	0	0	107.7	R278	V269-R278 WeakPolarHBondContact O-CB 3.2Å; V269-R278 WeakPolarHBondContact O-CG 3.17Å; V269-R278 PolarHBondContact O-N 3.33Å
270	L	92.3	Very high	92.9	Very high	103 Å²	103	68.5 Å²	68.5	54%	0.539	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-61.4	141.8	-176.3	-68.8	176	0	0	0	112.7	R275 D276	L270-R275 WeakPolarHBondContact CD2-O 3.48Å; L270-D276 WeakPolarHBondContact CA-O 3.35Å
271	V	93.3	Very high	92.9	Very high	52 Å²	52	70.1 Å²	70.1	32%	0.315	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-73.9	134.3	168.7	177.7	0	0	0	0	109.1	N273 T274 D276 R278	V271-N273 PolarHBondContact O-N 2.91Å; V271-T274 HydrophobicContact CG1-CG2 4.3Å; V271-T274 PolarHBondContact O-N 2.8Å; V271-T274 VanDerWaalsContact O-N 3.1Å; V271-D276 PolarHBondContact N-O 2.85Å; V271-R278 HydrophobicContact CG2-CG 3.68Å
272	P	91.7	Very high	93	Very high	86 Å²	86	67.6 Å²	67.6	56%	0.558	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	128.7	179.6	-27.3	35.5	0	0	0	112.9	T274	P272-T274 VanDerWaalsContact C-N 3.33Å
273	N	91.1	Very high	93.1	Very high	173 Å²	173	71.1 Å²	71.1	93%	0.925	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	15.8	-176.6	-44.7	-57.4	0	0	0	116.2	V271	V271-N273 PolarHBondContact O-N 2.91Å
274	T	90.9	Very high	93.1	Very high	60 Å²	60	71.3 Å²	71.3	37%	0.368	39%	0.386	S	S	.	.	S	Bend	trans	-131	170.1	169.3	88.7	0	0	0	0	111.5	V271 P272 D276	V271-T274 HydrophobicContact CG1-CG2 4.3Å; V271-T274 PolarHBondContact O-N 2.8Å; V271-T274 VanDerWaalsContact O-N 3.1Å; P272-T274 VanDerWaalsContact C-N 3.33Å; T274-D276 VanDerWaalsContact C-N 3.32Å; T274-D276 WeakPolarHBondContact CB-OD2 3.36Å; T274-D276 WeakPolarHBondContact OG1-CB 3.46Å; T274-D276 VanDerWaalsContact OG1-CG 3.25Å; T274-D276 PolarHBondContact OG1-N 2.81Å; T274-D276 VanDerWaalsContact OG1-N 3.07Å; T274-D276 PolarHBondContact OG1-OD2 3.37Å
275	R	89.3	Confident	93.1	Very high	146 Å²	146	72.4 Å²	72.4	55%	0.551	40%	0.4	S	S	*	.	S	Bend	trans	-90.7	5.6	171.4	-70.8	-177.1	174	151.5	1.6	112.1	E223 D224 L270	E223-R275 PolarHBondContact O-NH2 2.88Å; D224-R275 IonicContact OD1-CZ 3.34Å; D224-R275 IonicContact OD1-NH1 2.71Å; D224-R275 PolarHBondContact OD1-NH1 3.35Å; D224-R275 IonicContact OD1-NH2 3.35Å; D224-R275 PolarHBondContact OD1-NH2 3.28Å; L270-R275 WeakPolarHBondContact CD2-O 3.48Å
276	D	89.6	Confident	93	Very high	99 Å²	99	71.8 Å²	71.8	53%	0.529	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-86.9	138.3	-172.3	-41.3	-60.8	0	0	0	112.4	L270 V271 T274	L270-D276 WeakPolarHBondContact CA-O 3.35Å; V271-D276 PolarHBondContact N-O 2.85Å; T274-D276 VanDerWaalsContact C-N 3.32Å; T274-D276 WeakPolarHBondContact CB-OD2 3.36Å; T274-D276 WeakPolarHBondContact OG1-CB 3.46Å; T274-D276 VanDerWaalsContact OG1-CG 3.25Å; T274-D276 PolarHBondContact OG1-N 2.81Å; T274-D276 VanDerWaalsContact OG1-N 3.07Å; T274-D276 PolarHBondContact OG1-OD2 3.37Å
277	C	91.5	Very high	92.8	Very high	37 Å²	37	71.7 Å²	71.7	25%	0.25	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-71.4	137.8	167.7	-55.3	0	0	0	0	110.8	C268	C268-C277 HydrophobicContact CB-CB 3.9Å; C268-C277 WeakPolarHBondContact CB-SG 3.37Å; C268-C277 WeakPolarHBondContact SG-CB 3.35Å; C268-C277 CovalentContact SG-SG 2.03Å; C268-C277 PolarHBondContact SG-SG 2.83Å
278	R	90.9	Very high	92.5	Very high	141 Å²	141	68.4 Å²	68.4	53%	0.532	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-58.2	141.2	168.6	-78.1	-179.4	179	-158.5	-1.5	110.7	V269 V271 L280	V269-R278 WeakPolarHBondContact O-CB 3.2Å; V269-R278 WeakPolarHBondContact O-CG 3.17Å; V269-R278 PolarHBondContact O-N 3.33Å; V271-R278 HydrophobicContact CG2-CG 3.68Å; R278-L280 PolarHBondContact O-N 2.96Å
279	P	90	Very high	92.4	Very high	131 Å²	131	70.5 Å²	70.5	85%	0.851	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-53.7	131.4	173.3	-26.5	34.9	0	0	0	111.8
280	L	90.9	Very high	92.3	Very high	33 Å²	33	70.8 Å²	70.8	17%	0.173	38%	0.378	C	S	.	.			trans	-106.8	135.3	-177.9	-178.4	63.7	0	0	0	110	F265 L266 P267 R278 Y282 S380	F265-L280 HydrophobicContact CB-CD2 4.42Å; L266-L280 VanDerWaalsContact O-CD2 3.32Å; L266-L280 WeakPolarHBondContact O-CD2 3.46Å; P267-L280 HydrophobicContact CG-CD1 4.36Å; R278-L280 PolarHBondContact O-N 2.96Å; L280-Y282 HydrophobicContact CD2-CD1 4.39Å; L280-Y282 HydrophobicContact CD2-CE1 3.74Å; L280-Y282 HydrophobicContact CD2-CE2 3.89Å; L280-Y282 VanDerWaalsContact CD2-CZ 3.45Å; L280-Y282 HydrophobicContact CG-CE1 4.47Å; L280-Y282 HydrophobicContact CG-CE2 4.36Å; L280-S380 PolarHBondContact O-N 2.95Å
281	T	95.3	Very high	92.3	Very high	72 Å²	72	68.4 Å²	68.4	44%	0.442	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.1	171.6	-53.2	0	0	0	0	108.9	S380 H382	T281-S380 CarbonylContact C-O 3.56Å; T281-S380 WeakPolarHBondContact CA-O 3.49Å; T281-H382 HydrophobicContact CG2-CB 4.36Å
282	Y	96.9	Very high	92.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	153.4	170	-65.3	-74.1	0	0	0	111.2	F265 L266 L280 V300 P302 I304 A379 S380 H382	F265-Y282 HydrophobicContact CD1-CE2 4.06Å; F265-Y282 WeakPolarHBondContact CD1-OH 3.43Å; F265-Y282 HydrophobicContact CE1-CE2 4.39Å; L266-Y282 PolarHBondContact O-OH 2.9Å; L280-Y282 HydrophobicContact CD2-CD1 4.39Å; L280-Y282 HydrophobicContact CD2-CE1 3.74Å; L280-Y282 HydrophobicContact CD2-CE2 3.89Å; L280-Y282 VanDerWaalsContact CD2-CZ 3.45Å; L280-Y282 HydrophobicContact CG-CE1 4.47Å; L280-Y282 HydrophobicContact CG-CE2 4.36Å; Y282-V300 HydrophobicContact CD1-CG1 4.08Å; Y282-V300 HydrophobicContact CG-CG1 4.14Å; Y282-P302 HydrophobicContact CD1-CG 3.98Å; Y282-P302 WeakPolarHBondContact CD1-O 3.37Å; Y282-P302 HydrophobicContact CE1-CG 3.92Å; Y282-P302 WeakPolarHBondContact CE1-O 3.2Å; Y282-I304 HydrophobicContact CD1-CG1 3.96Å; Y282-I304 HydrophobicContact CD2-CG1 4.16Å; Y282-I304 HydrophobicContact CE1-CB 4.3Å; Y282-I304 HydrophobicContact CE1-CG1 3.99Å; Y282-I304 HydrophobicContact CE2-CG1 4.21Å; Y282-I304 HydrophobicContact CE2-CG2 4.12Å; Y282-I304 HydrophobicContact CG-CG1 4.02Å; Y282-A379 HydrophobicContact CD2-CB 4Å; Y282-A379 HydrophobicContact CE2-CB 3.64Å; Y282-S380 WeakPolarHBondContact CD2-O 3.33Å; Y282-S380 PolarHBondContact N-O 2.84Å; Y282-H382 PolarHBondContact O-N 3.22Å
283	Q	96.6	Very high	92.4	Very high	84 Å²	84	70.3 Å²	70.3	39%	0.393	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.4	-177.5	-60.8	-66.8	-34.8	0	0	110.5	T301 H382	Q283-T301 PolarHBondContact N-O 3.42Å; Q283-T301 PolarHBondContact O-N 2.87Å; Q283-H382 CarbonylContact C-O 3.58Å; Q283-H382 WeakPolarHBondContact CA-O 3.33Å; Q283-H382 PolarHBondContact OE1-CD2 3.05Å; Q283-H382 VanDerWaalsContact OE1-CD2 3.28Å
284	A	96.6	Very high	92.4	Very high	7 Å²	7	67.3 Å²	67.3	6%	0.058	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.9	168.7	0	0	0	0	0	109.8	I298 V300 L381 H382 I383 E384	A284-I298 HydrophobicContact CB-CG2 3.92Å; A284-V300 HydrophobicContact CB-CG2 4.39Å; A284-L381 HydrophobicContact CB-CD1 4.43Å; A284-H382 PolarHBondContact N-O 2.71Å; A284-I383 HydrophobicContact CB-CG1 4.36Å; A284-I383 HydrophobicContact CB-CG2 4.38Å; A284-I383 WeakPolarHBondContact O-CA 3.5Å; A284-E384 PolarHBondContact O-N 3.43Å
285	A	94.7	Very high	92.5	Very high	52 Å²	52	66.3 Å²	66.3	43%	0.43	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.8	175.8	0	0	0	0	0	109.7	E384 L386	A285-E384 WeakPolarHBondContact CA-O 3.3Å; A285-L386 HydrophobicContact CB-CD1 3.98Å; A285-L386 HydrophobicContact CB-CD2 4.31Å; A285-L386 HydrophobicContact CB-CG 4.13Å
286	I	94.4	Very high	92.8	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	114.7	-170.4	-63.4	-174.1	0	0	0	108	L295 I298 F338 L349 I383 E384 I385 L386	I286-L295 HydrophobicContact CG2-CD1 3.69Å; I286-I298 HydrophobicContact CD1-CD1 3.93Å; I286-I298 HydrophobicContact CD1-CG1 4.11Å; I286-I298 HydrophobicContact CD1-CG2 4.07Å; I286-I298 HydrophobicContact CG1-CD1 4.15Å; I286-I298 HydrophobicContact CG1-CG2 4.13Å; I286-F338 HydrophobicContact CD1-CE1 3.49Å; I286-F338 VanDerWaalsContact CD1-CE1 3.49Å; I286-F338 HydrophobicContact CD1-CZ 3.98Å; I286-L349 HydrophobicContact CD1-CD1 4.45Å; I286-L349 HydrophobicContact CG2-CD2 4.43Å; I286-I383 HydrophobicContact CD1-CG2 3.61Å; I286-I383 HydrophobicContact CG1-CG2 3.9Å; I286-E384 PolarHBondContact N-O 2.91Å; I286-I385 HydrophobicContact CB-CD1 3.9Å; I286-I385 HydrophobicContact CG2-CD1 4.23Å; I286-I385 CarbonylContact O-C 3.52Å; I286-I385 WeakPolarHBondContact O-CA 3.08Å; I286-L386 PolarHBondContact O-N 2.87Å
287	P	91.6	Very high	93	Very high	35 Å²	35	60.9 Å²	60.9	23%	0.227	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	135.9	169.9	-15.8	29	0	0	0	110.6	R290 E388	P287-R290 HydrophobicContact CB-CG 3.88Å; P287-E388 HydrophobicContact CB-CG 4.14Å
288	E	90.4	Very high	93.2	Very high	4 Å²	4	59.7 Å²	59.7	2%	0.019	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	162.8	-179.4	76	172.7	114	0	0	113.1	R290 V353 R355 I385 L386 E388 N390	E288-R290 PolarHBondContact O-N 3.34Å; E288-V353 CarbonylContact C-O 3.23Å; E288-V353 WeakPolarHBondContact CA-O 3.05Å; E288-V353 WeakPolarHBondContact CB-O 3.21Å; E288-R355 HydrophobicContact CB-CB 4.09Å; E288-R355 HydrophobicContact CG-CB 4.31Å; E288-R355 WeakPolarHBondContact OE1-CB 3.25Å; E288-R355 WeakPolarHBondContact OE2-CB 3.38Å; E288-R355 PolarHBondContact OE2-N 3.41Å; E288-I385 HydrophobicContact CB-CG2 3.88Å; E288-L386 PolarHBondContact N-O 3.15Å; E288-E388 HydrophobicContact CG-CB 4.29Å; E288-N390 VanDerWaalsContact CD-ND2 3.28Å; E288-N390 PolarHBondContact OE1-ND2 2.98Å
289	L	89.6	Confident	93.4	Very high	82 Å²	82	59.6 Å²	59.6	43%	0.429	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	-6.5	178.7	-55.6	-179.8	0	0	0	116.6	V353 N354 N390	L289-V353 PolarHBondContact N-O 2.94Å; L289-N354 HydrophobicContact CD2-CB 3.82Å; L289-N390 HydrophobicContact CD1-CB 4.09Å
290	R	90.1	Very high	93.7	Very high	89 Å²	89	54 Å²	54	34%	0.336	29%	0.289	S	S	.	.			trans	-65.6	148	174.1	-66.3	-59.7	-178.3	159.4	-5.6	113.3	P287 E288 E294 L295 P352 E388	P287-R290 HydrophobicContact CB-CG 3.88Å; E288-R290 PolarHBondContact O-N 3.34Å; R290-E294 IonicContact NH1-OE1 2.77Å; R290-E294 PolarHBondContact NH1-OE1 2.85Å; R290-L295 HydrophobicContact CB-CD1 3.61Å; R290-L295 HydrophobicContact CB-CD2 4.19Å; R290-L295 HydrophobicContact CB-CG 3.77Å; R290-L295 HydrophobicContact CG-CD1 4.33Å; R290-L295 HydrophobicContact CG-CD2 4.35Å; R290-L295 HydrophobicContact CG-CG 4.46Å; R290-P352 WeakPolarHBondContact O-CA 3.32Å; R290-P352 VanDerWaalsContact O-CB 3.3Å; R290-P352 WeakPolarHBondContact O-CB 3.49Å; R290-P352 WeakPolarHBondContact O-CG 3.28Å; R290-E388 IonicContact CZ-OE1 2.68Å; R290-E388 VanDerWaalsContact CZ-OE1 3.23Å; R290-E388 IonicContact CZ-OE2 2.67Å; R290-E388 IonicContact NE-OE1 3.62Å; R290-E388 PolarHBondContact NE-OE1 2.62Å; R290-E388 IonicContact NE-OE2 2.74Å; R290-E388 PolarHBondContact NE-OE2 3.17Å; R290-E388 IonicContact NH2-OE1 2.67Å; R290-E388 PolarHBondContact NH2-OE1 2.97Å; R290-E388 IonicContact NH2-OE2 3.14Å; R290-E388 PolarHBondContact NH2-OE2 3.01Å
291	T	92.7	Very high	93.9	Very high	52 Å²	52	56.6 Å²	56.6	32%	0.319	31%	0.306	S	S	.	.			trans	-80.3	149.2	-178.5	59.8	0	0	0	0	112.3	E293 E294 L295	T291-E293 PolarHBondContact O-N 3.37Å; T291-E293 VanDerWaalsContact O-N 3.17Å; T291-E294 PolarHBondContact N-OE2 3.17Å; T291-E294 PolarHBondContact O-N 3.03Å; T291-E294 VanDerWaalsContact OG1-CD 3.3Å; T291-E294 VanDerWaalsContact OG1-CG 3.25Å; T291-E294 WeakPolarHBondContact OG1-CG 3.42Å; T291-E294 PolarHBondContact OG1-OE2 3.46Å; T291-L295 PolarHBondContact O-N 3.18Å
292	P	94.1	Very high	93.9	Very high	18 Å²	18	55.1 Å²	55.1	12%	0.117	30%	0.298	C	S	.	.	H	α-helix	trans	-48.6	-37.1	169.5	-31.9	38.7	0	0	0	113.7	E294 L295 N296 L349 L350	P292-E294 VanDerWaalsContact C-N 3.33Å; P292-E294 PolarHBondContact O-N 3.11Å; P292-L295 PolarHBondContact O-N 2.8Å; P292-N296 WeakPolarHBondContact O-CB 3.23Å; P292-N296 PolarHBondContact O-N 2.88Å; P292-N296 PolarHBondContact O-ND2 3.09Å; P292-N296 VanDerWaalsContact O-ND2 3.07Å; P292-L349 WeakPolarHBondContact CB-O 3.28Å; P292-L350 WeakPolarHBondContact CG-O 3.4Å
293	E	93.3	Very high	93.8	Very high	161 Å²	161	59.2 Å²	59.2	75%	0.752	32%	0.324	S	S	*	.	H	α-helix	trans	-68.7	-27	180	-66.1	75.9	-170.2	0	0	113.9	T291	T291-E293 PolarHBondContact O-N 3.37Å; T291-E293 VanDerWaalsContact O-N 3.17Å
294	E	91.3	Very high	93.8	Very high	109 Å²	109	56 Å²	56	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-82.6	-32.9	176.7	-73.1	167.6	117.1	0	0	112.7	R290 T291 P292	R290-E294 IonicContact NH1-OE1 2.77Å; R290-E294 PolarHBondContact NH1-OE1 2.85Å; T291-E294 PolarHBondContact N-OE2 3.17Å; T291-E294 PolarHBondContact O-N 3.03Å; T291-E294 VanDerWaalsContact OG1-CD 3.3Å; T291-E294 VanDerWaalsContact OG1-CG 3.25Å; T291-E294 WeakPolarHBondContact OG1-CG 3.42Å; T291-E294 PolarHBondContact OG1-OE2 3.46Å; P292-E294 VanDerWaalsContact C-N 3.33Å; P292-E294 PolarHBondContact O-N 3.11Å
295	L	93.3	Very high	93.8	Very high	40 Å²	40	60 Å²	60	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-104.3	-21.1	-170.3	-62.1	-170.5	0	0	0	115.1	I286 R290 T291 P292 P297 I298 L349	I286-L295 HydrophobicContact CG2-CD1 3.69Å; R290-L295 HydrophobicContact CB-CD1 3.61Å; R290-L295 HydrophobicContact CB-CD2 4.19Å; R290-L295 HydrophobicContact CB-CG 3.77Å; R290-L295 HydrophobicContact CG-CD1 4.33Å; R290-L295 HydrophobicContact CG-CD2 4.35Å; R290-L295 HydrophobicContact CG-CG 4.46Å; T291-L295 PolarHBondContact O-N 3.18Å; P292-L295 PolarHBondContact O-N 2.8Å; L295-P297 CarbonylContact O-C 3.58Å; L295-P297 VanDerWaalsContact O-C 3.29Å; L295-I298 HydrophobicContact CB-CD1 3.75Å; L295-L349 HydrophobicContact CD1-CD2 4.09Å
296	N	94.5	Very high	93.9	Very high	57 Å²	57	57.8 Å²	57.8	31%	0.305	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-77.7	139.7	-173.9	-77.2	-31.4	0	0	0	113.6	P292 T348 L349	P292-N296 WeakPolarHBondContact O-CB 3.23Å; P292-N296 PolarHBondContact O-N 2.88Å; P292-N296 PolarHBondContact O-ND2 3.09Å; P292-N296 VanDerWaalsContact O-ND2 3.07Å; N296-T348 VanDerWaalsContact OD1-CA 3.25Å; N296-T348 WeakPolarHBondContact OD1-CA 3.12Å; N296-L349 PolarHBondContact ND2-O 2.83Å; N296-L349 PolarHBondContact OD1-N 2.74Å
297	P	94.8	Very high	93.9	Very high	73 Å²	73	60.6 Å²	60.6	47%	0.474	32%	0.324	S	S	.	.	S	Bend	cis	-79.3	145.1	-5.7	32.5	-34.7	0	0	0	112.6	L295 L299 E346	L295-P297 CarbonylContact O-C 3.58Å; L295-P297 VanDerWaalsContact O-C 3.29Å; P297-L299 PolarHBondContact O-N 2.77Å; P297-E346 HydrophobicContact CB-CG 3.44Å; P297-E346 VanDerWaalsContact CB-CG 3.44Å; P297-E346 HydrophobicContact CG-CG 4.33Å
298	I	95.2	Very high	94.1	Very high	13 Å²	13	60.1 Å²	60.1	7%	0.067	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-65.1	120.9	178.8	-56.9	-56.8	0	0	0	109.8	A284 I286 L295 V300 L347 L349	A284-I298 HydrophobicContact CB-CG2 3.92Å; I286-I298 HydrophobicContact CD1-CD1 3.93Å; I286-I298 HydrophobicContact CD1-CG1 4.11Å; I286-I298 HydrophobicContact CD1-CG2 4.07Å; I286-I298 HydrophobicContact CG1-CD1 4.15Å; I286-I298 HydrophobicContact CG1-CG2 4.13Å; L295-I298 HydrophobicContact CB-CD1 3.75Å; I298-V300 PolarHBondContact O-N 3.03Å; I298-L347 HydrophobicContact CB-CB 4.25Å; I298-L347 HydrophobicContact CB-CD2 4.08Å; I298-L347 HydrophobicContact CB-CG 4.23Å; I298-L347 HydrophobicContact CG2-CD2 3.98Å; I298-L347 PolarHBondContact N-O 2.79Å; I298-L349 HydrophobicContact CD1-CB 4.08Å; I298-L349 HydrophobicContact CG1-CB 4.25Å
299	L	95	Very high	94.4	Very high	139 Å²	139	62.6 Å²	62.6	73%	0.728	33%	0.331	S	S	*	.			trans	-72.7	110.9	179.5	-177.4	61.1	0	0	0	110.9	P297	P297-L299 PolarHBondContact O-N 2.77Å
300	V	96.7	Very high	94.6	Very high	12 Å²	12	59 Å²	59	7%	0.073	31%	0.312	C	S	.	.			trans	-96.1	134.8	174	-173.5	0	0	0	0	110.5	Y282 A284 I298 P302 I304 L347 L381	Y282-V300 HydrophobicContact CD1-CG1 4.08Å; Y282-V300 HydrophobicContact CG-CG1 4.14Å; A284-V300 HydrophobicContact CB-CG2 4.39Å; I298-V300 PolarHBondContact O-N 3.03Å; V300-P302 CarbonylContact C-O 3.51Å; V300-P302 CarbonylContact O-C 3.54Å; V300-P302 VanDerWaalsContact O-C 3.23Å; V300-I304 HydrophobicContact CB-CD1 4.32Å; V300-I304 HydrophobicContact CB-CG1 4.08Å; V300-I304 HydrophobicContact CG1-CD1 3.98Å; V300-I304 HydrophobicContact CG1-CG1 3.67Å; V300-I304 HydrophobicContact CG2-CD1 4.11Å; V300-I304 HydrophobicContact CG2-CG1 4.41Å; V300-L347 HydrophobicContact CG2-CB 4.2Å; V300-L347 HydrophobicContact CG2-CD2 4.01Å; V300-L381 HydrophobicContact CG1-CD1 3.74Å; V300-L381 HydrophobicContact CG2-CD1 4.37Å
301	T	93.9	Very high	94.8	Very high	88 Å²	88	61 Å²	61	54%	0.54	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-116.9	124.7	-179.5	-59.3	0	0	0	0	111.3	Q283	Q283-T301 PolarHBondContact N-O 3.42Å; Q283-T301 PolarHBondContact O-N 2.87Å
302	P	95.7	Very high	94.9	Very high	42 Å²	42	61.7 Å²	61.7	27%	0.273	32%	0.321	S	S	.	.	S	Bend	cis	-63.3	169.9	-16.8	29	-33.5	0	0	0	111.7	P267 Y282 V300 I304	P267-P302 HydrophobicContact CG-CG 4.41Å; Y282-P302 HydrophobicContact CD1-CG 3.98Å; Y282-P302 WeakPolarHBondContact CD1-O 3.37Å; Y282-P302 HydrophobicContact CE1-CG 3.92Å; Y282-P302 WeakPolarHBondContact CE1-O 3.2Å; V300-P302 CarbonylContact C-O 3.51Å; V300-P302 CarbonylContact O-C 3.54Å; V300-P302 VanDerWaalsContact O-C 3.23Å; P302-I304 PolarHBondContact O-N 3.34Å
303	P	95.9	Very high	94.9	Very high	85 Å²	85	61.3 Å²	61.3	55%	0.552	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-59	130.1	177.1	-24.8	34.9	0	0	0	111.8	Q305	P303-Q305 PolarHBondContact O-N 3.27Å; P303-Q305 VanDerWaalsContact O-N 3.17Å
304	I	96.8	Very high	94.8	Very high	17 Å²	17	58.3 Å²	58.3	9%	0.087	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-66	116.4	178.8	-53.3	177.3	0	0	0	109	F265 Y282 V300 P302 Y324 M340 A345 L381	F265-I304 HydrophobicContact CD1-CG2 4.47Å; F265-I304 HydrophobicContact CE1-CG2 4.02Å; Y282-I304 HydrophobicContact CD1-CG1 3.96Å; Y282-I304 HydrophobicContact CD2-CG1 4.16Å; Y282-I304 HydrophobicContact CE1-CB 4.3Å; Y282-I304 HydrophobicContact CE1-CG1 3.99Å; Y282-I304 HydrophobicContact CE2-CG1 4.21Å; Y282-I304 HydrophobicContact CE2-CG2 4.12Å; Y282-I304 HydrophobicContact CG-CG1 4.02Å; V300-I304 HydrophobicContact CB-CD1 4.32Å; V300-I304 HydrophobicContact CB-CG1 4.08Å; V300-I304 HydrophobicContact CG1-CD1 3.98Å; V300-I304 HydrophobicContact CG1-CG1 3.67Å; V300-I304 HydrophobicContact CG2-CD1 4.11Å; V300-I304 HydrophobicContact CG2-CG1 4.41Å; P302-I304 PolarHBondContact O-N 3.34Å; I304-Y324 HydrophobicContact CG2-CD1 4.46Å; I304-M340 HydrophobicContact CD1-CE 3.61Å; I304-A345 HydrophobicContact CB-CB 3.73Å; I304-A345 HydrophobicContact CG2-CB 3.55Å; I304-L381 HydrophobicContact CD1-CD2 4.41Å
305	Q	95.9	Very high	94.9	Very high	90 Å²	90	56.1 Å²	56.1	42%	0.421	30%	0.3	S	S	.	.			trans	-151.7	145.7	171.9	70.2	-161.8	-64.9	0	0	109.5	L266 P303	L266-Q305 HydrophobicContact CB-CG 3.75Å; L266-Q305 HydrophobicContact CD1-CG 3.93Å; L266-Q305 HydrophobicContact CG-CG 4.17Å; L266-Q305 PolarHBondContact N-O 3.24Å; P303-Q305 PolarHBondContact O-N 3.27Å; P303-Q305 VanDerWaalsContact O-N 3.17Å
306	A	96.4	Very high	94.9	Very high	7 Å²	7	58 Å²	58	6%	0.058	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.9	169.3	0	0	0	0	0	109.4	P263 M264 F265 I322 Y324 A367	P263-A306 HydrophobicContact CB-CB 4.11Å; M264-A306 CarbonylContact O-C 3.43Å; M264-A306 WeakPolarHBondContact O-CA 3.36Å; M264-A306 WeakPolarHBondContact O-CB 3.3Å; F265-A306 HydrophobicContact CD1-CB 3.99Å; F265-A306 HydrophobicContact CE1-CB 4.29Å; F265-A306 HydrophobicContact CG-CB 4.46Å; A306-I322 HydrophobicContact CB-CD1 4.25Å; A306-I322 HydrophobicContact CB-CG2 4.46Å; A306-I322 VanDerWaalsContact O-CD1 3.27Å; A306-I322 WeakPolarHBondContact O-CD1 3.39Å; A306-Y324 HydrophobicContact CB-CE1 3.84Å; A306-Y324 PolarHBondContact N-OH 2.98Å; A306-Y324 PolarHBondContact O-OH 2.94Å; A306-A367 HydrophobicContact CB-CB 3.74Å
307	I	95.8	Very high	94.9	Very high	60 Å²	60	59.9 Å²	59.9	31%	0.308	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.5	175.4	54.6	178.4	0	0	0	108.9	P263 M264 L266 Q309 R311	P263-I307 CarbonylContact C-O 3.58Å; P263-I307 WeakPolarHBondContact CA-O 3.39Å; M264-I307 HydrophobicContact CG-CG1 3.92Å; M264-I307 VanDerWaalsContact CG-O 3.28Å; M264-I307 WeakPolarHBondContact CG-O 3.11Å; M264-I307 PolarHBondContact N-O 2.79Å; M264-I307 PolarHBondContact O-N 2.85Å; M264-I307 HydrophobicContact SD-CG1 4.29Å; L266-I307 HydrophobicContact CD1-CD1 3.79Å; L266-I307 HydrophobicContact CD1-CG1 4.12Å; L266-I307 HydrophobicContact CD1-CG2 4.29Å; L266-I307 HydrophobicContact CD2-CD1 3.9Å; L266-I307 HydrophobicContact CD2-CG1 4.09Å; L266-I307 HydrophobicContact CG-CD1 4.19Å; L266-I307 HydrophobicContact CG-CG1 4.16Å; I307-Q309 PolarHBondContact O-N 2.95Å; I307-R311 VanDerWaalsContact CG1-NH1 3.34Å
308	D	95.5	Very high	94.8	Very high	24 Å²	24	61 Å²	61	13%	0.128	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.1	135.4	174.9	-162.1	-25.3	0	0	0	111	D310 R311 P320	D308-D310 VanDerWaalsContact C-N 3.27Å; D308-D310 PolarHBondContact OD1-N 2.82Å; D308-R311 PolarHBondContact O-NH1 2.84Å; D308-P320 WeakPolarHBondContact OD2-CD 3.22Å; D308-P320 VanDerWaalsContact OD2-CG 3.28Å; D308-P320 WeakPolarHBondContact OD2-CG 3.32Å
309	Q	95.3	Very high	94.8	Very high	56 Å²	56	65.4 Å²	65.4	26%	0.262	35%	0.349	S	S	.	.	S	Bend	trans	-71.6	-26.7	175.9	-76	179.9	110	0	0	111.6	L261 G262 M264 I307 R311	L261-Q309 HydrophobicContact CB-CB 3.63Å; L261-Q309 HydrophobicContact CD1-CB 3.92Å; L261-Q309 HydrophobicContact CG-CB 4.44Å; G262-Q309 VanDerWaalsContact O-CB 3.25Å; G262-Q309 WeakPolarHBondContact O-CB 3.49Å; G262-Q309 WeakPolarHBondContact O-CG 3.49Å; G262-Q309 PolarHBondContact O-N 2.86Å; G262-Q309 PolarHBondContact O-NE2 2.88Å; M264-Q309 HydrophobicContact CB-CG 3.82Å; M264-Q309 HydrophobicContact CE-CG 3.68Å; M264-Q309 HydrophobicContact CG-CG 3.83Å; I307-Q309 PolarHBondContact O-N 2.95Å; Q309-R311 WeakPolarHBondContact O-CD 3.42Å; Q309-R311 VanDerWaalsContact O-CG 3.3Å; Q309-R311 WeakPolarHBondContact O-CG 3.39Å; Q309-R311 PolarHBondContact O-N 2.83Å
310	D	95.4	Very high	94.8	Very high	6 Å²	6	59.6 Å²	59.6	3%	0.032	32%	0.32	C	S	.	.			trans	-83.6	93.9	-176.3	-63.5	-14.6	0	0	0	109.4	D257 G258 D259 D260 L261 D308 N312 I313	D257-D310 WeakPolarHBondContact OD1-CB 3.4Å; G258-D310 VanDerWaalsContact O-OD2 3.1Å; D259-D310 WeakPolarHBondContact CA-OD2 3.37Å; D260-D310 PolarHBondContact N-OD2 3.04Å; L261-D310 WeakPolarHBondContact CB-OD1 3.33Å; L261-D310 WeakPolarHBondContact CD1-OD1 3.49Å; L261-D310 WeakPolarHBondContact CG-OD1 3.37Å; L261-D310 PolarHBondContact N-OD2 3.35Å; D308-D310 VanDerWaalsContact C-N 3.27Å; D308-D310 PolarHBondContact OD1-N 2.82Å; D310-N312 PolarHBondContact O-N 2.93Å; D310-I313 HydrophobicContact CB-CD1 3.67Å; D310-I313 HydrophobicContact CB-CG1 3.82Å
311	R	92.5	Very high	94.7	Very high	133 Å²	133	60.3 Å²	60.3	50%	0.502	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-22	-158.8	-60.9	-46.9	-165.2	173.1	4.9	114.5	D257 M264 I307 D308 Q309	D257-R311 PolarHBondContact OD2-N 2.79Å; M264-R311 VanDerWaalsContact CE-NH2 3.29Å; M264-R311 PolarHBondContact SD-NH2 2.03Å; I307-R311 VanDerWaalsContact CG1-NH1 3.34Å; D308-R311 PolarHBondContact O-NH1 2.84Å; Q309-R311 WeakPolarHBondContact O-CD 3.42Å; Q309-R311 VanDerWaalsContact O-CG 3.3Å; Q309-R311 WeakPolarHBondContact O-CG 3.39Å; Q309-R311 PolarHBondContact O-N 2.83Å
312	N	94.9	Very high	94.8	Very high	65 Å²	65	57.4 Å²	57.4	35%	0.348	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.8	31.3	-168.3	-170.3	40.5	0	0	0	112	Y222 D257 D310 Q314	Y222-N312 HydrophobicContact CE1-CB 4.41Å; Y222-N312 WeakPolarHBondContact OH-CB 3.31Å; Y222-N312 PolarHBondContact OH-ND2 2.81Å; D257-N312 HydrophobicContact CB-CB 4.2Å; D257-N312 WeakPolarHBondContact OD2-CA 3.26Å; D257-N312 VanDerWaalsContact OD2-CB 3.24Å; D257-N312 WeakPolarHBondContact OD2-CB 3.34Å; D257-N312 PolarHBondContact OD2-N 2.67Å; D310-N312 PolarHBondContact O-N 2.93Å; N312-Q314 WeakPolarHBondContact O-CG 3.47Å; N312-Q314 PolarHBondContact O-N 2.74Å; N312-Q314 VanDerWaalsContact O-N 3.15Å; N312-Q314 PolarHBondContact OD1-NE2 2.99Å
313	I	94.4	Very high	94.9	Very high	10 Å²	10	57.7 Å²	57.7	5%	0.051	31%	0.31	C	S	.	.			trans	-50.1	125	165	-66.2	176	0	0	0	109	D259 D310 D318 R319	D259-I313 HydrophobicContact CB-CD1 4.37Å; D310-I313 HydrophobicContact CB-CD1 3.67Å; D310-I313 HydrophobicContact CB-CG1 3.82Å; I313-D318 HydrophobicContact CG2-CB 4.11Å; I313-R319 HydrophobicContact CB-CG 3.91Å; I313-R319 HydrophobicContact CG2-CG 3.95Å; I313-R319 PolarHBondContact O-NE 2.98Å; I313-R319 PolarHBondContact O-NH2 2.96Å
314	Q	91.4	Very high	95	Very high	98 Å²	98	54.6 Å²	54.6	46%	0.458	29%	0.287	S	S	.	.	S	Bend	trans	-128.7	137.8	178.7	-65.4	-58.4	-27.5	0	0	110	N312	N312-Q314 WeakPolarHBondContact O-CG 3.47Å; N312-Q314 PolarHBondContact O-N 2.74Å; N312-Q314 VanDerWaalsContact O-N 3.15Å; N312-Q314 PolarHBondContact OD1-NE2 2.99Å
315	P	94.4	Very high	95.1	Very high	64 Å²	64	55.5 Å²	55.5	42%	0.416	30%	0.295	S	S	.	.	S	Bend	cis	-70.1	163.8	-4.7	29.6	-36.4	0	0	0	113.1	S317 D318	P315-S317 WeakPolarHBondContact CG-OG 3.38Å; P315-S317 PolarHBondContact O-N 2.95Å; P315-D318 PolarHBondContact O-N 2.78Å
316	P	93	Very high	95.2	Very high	80 Å²	80	52.5 Å²	52.5	52%	0.519	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.8	-179.9	-23.5	35.4	0	0	0	115.6	D318	P316-D318 VanDerWaalsContact C-N 3.25Å
317	S	94.1	Very high	95.2	Very high	96 Å²	96	55.8 Å²	55.8	67%	0.671	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.3	171.5	48.6	0	0	0	0	113.7	P315	P315-S317 WeakPolarHBondContact CG-OG 3.38Å; P315-S317 PolarHBondContact O-N 2.95Å
318	D	93.7	Very high	95.2	Very high	96 Å²	96	56.8 Å²	56.8	51%	0.513	31%	0.306	S	S	.	.	S	Bend	trans	-95.9	-3.2	-171.5	-59.9	16.2	0	0	0	110.7	I313 P315 P316	I313-D318 HydrophobicContact CG2-CB 4.11Å; P315-D318 PolarHBondContact O-N 2.78Å; P316-D318 VanDerWaalsContact C-N 3.25Å
319	R	94.4	Very high	95.2	Very high	105 Å²	105	56.2 Å²	56.2	40%	0.396	31%	0.306	S	S	.	.	S	Bend	trans	-69.8	122.8	174.5	-68.4	171.6	-170.9	-167.9	-3.4	109.9	I313	I313-R319 HydrophobicContact CB-CG 3.91Å; I313-R319 HydrophobicContact CG2-CG 3.95Å; I313-R319 PolarHBondContact O-NE 2.98Å; I313-R319 PolarHBondContact O-NH2 2.96Å
320	P	94.2	Very high	95.2	Very high	17 Å²	17	57.7 Å²	57.7	11%	0.11	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-65.7	150.2	178.8	26.4	-33.4	0	0	0	112.1	D308 Q369 N371	D308-P320 WeakPolarHBondContact OD2-CD 3.22Å; D308-P320 VanDerWaalsContact OD2-CG 3.28Å; D308-P320 WeakPolarHBondContact OD2-CG 3.32Å; P320-Q369 HydrophobicContact CB-CB 3.8Å; P320-Q369 HydrophobicContact CB-CG 3.73Å; P320-Q369 HydrophobicContact CG-CB 4.13Å; P320-Q369 HydrophobicContact CG-CG 3.52Å; P320-N371 HydrophobicContact CB-CB 4.14Å
321	G	94.9	Very high	95.3	Very high	27 Å²	27	59.8 Å²	59.8	28%	0.278	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-80	147.2	161.6	0	0	0	0	0	110.1	D370	G321-D370 WeakPolarHBondContact CA-OD1 3.48Å; G321-D370 WeakPolarHBondContact CA-OD2 3.32Å; G321-D370 PolarHBondContact N-OD1 2.83Å; G321-D370 WeakPolarHBondContact O-CB 3.4Å; G321-D370 PolarHBondContact O-N 2.9Å
322	I	97.2	Very high	95.3	Very high	27 Å²	27	61.7 Å²	61.7	14%	0.138	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	141	175.3	-62.1	169.8	0	0	0	109.5	P263 A306 Y324 R343 A367 E368	P263-I322 HydrophobicContact CB-CD1 4.06Å; P263-I322 HydrophobicContact CB-CG1 4.38Å; P263-I322 HydrophobicContact CG-CD1 4.35Å; P263-I322 HydrophobicContact CG-CG1 4.13Å; A306-I322 HydrophobicContact CB-CD1 4.25Å; A306-I322 HydrophobicContact CB-CG2 4.46Å; A306-I322 VanDerWaalsContact O-CD1 3.27Å; A306-I322 WeakPolarHBondContact O-CD1 3.39Å; I322-Y324 HydrophobicContact CB-CE2 4.35Å; I322-Y324 HydrophobicContact CG2-CD1 4.46Å; I322-Y324 HydrophobicContact CG2-CD2 4.31Å; I322-Y324 HydrophobicContact CG2-CE1 3.99Å; I322-Y324 HydrophobicContact CG2-CE2 3.81Å; I322-R343 WeakPolarHBondContact O-CD 3.38Å; I322-R343 PolarHBondContact O-NH1 2.73Å; I322-A367 HydrophobicContact CG2-CB 3.99Å; I322-E368 CarbonylContact C-O 3.52Å; I322-E368 WeakPolarHBondContact CA-O 3.21Å
323	L	97.6	Very high	95.4	Very high	49 Å²	49	61 Å²	61	26%	0.257	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.1	171.9	-71.9	169.7	0	0	0	109.8	P342 A367 E368 D370	L323-P342 CarbonylContact C-O 3.6Å; L323-P342 WeakPolarHBondContact CA-O 3.48Å; L323-P342 HydrophobicContact CD2-CB 4.22Å; L323-A367 WeakPolarHBondContact O-CA 3.49Å; L323-E368 HydrophobicContact CB-CG 4.17Å; L323-E368 PolarHBondContact N-O 2.99Å; L323-E368 PolarHBondContact O-N 2.82Å; L323-D370 HydrophobicContact CD1-CB 3.69Å; L323-D370 HydrophobicContact CG-CB 3.97Å
324	Y	98	Very high	95.5	Very high	20 Å²	20	62 Å²	62	8%	0.078	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.4	175.6	-58.2	-86.1	0	0	0	110.6	F265 I304 A306 I322 P342 A345 K366 A367	F265-Y324 HydrophobicContact CE1-CD1 4.34Å; F265-Y324 HydrophobicContact CE1-CE1 4.22Å; I304-Y324 HydrophobicContact CG2-CD1 4.46Å; A306-Y324 HydrophobicContact CB-CE1 3.84Å; A306-Y324 PolarHBondContact N-OH 2.98Å; A306-Y324 PolarHBondContact O-OH 2.94Å; I322-Y324 HydrophobicContact CB-CE2 4.35Å; I322-Y324 HydrophobicContact CG2-CD1 4.46Å; I322-Y324 HydrophobicContact CG2-CD2 4.31Å; I322-Y324 HydrophobicContact CG2-CE1 3.99Å; I322-Y324 HydrophobicContact CG2-CE2 3.81Å; Y324-P342 PolarHBondContact N-O 3.04Å; Y324-P342 WeakPolarHBondContact O-CA 3.04Å; Y324-A345 HydrophobicContact CD1-CB 3.76Å; Y324-A345 HydrophobicContact CD2-CB 3.88Å; Y324-A345 HydrophobicContact CE1-CB 4.11Å; Y324-A345 HydrophobicContact CE2-CB 4.23Å; Y324-A345 HydrophobicContact CG-CB 3.63Å; Y324-K366 WeakPolarHBondContact CA-O 3.45Å; Y324-A367 HydrophobicContact CD1-CB 3.96Å; Y324-A367 HydrophobicContact CE1-CB 3.93Å
325	S	97.4	Very high	95.8	Very high	35 Å²	35	60.9 Å²	60.9	25%	0.245	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	150	175.8	48.3	0	0	0	0	111	I365 K366	S325-I365 WeakPolarHBondContact O-CA 3.29Å; S325-K366 PolarHBondContact N-O 2.91Å; S325-K366 PolarHBondContact O-N 2.67Å; S325-K366 WeakPolarHBondContact OG-CE 3.25Å
326	I	97.6	Very high	95.9	Very high	28 Å²	28	64.3 Å²	64.3	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.7	163.7	-53	161.6	0	0	0	106.3	Y334 F338 M340 L347 L363 I365	I326-Y334 HydrophobicContact CB-CE2 3.85Å; I326-Y334 HydrophobicContact CD1-CD2 4.34Å; I326-Y334 HydrophobicContact CD1-CE2 4.27Å; I326-Y334 HydrophobicContact CG2-CD2 3.9Å; I326-Y334 HydrophobicContact CG2-CE2 3.27Å; I326-F338 HydrophobicContact CD1-CB 4.11Å; I326-M340 HydrophobicContact CD1-CB 4.12Å; I326-M340 HydrophobicContact CG1-CB 4.01Å; I326-M340 HydrophobicContact CG1-CE 4.39Å; I326-M340 HydrophobicContact CG1-SD 4.45Å; I326-L347 HydrophobicContact CD1-CD1 4.35Å; I326-L363 HydrophobicContact CD1-CD1 4.26Å; I326-L363 HydrophobicContact CG2-CB 4.17Å; I326-L363 HydrophobicContact CG2-CD1 4.29Å; I326-I365 HydrophobicContact CB-CD1 4.34Å; I326-I365 HydrophobicContact CG1-CD1 3.75Å; I326-I365 HydrophobicContact CG2-CD1 4.38Å
327	L	96.5	Very high	96.1	Very high	76 Å²	76	60.8 Å²	60.8	40%	0.398	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-50.1	-175.1	178.2	66.1	0	0	0	111.5	V364 K366 F378	L327-V364 HydrophobicContact CD2-CG1 4.46Å; L327-V364 PolarHBondContact N-O 2.64Å; L327-K366 HydrophobicContact CB-CB 4.21Å; L327-K366 HydrophobicContact CD1-CD 4.45Å; L327-F378 HydrophobicContact CD2-CD1 3.91Å; L327-F378 HydrophobicContact CD2-CE1 3.69Å
328	V	96.4	Very high	96.2	Very high	81 Å²	81	56.5 Å²	56.5	49%	0.491	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	163.8	-179.8	-72.4	0	0	0	0	108.7	V364	V328-V364 HydrophobicContact CG2-CB 3.83Å; V328-V364 HydrophobicContact CG2-CG2 3.86Å; V328-V364 PolarHBondContact O-N 2.76Å
329	G	95.8	Very high	96.4	Very high	11 Å²	11	56.3 Å²	56.3	11%	0.113	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	160.1	176.4	0	0	0	0	0	112.4	P331 Y334 D362	G329-P331 CarbonylContact C-O 3.44Å; G329-Y334 VanDerWaalsContact N-CE1 3.33Å; G329-D362 CarbonylContact C-O 3.58Å; G329-D362 VanDerWaalsContact CA-O 3.25Å; G329-D362 WeakPolarHBondContact CA-O 3.44Å
330	T	95.9	Very high	96.5	Very high	87 Å²	87	52 Å²	52	53%	0.534	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.5	174.6	52.9	0	0	0	0	109.7	D362	T330-D362 PolarHBondContact N-O 3.04Å; T330-D362 PolarHBondContact O-N 2.88Å
331	P	96.1	Very high	96.7	Very high	50 Å²	50	55 Å²	55	33%	0.325	29%	0.291	S	S	.	.	S	Bend	cis	-57	152.3	-4.7	-28.6	38.3	0	0	0	115.5	G329 D333 Y334 K360 F361	G329-P331 CarbonylContact C-O 3.44Å; P331-D333 VanDerWaalsContact CB-OD1 3.26Å; P331-D333 WeakPolarHBondContact CB-OD1 3.34Å; P331-D333 PolarHBondContact O-N 3.5Å; P331-Y334 WeakPolarHBondContact O-CD1 3.41Å; P331-Y334 PolarHBondContact O-N 2.81Å; P331-K360 VanDerWaalsContact CD-O 3.31Å; P331-K360 WeakPolarHBondContact CD-O 3.37Å; P331-F361 HydrophobicContact CG-CD1 4.49Å; P331-F361 HydrophobicContact CG-CE1 4.49Å
332	E	94.3	Very high	96.8	Very high	174 Å²	174	56.3 Å²	56.3	81%	0.813	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.6	-177	-67.7	-170.5	163.9	0	0	113.7	Y334 P335	E332-Y334 PolarHBondContact O-N 3.22Å; E332-P335 WeakPolarHBondContact O-CD 3.35Å
333	D	96.3	Very high	96.7	Very high	50 Å²	50	60.7 Å²	60.7	27%	0.267	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	9.6	178.5	72.7	-34.5	0	0	0	113.8	P331 P335 R336 H358	P331-D333 VanDerWaalsContact CB-OD1 3.26Å; P331-D333 WeakPolarHBondContact CB-OD1 3.34Å; P331-D333 PolarHBondContact O-N 3.5Å; D333-P335 WeakPolarHBondContact O-CD 3.1Å; D333-P335 VanDerWaalsContact O-N 3.08Å; D333-R336 WeakPolarHBondContact O-CB 3.42Å; D333-R336 PolarHBondContact O-N 2.9Å; D333-R336 IonicContact OD2-NH1 3.66Å; D333-H358 IonicContact OD1-CD2 3.48Å; D333-H358 IonicContact OD1-NE2 3.48Å; D333-H358 PolarHBondContact OD1-NE2 2.98Å; D333-H358 VanDerWaalsContact OD1-NE2 3.11Å; D333-H358 IonicContact OD2-CE1 3.34Å; D333-H358 PolarHBondContact OD2-CE1 2.88Å; D333-H358 IonicContact OD2-NE2 3.94Å; D333-H358 PolarHBondContact OD2-NE2 3.28Å
334	Y	96.7	Very high	96.6	Very high	32 Å²	32	62.2 Å²	62.2	13%	0.125	32%	0.321	C	S	.	.	H	α-helix	trans	-45.5	-32.6	169.8	81.1	-94.7	0	0	0	115.7	I326 G329 P331 E332 R336 F337 F338 L363	I326-Y334 HydrophobicContact CB-CE2 3.85Å; I326-Y334 HydrophobicContact CD1-CD2 4.34Å; I326-Y334 HydrophobicContact CD1-CE2 4.27Å; I326-Y334 HydrophobicContact CG2-CD2 3.9Å; I326-Y334 HydrophobicContact CG2-CE2 3.27Å; G329-Y334 VanDerWaalsContact N-CE1 3.33Å; P331-Y334 WeakPolarHBondContact O-CD1 3.41Å; P331-Y334 PolarHBondContact O-N 2.81Å; E332-Y334 PolarHBondContact O-N 3.22Å; Y334-R336 PolarHBondContact O-N 3.1Å; Y334-R336 VanDerWaalsContact O-N 3.15Å; Y334-F337 PolarHBondContact O-N 3.27Å; Y334-F338 PolarHBondContact O-N 3.48Å; Y334-L363 HydrophobicContact CD1-CD2 4.09Å; Y334-L363 HydrophobicContact CD2-CD2 4Å; Y334-L363 HydrophobicContact CG-CD2 3.63Å
335	P	96.8	Very high	96.5	Very high	73 Å²	73	61.5 Å²	61.5	47%	0.474	32%	0.319	S	S	.	.	H	α-helix	trans	-67.4	-12.6	178.9	-19.6	33.6	0	0	0	114	E332 D333	E332-P335 WeakPolarHBondContact O-CD 3.35Å; D333-P335 WeakPolarHBondContact O-CD 3.1Å; D333-P335 VanDerWaalsContact O-N 3.08Å
336	R	96.4	Very high	96.5	Very high	136 Å²	136	64.2 Å²	64.2	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-74.3	-36.4	170.7	-67	176.5	54.6	-163.6	-5.1	112.3	D333 Y334 L350 E351	D333-R336 WeakPolarHBondContact O-CB 3.42Å; D333-R336 PolarHBondContact O-N 2.9Å; D333-R336 IonicContact OD2-NH1 3.66Å; Y334-R336 PolarHBondContact O-N 3.1Å; Y334-R336 VanDerWaalsContact O-N 3.15Å; R336-L350 VanDerWaalsContact O-CB 3.3Å; R336-L350 WeakPolarHBondContact O-CB 3.35Å; R336-E351 IonicContact CZ-OE1 2.7Å; R336-E351 IonicContact NE-OE1 2.8Å; R336-E351 PolarHBondContact NE-OE1 3.07Å; R336-E351 IonicContact NH2-OE1 3.2Å; R336-E351 PolarHBondContact NH2-OE1 2.59Å; R336-E351 IonicContact NH2-OE2 2.67Å
337	F	97.1	Very high	96.5	Very high	6 Å²	6	63 Å²	63	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-95.8	-34.4	-173.3	-60.4	-76.3	0	0	0	112.4	Y334 L349 L350 E351 V353 H358 F361	Y334-F337 PolarHBondContact O-N 3.27Å; F337-L349 HydrophobicContact CB-CD1 4.44Å; F337-L349 CarbonylContact O-C 3.59Å; F337-L349 VanDerWaalsContact O-CA 3.28Å; F337-L349 WeakPolarHBondContact O-CA 3.43Å; F337-L350 PolarHBondContact O-N 3.18Å; F337-E351 HydrophobicContact CD1-CG 3.59Å; F337-E351 HydrophobicContact CE1-CG 3.77Å; F337-E351 HydrophobicContact CG-CG 4.49Å; F337-V353 HydrophobicContact CD1-CG2 3.84Å; F337-V353 HydrophobicContact CE1-CG1 4.48Å; F337-V353 HydrophobicContact CE1-CG2 4.36Å; F337-V353 HydrophobicContact CG-CG2 4.42Å; F337-H358 AromaticContact CE2-CD2 3.9Å; F337-H358 AromaticContact CE2-CE1 3.57Å; F337-H358 AromaticContact CE2-NE2 3.49Å; F337-H358 WeakPolarHBondContact CE2-NE2 3.07Å; F337-H358 AromaticContact CZ-CE1 3.5Å; F337-H358 AromaticContact CZ-ND1 3.68Å; F337-H358 AromaticContact CZ-NE2 3.92Å; F337-F361 HydrophobicContact CB-CZ 4.48Å; F337-F361 AromaticContact CD2-CE1 3.76Å; F337-F361 HydrophobicContact CD2-CE1 3.76Å; F337-F361 AromaticContact CD2-CZ 3.55Å; F337-F361 HydrophobicContact CD2-CZ 3.55Å; F337-F361 HydrophobicContact CE2-CE1 4.22Å; F337-F361 AromaticContact CE2-CZ 3.91Å; F337-F361 HydrophobicContact CE2-CZ 3.91Å; F337-F361 HydrophobicContact CG-CZ 4.04Å
338	F	97.6	Very high	96.5	Very high	7 Å²	7	60.5 Å²	60.5	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.6	-169.3	-56.4	-65.2	0	0	0	113.5	I286 I326 Y334 L347 L349 F361 L363 I383	I286-F338 HydrophobicContact CD1-CE1 3.49Å; I286-F338 VanDerWaalsContact CD1-CE1 3.49Å; I286-F338 HydrophobicContact CD1-CZ 3.98Å; I326-F338 HydrophobicContact CD1-CB 4.11Å; Y334-F338 PolarHBondContact O-N 3.48Å; F338-L347 HydrophobicContact CB-CD1 4.13Å; F338-L347 HydrophobicContact CD1-CD1 4.39Å; F338-L347 HydrophobicContact CD1-CG 4.49Å; F338-L349 HydrophobicContact CD1-CD1 4.34Å; F338-L349 HydrophobicContact CE1-CD1 3.76Å; F338-L349 HydrophobicContact CZ-CD1 4.36Å; F338-F361 HydrophobicContact CD2-CD1 4.48Å; F338-F361 HydrophobicContact CD2-CG 4.47Å; F338-F361 HydrophobicContact CE2-CB 4.18Å; F338-F361 AromaticContact CE2-CD1 3.86Å; F338-F361 HydrophobicContact CE2-CD1 3.86Å; F338-F361 AromaticContact CE2-CD2 3.5Å; F338-F361 HydrophobicContact CE2-CD2 3.5Å; F338-F361 HydrophobicContact CE2-CE1 4.05Å; F338-F361 AromaticContact CE2-CE2 3.71Å; F338-F361 HydrophobicContact CE2-CE2 3.71Å; F338-F361 AromaticContact CE2-CG 3.58Å; F338-F361 HydrophobicContact CE2-CG 3.58Å; F338-F361 AromaticContact CE2-CZ 3.97Å; F338-F361 HydrophobicContact CE2-CZ 3.97Å; F338-F361 AromaticContact CZ-CD2 3.86Å; F338-F361 HydrophobicContact CZ-CD2 3.86Å; F338-F361 AromaticContact CZ-CE2 3.99Å; F338-F361 HydrophobicContact CZ-CE2 3.99Å; F338-F361 HydrophobicContact CZ-CG 4.35Å; F338-L363 HydrophobicContact CD2-CD1 4.32Å; F338-I383 HydrophobicContact CD1-CD1 4.09Å; F338-I383 HydrophobicContact CD2-CD1 4.15Å; F338-I383 HydrophobicContact CE1-CD1 3.85Å; F338-I383 HydrophobicContact CE2-CD1 3.91Å; F338-I383 HydrophobicContact CG-CD1 4.24Å; F338-I383 HydrophobicContact CZ-CD1 3.75Å; F338-I383 HydrophobicContact CZ-CG2 4.19Å
339	H	97	Very high	96.5	Very high	92 Å²	92	56.8 Å²	56.8	43%	0.426	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.2	165.7	170	-92.7	0	0	0	109.5	T348 L350	H339-T348 PolarHBondContact N-O 2.95Å; H339-T348 PolarHBondContact ND1-OG1 3.32Å; H339-T348 PolarHBondContact O-N 2.68Å; H339-T348 PolarHBondContact O-OG1 2.7Å; H339-L350 HydrophobicContact CB-CD1 4.05Å; H339-L350 HydrophobicContact CB-CD2 3.86Å; H339-L350 HydrophobicContact CB-CG 4.1Å
340	M	97.5	Very high	96.6	Very high	13 Å²	13	60.5 Å²	60.5	6%	0.064	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125	176.5	176.6	171	-76.3	0	0	110	I304 I326 E346 L347 I365	I304-M340 HydrophobicContact CD1-CE 3.61Å; I326-M340 HydrophobicContact CD1-CB 4.12Å; I326-M340 HydrophobicContact CG1-CB 4.01Å; I326-M340 HydrophobicContact CG1-CE 4.39Å; I326-M340 HydrophobicContact CG1-SD 4.45Å; M340-E346 CarbonylContact C-O 3.46Å; M340-E346 WeakPolarHBondContact CA-O 3.38Å; M340-L347 HydrophobicContact CE-CD1 4.39Å; M340-I365 HydrophobicContact CE-CD1 3.53Å; M340-I365 HydrophobicContact CE-CG1 4.04Å; M340-I365 HydrophobicContact CE-CG2 4.02Å; M340-I365 HydrophobicContact SD-CD1 4.22Å; M340-I365 HydrophobicContact SD-CG2 3.74Å
341	H	97.2	Very high	96.5	Very high	80 Å²	80	59.4 Å²	59.4	37%	0.37	29%	0.293	S	S	.	.			trans	-71.8	122.9	179.9	-176.9	-100.8	0	0	0	111.2	R343 T344 A345 E346	H341-R343 PolarHBondContact O-N 3.3Å; H341-T344 PolarHBondContact ND1-OG1 3.01Å; H341-T344 PolarHBondContact O-N 2.86Å; H341-A345 PolarHBondContact O-N 3.15Å; H341-E346 HydrophobicContact CB-CB 4.16Å; H341-E346 PolarHBondContact N-O 2.67Å
342	P	97	Very high	96.4	Very high	55 Å²	55	59.8 Å²	59.8	36%	0.357	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.7	-161.6	26	-36.1	0	0	0	115.2	L323 Y324	L323-P342 CarbonylContact C-O 3.6Å; L323-P342 WeakPolarHBondContact CA-O 3.48Å; L323-P342 HydrophobicContact CD2-CB 4.22Å; Y324-P342 PolarHBondContact N-O 3.04Å; Y324-P342 WeakPolarHBondContact O-CA 3.04Å
343	R	95.7	Very high	96.4	Very high	120 Å²	120	51.5 Å²	51.5	45%	0.453	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-19.2	179.6	-65.3	-58.1	-167	172.5	8.2	115	I322 H341 D370	I322-R343 WeakPolarHBondContact O-CD 3.38Å; I322-R343 PolarHBondContact O-NH1 2.73Å; H341-R343 PolarHBondContact O-N 3.3Å; R343-D370 IonicContact CZ-OD2 2.93Å; R343-D370 IonicContact NH1-OD2 2.87Å; R343-D370 PolarHBondContact NH1-OD2 2.8Å; R343-D370 IonicContact NH2-OD2 3.39Å; R343-D370 PolarHBondContact NH2-OD2 2.89Å
344	T	95.8	Very high	96.1	Very high	80 Å²	80	51 Å²	51	49%	0.491	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-7.6	-175.2	57.1	0	0	0	0	113	H341 E346	H341-T344 PolarHBondContact ND1-OG1 3.01Å; H341-T344 PolarHBondContact O-N 2.86Å; T344-E346 PolarHBondContact O-N 2.95Å; T344-E346 VanDerWaalsContact O-N 3.09Å; T344-E346 WeakPolarHBondContact OG1-CB 3.43Å; T344-E346 PolarHBondContact OG1-N 3.05Å
345	A	96.2	Very high	95.7	Very high	5 Å²	5	53.2 Å²	53.2	4%	0.041	26%	0.262	C	S	.	.			trans	56.1	15.7	-170.1	0	0	0	0	0	114.5	I304 Y324 H341 L347	I304-A345 HydrophobicContact CB-CB 3.73Å; I304-A345 HydrophobicContact CG2-CB 3.55Å; Y324-A345 HydrophobicContact CD1-CB 3.76Å; Y324-A345 HydrophobicContact CD2-CB 3.88Å; Y324-A345 HydrophobicContact CE1-CB 4.11Å; Y324-A345 HydrophobicContact CE2-CB 4.23Å; Y324-A345 HydrophobicContact CG-CB 3.63Å; H341-A345 PolarHBondContact O-N 3.15Å; A345-L347 PolarHBondContact O-N 3.37Å
346	E	96.4	Very high	95.1	Very high	92 Å²	92	53.8 Å²	53.8	43%	0.43	26%	0.261	S	S	.	.			trans	-64.7	126.3	177.8	-171.9	177.4	103.4	0	0	109.8	P297 M340 H341 T344	P297-E346 HydrophobicContact CB-CG 3.44Å; P297-E346 VanDerWaalsContact CB-CG 3.44Å; P297-E346 HydrophobicContact CG-CG 4.33Å; M340-E346 CarbonylContact C-O 3.46Å; M340-E346 WeakPolarHBondContact CA-O 3.38Å; H341-E346 HydrophobicContact CB-CB 4.16Å; H341-E346 PolarHBondContact N-O 2.67Å; T344-E346 PolarHBondContact O-N 2.95Å; T344-E346 VanDerWaalsContact O-N 3.09Å; T344-E346 WeakPolarHBondContact OG1-CB 3.43Å; T344-E346 PolarHBondContact OG1-N 3.05Å
347	L	97.3	Very high	94.8	Very high	2 Å²	2	55 Å²	55	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.1	-179.4	-173.8	70.1	0	0	0	109.4	I298 V300 I326 F338 M340 A345 L381 I383	I298-L347 HydrophobicContact CB-CB 4.25Å; I298-L347 HydrophobicContact CB-CD2 4.08Å; I298-L347 HydrophobicContact CB-CG 4.23Å; I298-L347 HydrophobicContact CG2-CD2 3.98Å; I298-L347 PolarHBondContact N-O 2.79Å; V300-L347 HydrophobicContact CG2-CB 4.2Å; V300-L347 HydrophobicContact CG2-CD2 4.01Å; I326-L347 HydrophobicContact CD1-CD1 4.35Å; F338-L347 HydrophobicContact CB-CD1 4.13Å; F338-L347 HydrophobicContact CD1-CD1 4.39Å; F338-L347 HydrophobicContact CD1-CG 4.49Å; M340-L347 HydrophobicContact CE-CD1 4.39Å; A345-L347 PolarHBondContact O-N 3.37Å; L347-L381 HydrophobicContact CD2-CD2 3.91Å; L347-I383 HydrophobicContact CD2-CD1 4Å
348	T	97.2	Very high	94.5	Very high	25 Å²	25	55.9 Å²	55.9	15%	0.153	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.9	179.3	49.4	0	0	0	0	110.7	N296 H339	N296-T348 VanDerWaalsContact OD1-CA 3.25Å; N296-T348 WeakPolarHBondContact OD1-CA 3.12Å; H339-T348 PolarHBondContact N-O 2.95Å; H339-T348 PolarHBondContact ND1-OG1 3.32Å; H339-T348 PolarHBondContact O-N 2.68Å; H339-T348 PolarHBondContact O-OG1 2.7Å
349	L	97.3	Very high	94.3	Very high	3 Å²	3	62 Å²	62	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.9	166.3	-172.1	71.3	0	0	0	109.6	I286 P292 L295 N296 I298 F337 F338 E351 V353	I286-L349 HydrophobicContact CD1-CD1 4.45Å; I286-L349 HydrophobicContact CG2-CD2 4.43Å; P292-L349 WeakPolarHBondContact CB-O 3.28Å; L295-L349 HydrophobicContact CD1-CD2 4.09Å; N296-L349 PolarHBondContact ND2-O 2.83Å; N296-L349 PolarHBondContact OD1-N 2.74Å; I298-L349 HydrophobicContact CD1-CB 4.08Å; I298-L349 HydrophobicContact CG1-CB 4.25Å; F337-L349 HydrophobicContact CB-CD1 4.44Å; F337-L349 CarbonylContact O-C 3.59Å; F337-L349 VanDerWaalsContact O-CA 3.28Å; F337-L349 WeakPolarHBondContact O-CA 3.43Å; F338-L349 HydrophobicContact CD1-CD1 4.34Å; F338-L349 HydrophobicContact CE1-CD1 3.76Å; F338-L349 HydrophobicContact CZ-CD1 4.36Å; L349-E351 WeakPolarHBondContact CD1-O 3.38Å; L349-E351 WeakPolarHBondContact CG-O 3.27Å; L349-V353 HydrophobicContact CD1-CG2 3.79Å
350	L	96.6	Very high	94.2	Very high	89 Å²	89	62.4 Å²	62.4	47%	0.466	30%	0.304	S	S	.	.			trans	-107.3	-35.7	-176.5	-65.1	178.1	0	0	0	113.1	P292 R336 F337 H339	P292-L350 WeakPolarHBondContact CG-O 3.4Å; R336-L350 VanDerWaalsContact O-CB 3.3Å; R336-L350 WeakPolarHBondContact O-CB 3.35Å; F337-L350 PolarHBondContact O-N 3.18Å; H339-L350 HydrophobicContact CB-CD1 4.05Å; H339-L350 HydrophobicContact CB-CD2 3.86Å; H339-L350 HydrophobicContact CB-CG 4.1Å
351	E	94.2	Very high	94.2	Very high	63 Å²	63	61.8 Å²	61.8	29%	0.294	30%	0.301	S	S	.	.	S	Bend	trans	-142.5	150.2	175.9	64.9	-173.5	-164.1	0	0	109.9	R336 F337 L349 V353	R336-E351 IonicContact CZ-OE1 2.7Å; R336-E351 IonicContact NE-OE1 2.8Å; R336-E351 PolarHBondContact NE-OE1 3.07Å; R336-E351 IonicContact NH2-OE1 3.2Å; R336-E351 PolarHBondContact NH2-OE1 2.59Å; R336-E351 IonicContact NH2-OE2 2.67Å; F337-E351 HydrophobicContact CD1-CG 3.59Å; F337-E351 HydrophobicContact CE1-CG 3.77Å; F337-E351 HydrophobicContact CG-CG 4.49Å; L349-E351 WeakPolarHBondContact CD1-O 3.38Å; L349-E351 WeakPolarHBondContact CG-O 3.27Å; E351-V353 PolarHBondContact O-N 2.95Å
352	P	94.5	Very high	94.2	Very high	58 Å²	58	60.8 Å²	60.8	38%	0.377	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-55.8	135.5	175.8	-24.4	33.9	0	0	0	111.8	R290	R290-P352 WeakPolarHBondContact O-CA 3.32Å; R290-P352 VanDerWaalsContact O-CB 3.3Å; R290-P352 WeakPolarHBondContact O-CB 3.49Å; R290-P352 WeakPolarHBondContact O-CG 3.28Å
353	V	93.6	Very high	94.2	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-88.6	132.4	174.7	-166.1	0	0	0	0	108.6	E288 L289 F337 L349 E351 H358 F361 I385	E288-V353 CarbonylContact C-O 3.23Å; E288-V353 WeakPolarHBondContact CA-O 3.05Å; E288-V353 WeakPolarHBondContact CB-O 3.21Å; L289-V353 PolarHBondContact N-O 2.94Å; F337-V353 HydrophobicContact CD1-CG2 3.84Å; F337-V353 HydrophobicContact CE1-CG1 4.48Å; F337-V353 HydrophobicContact CE1-CG2 4.36Å; F337-V353 HydrophobicContact CG-CG2 4.42Å; L349-V353 HydrophobicContact CD1-CG2 3.79Å; E351-V353 PolarHBondContact O-N 2.95Å; V353-H358 HydrophobicContact CG1-CB 3.58Å; V353-F361 HydrophobicContact CG1-CE2 4.07Å; V353-F361 HydrophobicContact CG1-CZ 4.43Å; V353-I385 HydrophobicContact CB-CD1 4.23Å; V353-I385 HydrophobicContact CB-CG2 4.38Å; V353-I385 HydrophobicContact CG1-CD1 4.02Å; V353-I385 HydrophobicContact CG1-CG1 3.98Å; V353-I385 HydrophobicContact CG1-CG2 4.14Å; V353-I385 HydrophobicContact CG2-CD1 4.13Å
354	N	90.2	Very high	94.3	Very high	39 Å²	39	54.5 Å²	54.5	21%	0.209	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-102.3	130.2	167.6	167.6	-61.2	0	0	0	108.3	L289 D356 F357 H358	L289-N354 HydrophobicContact CD2-CB 3.82Å; N354-D356 WeakPolarHBondContact OD1-CA 3.3Å; N354-D356 WeakPolarHBondContact OD1-CB 3.33Å; N354-D356 PolarHBondContact OD1-N 3.44Å; N354-F357 HydrophobicContact CB-CD2 4.12Å; N354-F357 PolarHBondContact O-N 2.68Å; N354-F357 WeakPolarHBondContact OD1-CD2 3.38Å; N354-H358 PolarHBondContact O-N 3.23Å
355	R	88.5	Confident	94.4	Very high	78 Å²	78	50.7 Å²	50.7	29%	0.294	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-23	-169.9	-166.4	175	165	-88.3	12.7	113.9	E288 F357 H358 Q359 I385 D387	E288-R355 HydrophobicContact CB-CB 4.09Å; E288-R355 HydrophobicContact CG-CB 4.31Å; E288-R355 WeakPolarHBondContact OE1-CB 3.25Å; E288-R355 WeakPolarHBondContact OE2-CB 3.38Å; E288-R355 PolarHBondContact OE2-N 3.41Å; R355-F357 PolarHBondContact O-N 2.93Å; R355-H358 PolarHBondContact O-N 3.44Å; R355-Q359 HydrophobicContact CG-CG 4.46Å; R355-Q359 WeakPolarHBondContact O-CG 3.32Å; R355-I385 HydrophobicContact CB-CG2 3.99Å; R355-I385 WeakPolarHBondContact CD-O 3.44Å; R355-I385 HydrophobicContact CG-CB 4.37Å; R355-I385 HydrophobicContact CG-CG2 4.04Å; R355-I385 PolarHBondContact NE-O 2.93Å; R355-D387 IonicContact CZ-OD2 2.7Å; R355-D387 IonicContact NE-OD2 3.21Å; R355-D387 IonicContact NH1-OD2 3.34Å; R355-D387 PolarHBondContact NH1-OD2 3.21Å; R355-D387 IonicContact NH2-OD2 3.7Å; R355-D387 PolarHBondContact NH2-OD2 3.12Å
356	D	83.8	Confident	94.5	Very high	86 Å²	86	52.1 Å²	52.1	46%	0.46	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-33.6	172.2	-65.1	-48.6	0	0	0	111.1	N354 Q391	N354-D356 WeakPolarHBondContact OD1-CA 3.3Å; N354-D356 WeakPolarHBondContact OD1-CB 3.33Å; N354-D356 PolarHBondContact OD1-N 3.44Å; D356-Q391 PolarHBondContact OD2-NE2 2.9Å; D356-Q391 VanDerWaalsContact OD2-NE2 3.12Å
357	F	89.7	Confident	94.5	Very high	161 Å²	161	47.8 Å²	47.8	71%	0.706	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-35.2	179.5	-56.9	-74.3	0	0	0	113.2	N354 R355	N354-F357 HydrophobicContact CB-CD2 4.12Å; N354-F357 PolarHBondContact O-N 2.68Å; N354-F357 WeakPolarHBondContact OD1-CD2 3.38Å; R355-F357 PolarHBondContact O-N 2.93Å
358	H	92.1	Very high	94.5	Very high	24 Å²	24	49.7 Å²	49.7	11%	0.111	24%	0.242	C	C	.	.			trans	-135.9	92.5	-170.6	-65.9	92.5	0	0	0	111.2	D333 F337 V353 N354 R355 F361 I385	D333-H358 IonicContact OD1-CD2 3.48Å; D333-H358 IonicContact OD1-NE2 3.48Å; D333-H358 PolarHBondContact OD1-NE2 2.98Å; D333-H358 VanDerWaalsContact OD1-NE2 3.11Å; D333-H358 IonicContact OD2-CE1 3.34Å; D333-H358 PolarHBondContact OD2-CE1 2.88Å; D333-H358 IonicContact OD2-NE2 3.94Å; D333-H358 PolarHBondContact OD2-NE2 3.28Å; F337-H358 AromaticContact CE2-CD2 3.9Å; F337-H358 AromaticContact CE2-CE1 3.57Å; F337-H358 AromaticContact CE2-NE2 3.49Å; F337-H358 WeakPolarHBondContact CE2-NE2 3.07Å; F337-H358 AromaticContact CZ-CE1 3.5Å; F337-H358 AromaticContact CZ-ND1 3.68Å; F337-H358 AromaticContact CZ-NE2 3.92Å; V353-H358 HydrophobicContact CG1-CB 3.58Å; N354-H358 PolarHBondContact O-N 3.23Å; R355-H358 PolarHBondContact O-N 3.44Å; H358-F361 HydrophobicContact CB-CE2 3.95Å; H358-F361 HydrophobicContact CB-CZ 3.76Å; H358-F361 AromaticContact CD2-CE1 3.7Å; H358-F361 AromaticContact CD2-CZ 3.42Å; H358-F361 VanDerWaalsContact CD2-CZ 3.42Å; H358-F361 WeakPolarHBondContact CD2-CZ 3.28Å; H358-F361 AromaticContact CG-CZ 3.77Å; H358-I385 WeakPolarHBondContact O-CB 3.31Å; H358-I385 VanDerWaalsContact O-CG1 3.23Å; H358-I385 WeakPolarHBondContact O-CG1 3.37Å
359	Q	91.5	Very high	94.5	Very high	136 Å²	136	48.8 Å²	48.8	64%	0.636	24%	0.236	S	C	*	.	S	Bend	trans	-78.2	-27.6	-179.8	-64.3	167.9	8	0	0	113.5	R355 I385	R355-Q359 HydrophobicContact CG-CG 4.46Å; R355-Q359 WeakPolarHBondContact O-CG 3.32Å; Q359-I385 WeakPolarHBondContact O-CB 3.27Å; Q359-I385 PolarHBondContact O-N 2.75Å; Q359-I385 VanDerWaalsContact O-N 3.09Å
360	K	95.1	Very high	94.5	Very high	101 Å²	101	51.6 Å²	51.6	44%	0.439	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	163.5	-178.1	58.5	163.6	-174	149.7	0	112.4	P331 D362 I383	P331-K360 VanDerWaalsContact CD-O 3.31Å; P331-K360 WeakPolarHBondContact CD-O 3.37Å; K360-D362 IonicContact NZ-OD2 2.71Å; K360-D362 PolarHBondContact NZ-OD2 2.83Å; K360-I383 CarbonylContact C-O 3.6Å; K360-I383 WeakPolarHBondContact CA-O 3.21Å; K360-I383 WeakPolarHBondContact CB-O 3.42Å
361	F	97.7	Very high	94.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.8	169.8	-58.9	-100.2	0	0	0	110.9	P331 F337 F338 V353 H358 L363 I383 I385	P331-F361 HydrophobicContact CG-CD1 4.49Å; P331-F361 HydrophobicContact CG-CE1 4.49Å; F337-F361 HydrophobicContact CB-CZ 4.48Å; F337-F361 AromaticContact CD2-CE1 3.76Å; F337-F361 HydrophobicContact CD2-CE1 3.76Å; F337-F361 AromaticContact CD2-CZ 3.55Å; F337-F361 HydrophobicContact CD2-CZ 3.55Å; F337-F361 HydrophobicContact CE2-CE1 4.22Å; F337-F361 AromaticContact CE2-CZ 3.91Å; F337-F361 HydrophobicContact CE2-CZ 3.91Å; F337-F361 HydrophobicContact CG-CZ 4.04Å; F338-F361 HydrophobicContact CD2-CD1 4.48Å; F338-F361 HydrophobicContact CD2-CG 4.47Å; F338-F361 HydrophobicContact CE2-CB 4.18Å; F338-F361 AromaticContact CE2-CD1 3.86Å; F338-F361 HydrophobicContact CE2-CD1 3.86Å; F338-F361 AromaticContact CE2-CD2 3.5Å; F338-F361 HydrophobicContact CE2-CD2 3.5Å; F338-F361 HydrophobicContact CE2-CE1 4.05Å; F338-F361 AromaticContact CE2-CE2 3.71Å; F338-F361 HydrophobicContact CE2-CE2 3.71Å; F338-F361 AromaticContact CE2-CG 3.58Å; F338-F361 HydrophobicContact CE2-CG 3.58Å; F338-F361 AromaticContact CE2-CZ 3.97Å; F338-F361 HydrophobicContact CE2-CZ 3.97Å; F338-F361 AromaticContact CZ-CD2 3.86Å; F338-F361 HydrophobicContact CZ-CD2 3.86Å; F338-F361 AromaticContact CZ-CE2 3.99Å; F338-F361 HydrophobicContact CZ-CE2 3.99Å; F338-F361 HydrophobicContact CZ-CG 4.35Å; V353-F361 HydrophobicContact CG1-CE2 4.07Å; V353-F361 HydrophobicContact CG1-CZ 4.43Å; H358-F361 HydrophobicContact CB-CE2 3.95Å; H358-F361 HydrophobicContact CB-CZ 3.76Å; H358-F361 AromaticContact CD2-CE1 3.7Å; H358-F361 AromaticContact CD2-CZ 3.42Å; H358-F361 VanDerWaalsContact CD2-CZ 3.42Å; H358-F361 WeakPolarHBondContact CD2-CZ 3.28Å; H358-F361 AromaticContact CG-CZ 3.77Å; F361-L363 HydrophobicContact CB-CD2 4.14Å; F361-L363 HydrophobicContact CB-CG 4.35Å; F361-I383 HydrophobicContact CB-CB 4.23Å; F361-I383 HydrophobicContact CB-CD1 4.5Å; F361-I383 PolarHBondContact N-O 3.13Å; F361-I383 PolarHBondContact O-N 2.85Å; F361-I385 HydrophobicContact CD2-CD1 4.22Å; F361-I385 HydrophobicContact CD2-CG1 4.36Å; F361-I385 HydrophobicContact CE2-CD1 4.09Å; F361-I385 HydrophobicContact CE2-CG1 4.17Å
362	D	97.9	Very high	94.2	Very high	58 Å²	58	50.4 Å²	50.4	31%	0.31	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	105	174.8	-75.1	-64.5	0	0	0	108.1	G329 T330 K360 H382	G329-D362 CarbonylContact C-O 3.58Å; G329-D362 VanDerWaalsContact CA-O 3.25Å; G329-D362 WeakPolarHBondContact CA-O 3.44Å; T330-D362 PolarHBondContact N-O 3.04Å; T330-D362 PolarHBondContact O-N 2.88Å; K360-D362 IonicContact NZ-OD2 2.71Å; K360-D362 PolarHBondContact NZ-OD2 2.83Å; D362-H382 IonicContact OD1-CE1 3.82Å; D362-H382 IonicContact OD1-CG 3.72Å; D362-H382 IonicContact OD1-ND1 3.19Å; D362-H382 PolarHBondContact OD1-ND1 2.94Å
363	L	97.8	Very high	94.2	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	155.6	-172.6	-50.7	-175.7	0	0	0	112.1	I326 Y334 F338 F361 S380 L381 I383	I326-L363 HydrophobicContact CD1-CD1 4.26Å; I326-L363 HydrophobicContact CG2-CB 4.17Å; I326-L363 HydrophobicContact CG2-CD1 4.29Å; Y334-L363 HydrophobicContact CD1-CD2 4.09Å; Y334-L363 HydrophobicContact CD2-CD2 4Å; Y334-L363 HydrophobicContact CG-CD2 3.63Å; F338-L363 HydrophobicContact CD2-CD1 4.32Å; F361-L363 HydrophobicContact CB-CD2 4.14Å; F361-L363 HydrophobicContact CB-CG 4.35Å; L363-S380 CarbonylContact O-C 3.24Å; L363-S380 WeakPolarHBondContact O-CA 3.08Å; L363-L381 HydrophobicContact CB-CB 4.28Å; L363-L381 HydrophobicContact CD1-CD2 4.23Å; L363-L381 PolarHBondContact N-O 3.07Å; L363-L381 PolarHBondContact O-N 2.9Å; L363-I383 HydrophobicContact CD1-CD1 3.77Å; L363-I383 HydrophobicContact CG-CD1 4.48Å
364	V	97.7	Very high	94.1	Very high	42 Å²	42	56 Å²	56	26%	0.255	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.9	170.9	-178.8	0	0	0	0	109.4	L327 V328 F378	L327-V364 HydrophobicContact CD2-CG1 4.46Å; L327-V364 PolarHBondContact N-O 2.64Å; V328-V364 HydrophobicContact CG2-CB 3.83Å; V328-V364 HydrophobicContact CG2-CG2 3.86Å; V328-V364 PolarHBondContact O-N 2.76Å; V364-F378 HydrophobicContact CG1-CB 4.28Å; V364-F378 HydrophobicContact CG1-CD1 4.49Å
365	I	97.4	Very high	94.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.4	177.7	-49.8	-50	0	0	0	109.1	F265 S325 I326 M340 F378 A379 L381	F265-I365 HydrophobicContact CE1-CG2 4.29Å; F265-I365 HydrophobicContact CZ-CB 4.32Å; F265-I365 HydrophobicContact CZ-CG2 3.98Å; S325-I365 WeakPolarHBondContact O-CA 3.29Å; I326-I365 HydrophobicContact CB-CD1 4.34Å; I326-I365 HydrophobicContact CG1-CD1 3.75Å; I326-I365 HydrophobicContact CG2-CD1 4.38Å; M340-I365 HydrophobicContact CE-CD1 3.53Å; M340-I365 HydrophobicContact CE-CG1 4.04Å; M340-I365 HydrophobicContact CE-CG2 4.02Å; M340-I365 HydrophobicContact SD-CD1 4.22Å; M340-I365 HydrophobicContact SD-CG2 3.74Å; I365-F378 WeakPolarHBondContact O-CA 3.27Å; I365-A379 PolarHBondContact N-O 2.7Å; I365-A379 PolarHBondContact O-N 3.21Å; I365-L381 HydrophobicContact CD1-CB 4.19Å; I365-L381 HydrophobicContact CD1-CD2 4.03Å; I365-L381 HydrophobicContact CG1-CB 3.91Å; I365-L381 HydrophobicContact CG1-CD2 4.37Å
366	K	97.6	Very high	94.7	Very high	35 Å²	35	56.3 Å²	56.3	15%	0.152	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.5	173.2	-178.5	-173.4	66.3	157.8	0	109.6	Y324 S325 L327 E368 P376 A377 F378	Y324-K366 WeakPolarHBondContact CA-O 3.45Å; S325-K366 PolarHBondContact N-O 2.91Å; S325-K366 PolarHBondContact O-N 2.67Å; S325-K366 WeakPolarHBondContact OG-CE 3.25Å; L327-K366 HydrophobicContact CB-CB 4.21Å; L327-K366 HydrophobicContact CD1-CD 4.45Å; K366-E368 VanDerWaalsContact CE-CD 3.45Å; K366-E368 WeakPolarHBondContact CE-OE1 3.09Å; K366-E368 VanDerWaalsContact CE-OE2 3.31Å; K366-E368 WeakPolarHBondContact CE-OE2 3.25Å; K366-E368 IonicContact NZ-OE1 3.31Å; K366-E368 PolarHBondContact NZ-OE1 3.46Å; K366-E368 IonicContact NZ-OE2 2.63Å; K366-E368 PolarHBondContact NZ-OE2 2.71Å; K366-P376 HydrophobicContact CD-CB 3.91Å; K366-P376 HydrophobicContact CG-CB 3.81Å; K366-A377 WeakPolarHBondContact CA-O 3.39Å; K366-F378 HydrophobicContact CB-CD1 4.15Å; K366-F378 HydrophobicContact CB-CE1 4.2Å; K366-F378 HydrophobicContact CD-CE1 4.13Å; K366-F378 HydrophobicContact CG-CD1 4.17Å; K366-F378 HydrophobicContact CG-CE1 3.81Å
367	A	97.6	Very high	95.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.1	166.7	0	0	0	0	0	108.9	P263 F265 A306 I322 L323 Y324 P376 A377	P263-A367 HydrophobicContact CB-CB 4.38Å; F265-A367 HydrophobicContact CE1-CB 3.87Å; F265-A367 HydrophobicContact CE2-CB 3.97Å; F265-A367 HydrophobicContact CZ-CB 3.49Å; F265-A367 VanDerWaalsContact CZ-CB 3.49Å; A306-A367 HydrophobicContact CB-CB 3.74Å; I322-A367 HydrophobicContact CG2-CB 3.99Å; L323-A367 WeakPolarHBondContact O-CA 3.49Å; Y324-A367 HydrophobicContact CD1-CB 3.96Å; Y324-A367 HydrophobicContact CE1-CB 3.93Å; A367-P376 WeakPolarHBondContact O-CA 3.42Å; A367-A377 PolarHBondContact N-O 2.83Å; A367-A377 PolarHBondContact O-N 3.25Å
368	E	97.3	Very high	95.7	Very high	42 Å²	42	51 Å²	51	20%	0.196	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	160	-176.4	76.4	-172	159.3	0	0	112.2	I322 L323 K366 P374 P376	I322-E368 CarbonylContact C-O 3.52Å; I322-E368 WeakPolarHBondContact CA-O 3.21Å; L323-E368 HydrophobicContact CB-CG 4.17Å; L323-E368 PolarHBondContact N-O 2.99Å; L323-E368 PolarHBondContact O-N 2.82Å; K366-E368 VanDerWaalsContact CE-CD 3.45Å; K366-E368 WeakPolarHBondContact CE-OE1 3.09Å; K366-E368 VanDerWaalsContact CE-OE2 3.31Å; K366-E368 WeakPolarHBondContact CE-OE2 3.25Å; K366-E368 IonicContact NZ-OE1 3.31Å; K366-E368 PolarHBondContact NZ-OE1 3.46Å; K366-E368 IonicContact NZ-OE2 2.63Å; K366-E368 PolarHBondContact NZ-OE2 2.71Å; E368-P374 CarbonylContact C-O 3.55Å; E368-P374 VanDerWaalsContact CA-O 3.27Å; E368-P374 WeakPolarHBondContact CA-O 3.24Å; E368-P374 HydrophobicContact CB-CB 3.95Å; E368-P374 VanDerWaalsContact CB-O 3.29Å; E368-P374 WeakPolarHBondContact CB-O 3.46Å; E368-P374 HydrophobicContact CG-CB 4.24Å; E368-P376 HydrophobicContact CB-CB 4.04Å
369	Q	97.5	Very high	95.9	Very high	6 Å²	6	50 Å²	50	3%	0.028	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	144.9	178.7	-74.1	159.8	-142.1	0	0	112.7	D259 L261 G262 P263 P320 H373 P374	D259-Q369 PolarHBondContact OD1-NE2 3.47Å; L261-Q369 PolarHBondContact O-OE1 2.7Å; L261-Q369 VanDerWaalsContact O-OE1 3.05Å; G262-Q369 VanDerWaalsContact CA-OE1 3.29Å; P263-Q369 HydrophobicContact CG-CG 4.04Å; P320-Q369 HydrophobicContact CB-CB 3.8Å; P320-Q369 HydrophobicContact CB-CG 3.73Å; P320-Q369 HydrophobicContact CG-CB 4.13Å; P320-Q369 HydrophobicContact CG-CG 3.52Å; Q369-H373 WeakPolarHBondContact CB-O 3.17Å; Q369-H373 PolarHBondContact NE2-O 3.03Å; Q369-P374 PolarHBondContact N-O 3.37Å
370	D	95.7	Very high	96.2	Very high	63 Å²	63	46.1 Å²	46.1	34%	0.337	26%	0.259	S	S	.	.	S	Bend	trans	-94.6	1.2	-176.2	70.6	-0.5	0	0	0	115.6	G321 L323 R343 G372	G321-D370 WeakPolarHBondContact CA-OD1 3.48Å; G321-D370 WeakPolarHBondContact CA-OD2 3.32Å; G321-D370 PolarHBondContact N-OD1 2.83Å; G321-D370 WeakPolarHBondContact O-CB 3.4Å; G321-D370 PolarHBondContact O-N 2.9Å; L323-D370 HydrophobicContact CD1-CB 3.69Å; L323-D370 HydrophobicContact CG-CB 3.97Å; R343-D370 IonicContact CZ-OD2 2.93Å; R343-D370 IonicContact NH1-OD2 2.87Å; R343-D370 PolarHBondContact NH1-OD2 2.8Å; R343-D370 IonicContact NH2-OD2 3.39Å; R343-D370 PolarHBondContact NH2-OD2 2.89Å; D370-G372 VanDerWaalsContact C-N 3.32Å; D370-G372 PolarHBondContact O-N 2.85Å
371	N	93.6	Very high	96.3	Very high	64 Å²	64	41.4 Å²	41.4	34%	0.342	24%	0.238	S	C	.	.	S	Bend	trans	-84.5	-0.3	-177.5	67.8	-2.3	0	0	0	114.4	D259 P320 H373	D259-N371 PolarHBondContact OD2-ND2 3.02Å; P320-N371 HydrophobicContact CB-CB 4.14Å; N371-H373 PolarHBondContact OD1-N 3.39Å
372	G	91.9	Very high	96.3	Very high	63 Å²	63	43.3 Å²	43.3	65%	0.649	25%	0.247	S	C	*	.	S	Bend	trans	99.1	-7.4	-177.1	0	0	0	0	0	114.9	D370 P374	D370-G372 VanDerWaalsContact C-N 3.32Å; D370-G372 PolarHBondContact O-N 2.85Å; G372-P374 VanDerWaalsContact O-CD 3.27Å; G372-P374 WeakPolarHBondContact O-CD 3.49Å
373	H	93.5	Very high	96.3	Very high	121 Å²	121	40.6 Å²	40.6	56%	0.56	23%	0.233	S	C	*	.			trans	-111.3	76.9	173	-68.7	-97.1	0	0	0	108.9	Q369 N371 L375	Q369-H373 WeakPolarHBondContact CB-O 3.17Å; Q369-H373 PolarHBondContact NE2-O 3.03Å; N371-H373 PolarHBondContact OD1-N 3.39Å; H373-L375 PolarHBondContact O-N 2.96Å
374	P	93.2	Very high	96.1	Very high	55 Å²	55	45.5 Å²	45.5	36%	0.357	26%	0.256	S	S	.	.			trans	-66.6	-30.1	-159.7	23.4	-35	0	0	0	115.3	E368 Q369 G372 P376	E368-P374 CarbonylContact C-O 3.55Å; E368-P374 VanDerWaalsContact CA-O 3.27Å; E368-P374 WeakPolarHBondContact CA-O 3.24Å; E368-P374 HydrophobicContact CB-CB 3.95Å; E368-P374 VanDerWaalsContact CB-O 3.29Å; E368-P374 WeakPolarHBondContact CB-O 3.46Å; E368-P374 HydrophobicContact CG-CB 4.24Å; Q369-P374 PolarHBondContact N-O 3.37Å; G372-P374 VanDerWaalsContact O-CD 3.27Å; G372-P374 WeakPolarHBondContact O-CD 3.49Å; P374-P376 VanDerWaalsContact O-N 3.16Å
375	L	94.9	Very high	96	Very high	69 Å²	69	43.7 Å²	43.7	36%	0.361	24%	0.244	S	C	.	.			trans	36.1	59.1	178	-60.7	177.4	0	0	0	113.7	L261 G262 P263 H373	L261-L375 WeakPolarHBondContact O-CD1 3.23Å; G262-L375 VanDerWaalsContact CA-CB 3.41Å; G262-L375 WeakPolarHBondContact CA-O 3.47Å; P263-L375 WeakPolarHBondContact CD-O 3.13Å; H373-L375 PolarHBondContact O-N 2.96Å
376	P	96.3	Very high	95.5	Very high	54 Å²	54	47 Å²	47	35%	0.351	26%	0.261	S	S	.	.			trans	-72.6	140.7	-162.3	28.8	-36.7	0	0	0	114	K366 A367 E368 P374 F378	K366-P376 HydrophobicContact CD-CB 3.91Å; K366-P376 HydrophobicContact CG-CB 3.81Å; A367-P376 WeakPolarHBondContact O-CA 3.42Å; E368-P376 HydrophobicContact CB-CB 4.04Å; P374-P376 VanDerWaalsContact O-N 3.16Å; P376-F378 HydrophobicContact CB-CE1 4.21Å; P376-F378 HydrophobicContact CB-CZ 3.93Å; P376-F378 HydrophobicContact CG-CZ 3.87Å
377	A	96.3	Very high	94.8	Very high	20 Å²	20	47.8 Å²	47.8	17%	0.165	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	157.8	164.6	0	0	0	0	0	112.1	P263 F265 K366 A367	P263-A377 WeakPolarHBondContact O-CB 3.2Å; F265-A377 HydrophobicContact CD2-CB 4.18Å; F265-A377 HydrophobicContact CE2-CB 4.26Å; K366-A377 WeakPolarHBondContact CA-O 3.39Å; A367-A377 PolarHBondContact N-O 2.83Å; A367-A377 PolarHBondContact O-N 3.25Å
378	F	97	Very high	93.7	Very high	115 Å²	115	50.7 Å²	50.7	50%	0.504	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.3	-175.3	-49.2	-74.3	0	0	0	111.9	F265 L327 V364 I365 K366 P376	F265-F378 VanDerWaalsContact CE2-C 3.49Å; L327-F378 HydrophobicContact CD2-CD1 3.91Å; L327-F378 HydrophobicContact CD2-CE1 3.69Å; V364-F378 HydrophobicContact CG1-CB 4.28Å; V364-F378 HydrophobicContact CG1-CD1 4.49Å; I365-F378 WeakPolarHBondContact O-CA 3.27Å; K366-F378 HydrophobicContact CB-CD1 4.15Å; K366-F378 HydrophobicContact CB-CE1 4.2Å; K366-F378 HydrophobicContact CD-CE1 4.13Å; K366-F378 HydrophobicContact CG-CD1 4.17Å; K366-F378 HydrophobicContact CG-CE1 3.81Å; P376-F378 HydrophobicContact CB-CE1 4.21Å; P376-F378 HydrophobicContact CB-CZ 3.93Å; P376-F378 HydrophobicContact CG-CZ 3.87Å
379	A	97.1	Very high	92.7	Very high	5 Å²	5	51.6 Å²	51.6	4%	0.041	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	153.4	171.3	0	0	0	0	0	110.2	F265 Y282 I365	F265-A379 HydrophobicContact CB-CB 4.46Å; F265-A379 HydrophobicContact CD1-CB 4.3Å; F265-A379 HydrophobicContact CD2-CB 3.53Å; F265-A379 HydrophobicContact CE1-CB 4.4Å; F265-A379 HydrophobicContact CE2-CB 3.67Å; F265-A379 HydrophobicContact CG-CB 3.85Å; F265-A379 HydrophobicContact CZ-CB 4.11Å; Y282-A379 HydrophobicContact CD2-CB 4Å; Y282-A379 HydrophobicContact CE2-CB 3.64Å; I365-A379 PolarHBondContact N-O 2.7Å; I365-A379 PolarHBondContact O-N 3.21Å
380	S	97.2	Very high	91.6	Very high	54 Å²	54	53.3 Å²	53.3	38%	0.378	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	148.4	176.2	-61.2	0	0	0	0	110.7	L280 T281 Y282 L363	L280-S380 PolarHBondContact O-N 2.95Å; T281-S380 CarbonylContact C-O 3.56Å; T281-S380 WeakPolarHBondContact CA-O 3.49Å; Y282-S380 WeakPolarHBondContact CD2-O 3.33Å; Y282-S380 PolarHBondContact N-O 2.84Å; L363-S380 CarbonylContact O-C 3.24Å; L363-S380 WeakPolarHBondContact O-CA 3.08Å
381	L	97.7	Very high	91	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	116.1	171.2	167.6	63.2	0	0	0	108.6	A284 V300 I304 L347 L363 I365 I383	A284-L381 HydrophobicContact CB-CD1 4.43Å; V300-L381 HydrophobicContact CG1-CD1 3.74Å; V300-L381 HydrophobicContact CG2-CD1 4.37Å; I304-L381 HydrophobicContact CD1-CD2 4.41Å; L347-L381 HydrophobicContact CD2-CD2 3.91Å; L363-L381 HydrophobicContact CB-CB 4.28Å; L363-L381 HydrophobicContact CD1-CD2 4.23Å; L363-L381 PolarHBondContact N-O 3.07Å; L363-L381 PolarHBondContact O-N 2.9Å; I365-L381 HydrophobicContact CD1-CB 4.19Å; I365-L381 HydrophobicContact CD1-CD2 4.03Å; I365-L381 HydrophobicContact CG1-CB 3.91Å; I365-L381 HydrophobicContact CG1-CD2 4.37Å; L381-I383 HydrophobicContact CD1-CG1 4.36Å; L381-I383 HydrophobicContact CD2-CD1 4.24Å; L381-I383 HydrophobicContact CD2-CG1 4.38Å; L381-I383 HydrophobicContact CG-CD1 4.42Å; L381-I383 HydrophobicContact CG-CG1 4.03Å
382	H	97.7	Very high	90.7	Very high	41 Å²	41	52.1 Å²	52.1	19%	0.19	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	131.8	173.5	-173.5	77	0	0	0	109.5	T281 Y282 Q283 A284 D362	T281-H382 HydrophobicContact CG2-CB 4.36Å; Y282-H382 PolarHBondContact O-N 3.22Å; Q283-H382 CarbonylContact C-O 3.58Å; Q283-H382 WeakPolarHBondContact CA-O 3.33Å; Q283-H382 PolarHBondContact OE1-CD2 3.05Å; Q283-H382 VanDerWaalsContact OE1-CD2 3.28Å; A284-H382 PolarHBondContact N-O 2.71Å; D362-H382 IonicContact OD1-CE1 3.82Å; D362-H382 IonicContact OD1-CG 3.72Å; D362-H382 IonicContact OD1-ND1 3.19Å; D362-H382 PolarHBondContact OD1-ND1 2.94Å
383	I	97.2	Very high	90.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.6	177.7	-48.3	-178.8	0	0	0	108	A284 I286 F338 L347 K360 F361 L363 L381 I385	A284-I383 HydrophobicContact CB-CG1 4.36Å; A284-I383 HydrophobicContact CB-CG2 4.38Å; A284-I383 WeakPolarHBondContact O-CA 3.5Å; I286-I383 HydrophobicContact CD1-CG2 3.61Å; I286-I383 HydrophobicContact CG1-CG2 3.9Å; F338-I383 HydrophobicContact CD1-CD1 4.09Å; F338-I383 HydrophobicContact CD2-CD1 4.15Å; F338-I383 HydrophobicContact CE1-CD1 3.85Å; F338-I383 HydrophobicContact CE2-CD1 3.91Å; F338-I383 HydrophobicContact CG-CD1 4.24Å; F338-I383 HydrophobicContact CZ-CD1 3.75Å; F338-I383 HydrophobicContact CZ-CG2 4.19Å; L347-I383 HydrophobicContact CD2-CD1 4Å; K360-I383 CarbonylContact C-O 3.6Å; K360-I383 WeakPolarHBondContact CA-O 3.21Å; K360-I383 WeakPolarHBondContact CB-O 3.42Å; F361-I383 HydrophobicContact CB-CB 4.23Å; F361-I383 HydrophobicContact CB-CD1 4.5Å; F361-I383 PolarHBondContact N-O 3.13Å; F361-I383 PolarHBondContact O-N 2.85Å; L363-I383 HydrophobicContact CD1-CD1 3.77Å; L363-I383 HydrophobicContact CG-CD1 4.48Å; L381-I383 HydrophobicContact CD1-CG1 4.36Å; L381-I383 HydrophobicContact CD2-CD1 4.24Å; L381-I383 HydrophobicContact CD2-CG1 4.38Å; L381-I383 HydrophobicContact CG-CD1 4.42Å; L381-I383 HydrophobicContact CG-CG1 4.03Å; I383-I385 HydrophobicContact CG2-CD1 4.26Å
384	E	94.7	Very high	90.7	Very high	106 Å²	106	47.6 Å²	47.6	50%	0.495	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.5	175	-173	172.7	-159.1	0	0	110.1	A284 A285 I286 L386	A284-E384 PolarHBondContact O-N 3.43Å; A285-E384 WeakPolarHBondContact CA-O 3.3Å; I286-E384 PolarHBondContact N-O 2.91Å; E384-L386 HydrophobicContact CG-CD2 4.17Å
385	I	93.9	Very high	90.8	Very high	3 Å²	3	46 Å²	46	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	113.4	174.3	-52.5	-55.7	0	0	0	108.1	I286 E288 V353 R355 H358 Q359 F361 I383	I286-I385 HydrophobicContact CB-CD1 3.9Å; I286-I385 HydrophobicContact CG2-CD1 4.23Å; I286-I385 CarbonylContact O-C 3.52Å; I286-I385 WeakPolarHBondContact O-CA 3.08Å; E288-I385 HydrophobicContact CB-CG2 3.88Å; V353-I385 HydrophobicContact CB-CD1 4.23Å; V353-I385 HydrophobicContact CB-CG2 4.38Å; V353-I385 HydrophobicContact CG1-CD1 4.02Å; V353-I385 HydrophobicContact CG1-CG1 3.98Å; V353-I385 HydrophobicContact CG1-CG2 4.14Å; V353-I385 HydrophobicContact CG2-CD1 4.13Å; R355-I385 HydrophobicContact CB-CG2 3.99Å; R355-I385 WeakPolarHBondContact CD-O 3.44Å; R355-I385 HydrophobicContact CG-CB 4.37Å; R355-I385 HydrophobicContact CG-CG2 4.04Å; R355-I385 PolarHBondContact NE-O 2.93Å; H358-I385 WeakPolarHBondContact O-CB 3.31Å; H358-I385 VanDerWaalsContact O-CG1 3.23Å; H358-I385 WeakPolarHBondContact O-CG1 3.37Å; Q359-I385 WeakPolarHBondContact O-CB 3.27Å; Q359-I385 PolarHBondContact O-N 2.75Å; Q359-I385 VanDerWaalsContact O-N 3.09Å; F361-I385 HydrophobicContact CD2-CD1 4.22Å; F361-I385 HydrophobicContact CD2-CG1 4.36Å; F361-I385 HydrophobicContact CE2-CD1 4.09Å; F361-I385 HydrophobicContact CE2-CG1 4.17Å; I383-I385 HydrophobicContact CG2-CD1 4.26Å
386	L	88	Confident	90.7	Very high	69 Å²	69	45.8 Å²	45.8	36%	0.361	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	134.9	-177.3	-54.5	177.1	0	0	0	109.7	A285 I286 E288 E384	A285-L386 HydrophobicContact CB-CD1 3.98Å; A285-L386 HydrophobicContact CB-CD2 4.31Å; A285-L386 HydrophobicContact CB-CG 4.13Å; I286-L386 PolarHBondContact O-N 2.87Å; E288-L386 PolarHBondContact N-O 3.15Å; E384-L386 HydrophobicContact CG-CD2 4.17Å
387	D	82.6	Confident	90.6	Very high	52 Å²	52	48.1 Å²	48.1	28%	0.278	25%	0.25	S	S	.	.			trans	-67.3	130.8	176.4	-152.4	-51.5	0	0	0	110.1	R355	R355-D387 IonicContact CZ-OD2 2.7Å; R355-D387 IonicContact NE-OD2 3.21Å; R355-D387 IonicContact NH1-OD2 3.34Å; R355-D387 PolarHBondContact NH1-OD2 3.21Å; R355-D387 IonicContact NH2-OD2 3.7Å; R355-D387 PolarHBondContact NH2-OD2 3.12Å
388	E	74.9	Confident	90.5	Very high	61 Å²	61	52.4 Å²	52.4	29%	0.285	28%	0.277	S	S	.	.			trans	-115	127.7	164.6	-69	-154.3	159	0	0	107.4	P287 E288 R290 N390	P287-E388 HydrophobicContact CB-CG 4.14Å; E288-E388 HydrophobicContact CG-CB 4.29Å; R290-E388 IonicContact CZ-OE1 2.68Å; R290-E388 VanDerWaalsContact CZ-OE1 3.23Å; R290-E388 IonicContact CZ-OE2 2.67Å; R290-E388 IonicContact NE-OE1 3.62Å; R290-E388 PolarHBondContact NE-OE1 2.62Å; R290-E388 IonicContact NE-OE2 2.74Å; R290-E388 PolarHBondContact NE-OE2 3.17Å; R290-E388 IonicContact NH2-OE1 2.67Å; R290-E388 PolarHBondContact NH2-OE1 2.97Å; R290-E388 IonicContact NH2-OE2 3.14Å; R290-E388 PolarHBondContact NH2-OE2 3.01Å; E388-N390 WeakPolarHBondContact O-CB 3.35Å; E388-N390 PolarHBondContact O-N 2.94Å; E388-N390 PolarHBondContact O-ND2 3.28Å
389	N	76.9	Confident	90.4	Very high	62 Å²	62	49.9 Å²	49.9	33%	0.332	27%	0.273	S	S	.	.	S	Bend	trans	-55	110.4	179.8	171.5	-71.8	0	0	0	110.4	D432 D485 V487 Q488	N389-D432 WeakPolarHBondContact CA-OD2 3.47Å; N389-D432 PolarHBondContact ND2-OD2 3.46Å; N389-D485 PolarHBondContact ND2-OD2 2.83Å; N389-D485 PolarHBondContact OD1-OD2 2.88Å; N389-V487 WeakPolarHBondContact OD1-CB 3.4Å; N389-Q488 PolarHBondContact OD1-NE2 3.4Å; N389-Q488 VanDerWaalsContact OD1-NE2 3.07Å
390	N	74.4	Confident	90.4	Very high	42 Å²	42	50.1 Å²	50.1	23%	0.225	27%	0.273	C	S	.	.			trans	-146.8	-8.5	-170.5	77.4	72.4	0	0	0	113.6	E288 L289 E388 D432 Q488	E288-N390 VanDerWaalsContact CD-ND2 3.28Å; E288-N390 PolarHBondContact OE1-ND2 2.98Å; L289-N390 HydrophobicContact CD1-CB 4.09Å; E388-N390 WeakPolarHBondContact O-CB 3.35Å; E388-N390 PolarHBondContact O-N 2.94Å; E388-N390 PolarHBondContact O-ND2 3.28Å; N390-D432 PolarHBondContact N-OD2 2.81Å; N390-Q488 PolarHBondContact O-OE1 3.44Å
391	Q	81.6	Confident	90.3	Very high	37 Å²	37	51.2 Å²	51.2	17%	0.173	27%	0.272	C	S	.	.	S	Bend	trans	-101.6	128.2	175.1	-56.9	-80	-46.4	0	0	109	D356 K431 D432 Q488	D356-Q391 PolarHBondContact OD2-NE2 2.9Å; D356-Q391 VanDerWaalsContact OD2-NE2 3.12Å; Q391-K431 HydrophobicContact CB-CB 4Å; Q391-K431 HydrophobicContact CG-CB 3.98Å; Q391-K431 HydrophobicContact CG-CD 4.48Å; Q391-D432 VanDerWaalsContact CB-OD1 3.24Å; Q391-D432 WeakPolarHBondContact CB-OD1 3.38Å; Q391-D432 WeakPolarHBondContact CG-OD1 3.44Å; Q391-D432 PolarHBondContact N-OD1 3.43Å; Q391-D432 PolarHBondContact N-OD2 3.34Å; Q391-Q488 VanDerWaalsContact C-NE2 3.29Å; Q391-Q488 PolarHBondContact O-NE2 3.21Å; Q391-Q488 VanDerWaalsContact O-NE2 3.12Å
392	S	88.3	Confident	90.2	Very high	64 Å²	64	51.2 Å²	51.2	45%	0.448	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-71.9	142.4	178.4	-40.5	0	0	0	0	110.5	Q488	S392-Q488 PolarHBondContact OG-OE1 3.3Å
393	P	93.2	Very high	90.1	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.026	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-57.1	154.4	177.4	-26.9	35.2	0	0	0	112.9	L429 L441 A483 D485 S490	P393-L429 CarbonylContact C-O 3.58Å; P393-L429 WeakPolarHBondContact CA-O 3.37Å; P393-L441 HydrophobicContact CB-CD1 4.01Å; P393-L441 HydrophobicContact CB-CD2 3.81Å; P393-L441 HydrophobicContact CG-CD2 3.5Å; P393-L441 VanDerWaalsContact CG-CD2 3.5Å; P393-A483 HydrophobicContact CB-CB 4.03Å; P393-D485 HydrophobicContact CG-CB 3.81Å; P393-S490 VanDerWaalsContact O-CA 3.22Å; P393-S490 WeakPolarHBondContact O-CA 3.18Å; P393-S490 WeakPolarHBondContact O-CB 3.38Å
394	Y	92.6	Very high	90	Very high	85 Å²	85	51.6 Å²	51.6	33%	0.333	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	145.3	179.7	70	-83.4	0	0	0	113.2	A428 L429 K431	Y394-A428 CarbonylContact O-C 3.57Å; Y394-A428 VanDerWaalsContact O-CA 3.27Å; Y394-A428 WeakPolarHBondContact O-CA 3.39Å; Y394-L429 WeakPolarHBondContact CD1-O 3.36Å; Y394-L429 HydrophobicContact CE1-CB 3.98Å; Y394-L429 HydrophobicContact CE2-CB 4.35Å; Y394-L429 PolarHBondContact N-O 2.93Å; Y394-L429 PolarHBondContact O-N 2.97Å; Y394-K431 HydrophobicContact CE1-CG 3.87Å
395	F	94.9	Very high	90	Very high	21 Å²	21	49 Å²	49	9%	0.092	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	140	171	-70.4	-81.5	0	0	0	111.3	M397 Y400 I426 A428 L443 I481 A483 S490 V493	F395-M397 PolarHBondContact O-N 3.05Å; F395-Y400 AromaticContact CD1-CE2 3.91Å; F395-Y400 HydrophobicContact CD1-CE2 3.91Å; F395-Y400 HydrophobicContact CG-CE2 4.41Å; F395-I426 HydrophobicContact CD1-CG2 4.07Å; F395-I426 HydrophobicContact CE1-CG2 3.79Å; F395-A428 HydrophobicContact CD1-CB 3.85Å; F395-A428 HydrophobicContact CE1-CB 3.84Å; F395-A428 HydrophobicContact CG-CB 4.43Å; F395-A428 HydrophobicContact CZ-CB 4.41Å; F395-L443 HydrophobicContact CE1-CD1 4.38Å; F395-L443 HydrophobicContact CE1-CD2 4.2Å; F395-L443 HydrophobicContact CZ-CD2 4.06Å; F395-I481 HydrophobicContact CE1-CG2 3.92Å; F395-I481 HydrophobicContact CE2-CG2 4.21Å; F395-I481 VanDerWaalsContact CE2-O 3.3Å; F395-I481 WeakPolarHBondContact CE2-O 3.3Å; F395-I481 HydrophobicContact CZ-CB 4.31Å; F395-I481 HydrophobicContact CZ-CG1 4.08Å; F395-I481 HydrophobicContact CZ-CG2 3.69Å; F395-A483 HydrophobicContact CE2-CB 4.18Å; F395-A483 HydrophobicContact CZ-CB 3.99Å; F395-S490 VanDerWaalsContact CE2-OG 3.31Å; F395-S490 WeakPolarHBondContact CE2-OG 2.99Å; F395-V493 HydrophobicContact CB-CB 4.5Å; F395-V493 HydrophobicContact CB-CG2 3.82Å; F395-V493 HydrophobicContact CD2-CB 3.89Å; F395-V493 HydrophobicContact CD2-CG2 3.56Å; F395-V493 HydrophobicContact CE2-CB 4.37Å; F395-V493 HydrophobicContact CE2-CG2 4.42Å; F395-V493 HydrophobicContact CG-CB 4.2Å; F395-V493 HydrophobicContact CG-CG2 3.9Å
396	T	93.3	Very high	90	Very high	65 Å²	65	49.3 Å²	49.3	40%	0.399	26%	0.263	S	S	.	.	S	Bend	trans	-69.2	-16	176.9	52.4	0	0	0	0	114.1	V427 L429	T396-V427 HydrophobicContact CG2-CB 4.08Å; T396-V427 HydrophobicContact CG2-CG1 3.77Å; T396-V427 WeakPolarHBondContact CG2-O 3.42Å; T396-V427 PolarHBondContact N-O 2.82Å; T396-V427 PolarHBondContact OG1-O 2.96Å; T396-L429 HydrophobicContact CG2-CD1 3.95Å; T396-L429 HydrophobicContact CG2-CG 4.2Å
397	M	93.9	Very high	90.2	Very high	103 Å²	103	49.6 Å²	49.6	51%	0.507	27%	0.271	S	S	.	.	S	Bend	trans	-130.5	142.5	-179.9	-66	-66.9	-70.6	0	0	110.5	F395 S399 Y400	F395-M397 PolarHBondContact O-N 3.05Å; M397-S399 VanDerWaalsContact C-N 3.3Å; M397-S399 PolarHBondContact O-N 3.36Å; M397-Y400 HydrophobicContact CB-CD1 4.38Å; M397-Y400 HydrophobicContact CB-CE1 3.74Å; M397-Y400 HydrophobicContact CB-CE2 4.48Å; M397-Y400 HydrophobicContact CG-CE1 4Å
398	P	93.2	Very high	90.7	Very high	111 Å²	111	47.9 Å²	47.9	72%	0.721	26%	0.264	S	S	*	.	S	Bend	trans	-78.1	-11.2	-177.6	32.5	-37.1	0	0	0	114.1
399	S	95.8	Very high	91.6	Very high	62 Å²	62	49.5 Å²	49.5	43%	0.434	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	156.6	172	56.2	0	0	0	0	109.9	M397 V494	M397-S399 VanDerWaalsContact C-N 3.3Å; M397-S399 PolarHBondContact O-N 3.36Å; S399-V494 CarbonylContact C-O 3.6Å; S399-V494 VanDerWaalsContact CA-O 3.27Å; S399-V494 WeakPolarHBondContact CA-O 3.36Å
400	Y	95.8	Very high	92.4	Very high	10 Å²	10	50.5 Å²	50.5	4%	0.039	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.6	177.4	-65.1	-77.4	0	0	0	110.6	F395 M397 L424 R425 I426 V427 V493 V494 V495 N496	F395-Y400 AromaticContact CD1-CE2 3.91Å; F395-Y400 HydrophobicContact CD1-CE2 3.91Å; F395-Y400 HydrophobicContact CG-CE2 4.41Å; M397-Y400 HydrophobicContact CB-CD1 4.38Å; M397-Y400 HydrophobicContact CB-CE1 3.74Å; M397-Y400 HydrophobicContact CB-CE2 4.48Å; M397-Y400 HydrophobicContact CG-CE1 4Å; Y400-L424 HydrophobicContact CD1-CD1 4.24Å; Y400-R425 WeakPolarHBondContact CE1-O 3.48Å; Y400-I426 HydrophobicContact CD1-CG1 4.07Å; Y400-I426 HydrophobicContact CD2-CG1 4.22Å; Y400-I426 HydrophobicContact CE1-CB 4.41Å; Y400-I426 HydrophobicContact CE1-CG1 4.17Å; Y400-I426 HydrophobicContact CE2-CG1 4.3Å; Y400-I426 HydrophobicContact CE2-CG2 3.96Å; Y400-I426 HydrophobicContact CG-CG1 4.11Å; Y400-V427 PolarHBondContact OH-N 2.86Å; Y400-V427 PolarHBondContact OH-O 3.41Å; Y400-V493 HydrophobicContact CD2-CG1 3.77Å; Y400-V493 HydrophobicContact CE2-CG1 3.87Å; Y400-V494 PolarHBondContact N-O 3.1Å; Y400-V495 HydrophobicContact CD2-CG2 4.38Å; Y400-V495 WeakPolarHBondContact O-CA 3.37Å; Y400-N496 PolarHBondContact O-N 3.01Å
401	Q	95.6	Very high	93.2	Very high	77 Å²	77	50.7 Å²	50.7	36%	0.36	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.2	175.7	-177.9	64.6	51.1	0	0	109.7	Y403 L424 N496	Q401-Y403 HydrophobicContact CG-CE2 3.88Å; Q401-L424 WeakPolarHBondContact O-CD1 3.43Å; Q401-N496 CarbonylContact C-O 3.59Å; Q401-N496 WeakPolarHBondContact CA-O 3.49Å; Q401-N496 PolarHBondContact NE2-O 2.72Å; Q401-N496 VanDerWaalsContact NE2-O 3.15Å
402	G	95.6	Very high	93.8	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	157.6	-179.6	0	0	0	0	0	113.3	S415 N496 I497 R498	G402-S415 CarbonylContact C-O 3.55Å; G402-S415 VanDerWaalsContact CA-O 3.23Å; G402-S415 WeakPolarHBondContact CA-O 3.38Å; G402-N496 PolarHBondContact N-O 3.47Å; G402-I497 WeakPolarHBondContact O-CA 3.42Å; G402-R498 PolarHBondContact O-N 3.34Å
403	Y	96.5	Very high	94.1	Very high	41 Å²	41	50 Å²	50	16%	0.161	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	140	174.8	-56.1	-85.4	0	0	0	109.7	Q401 S415 E416 L418 R498	Q401-Y403 HydrophobicContact CG-CE2 3.88Å; Y403-S415 PolarHBondContact N-O 2.89Å; Y403-S415 PolarHBondContact O-N 3.37Å; Y403-E416 WeakPolarHBondContact CE2-O 3.09Å; Y403-L418 HydrophobicContact CD1-CD2 3.71Å; Y403-L418 HydrophobicContact CD1-CG 4.02Å; Y403-L418 HydrophobicContact CE1-CD1 4.48Å; Y403-L418 HydrophobicContact CE1-CD2 3.48Å; Y403-L418 VanDerWaalsContact CE1-CD2 3.48Å; Y403-L418 HydrophobicContact CE1-CG 3.69Å; Y403-L418 HydrophobicContact CE2-CG 4.21Å; Y403-L418 HydrophobicContact CG-CD2 4.49Å; Y403-L418 HydrophobicContact CG-CG 4.42Å; Y403-R498 WeakPolarHBondContact CA-O 3.48Å; Y403-R498 HydrophobicContact CD1-CB 4.08Å; Y403-R498 HydrophobicContact CE1-CB 4.29Å
404	I	95.5	Very high	94.3	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.041	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	144	175.8	-168.3	59.2	0	0	0	109.2	A408 A412 I414 V469 I497 R498 V499 M500	I404-A408 HydrophobicContact CD1-CB 3.7Å; I404-A408 HydrophobicContact CG1-CB 3.97Å; I404-A412 HydrophobicContact CD1-CB 4.16Å; I404-I414 HydrophobicContact CB-CD1 3.8Å; I404-I414 HydrophobicContact CD1-CD1 4.24Å; I404-I414 HydrophobicContact CG1-CD1 3.96Å; I404-I414 HydrophobicContact CG2-CD1 4.19Å; I404-V469 HydrophobicContact CG2-CG2 4.25Å; I404-I497 HydrophobicContact CG2-CG2 3.91Å; I404-R498 PolarHBondContact N-O 2.76Å; I404-R498 VanDerWaalsContact N-O 3.16Å; I404-V499 HydrophobicContact CG2-CG2 4.39Å; I404-V499 CarbonylContact O-C 3.56Å; I404-V499 WeakPolarHBondContact O-CA 3.05Å; I404-M500 PolarHBondContact O-N 2.69Å
405	L	94.1	Very high	94.4	Very high	52 Å²	52	46 Å²	46	27%	0.272	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	140.9	172.9	-162	69.7	0	0	0	109	S407 A408 L420 M500 D501 A502	L405-S407 VanDerWaalsContact C-N 3.33Å; L405-S407 WeakPolarHBondContact CD2-OG 3.44Å; L405-S407 PolarHBondContact O-N 2.93Å; L405-A408 WeakPolarHBondContact O-CB 3.29Å; L405-A408 PolarHBondContact O-N 3.24Å; L405-L420 HydrophobicContact CB-CD1 3.95Å; L405-M500 HydrophobicContact CD1-CB 3.95Å; L405-D501 VanDerWaalsContact CD1-O 3.31Å; L405-D501 WeakPolarHBondContact CD1-O 3.41Å; L405-A502 HydrophobicContact CD1-CB 4.37Å; L405-A502 HydrophobicContact CG-CB 4.29Å
406	E	94.2	Very high	94.4	Very high	9 Å²	9	49.1 Å²	49.1	4%	0.042	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-36.7	-179.6	69	-160.5	124.9	0	0	113.6	A408 V469 R471 V499 M500 D501 A502	E406-A408 PolarHBondContact O-N 2.69Å; E406-V469 WeakPolarHBondContact CB-O 3.31Å; E406-R471 WeakPolarHBondContact OE2-CA 3.39Å; E406-R471 WeakPolarHBondContact OE2-CB 3.46Å; E406-R471 PolarHBondContact OE2-N 2.82Å; E406-V499 HydrophobicContact CB-CG1 3.68Å; E406-M500 PolarHBondContact N-O 2.86Å; E406-D501 WeakPolarHBondContact OE1-CA 3.44Å; E406-A502 HydrophobicContact CG-CB 3.96Å; E406-A502 PolarHBondContact OE1-N 3.28Å
407	S	91.9	Very high	94.3	Very high	75 Å²	75	47.3 Å²	47.3	52%	0.524	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	8.2	171.7	64	0	0	0	0	114.4	L405	L405-S407 VanDerWaalsContact C-N 3.33Å; L405-S407 WeakPolarHBondContact CD2-OG 3.44Å; L405-S407 PolarHBondContact O-N 2.93Å
408	A	92.8	Very high	94	Very high	16 Å²	16	46.9 Å²	46.9	13%	0.132	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-71.7	133.4	175.7	0	0	0	0	0	111.6	I404 L405 E406 A412	I404-A408 HydrophobicContact CD1-CB 3.7Å; I404-A408 HydrophobicContact CG1-CB 3.97Å; L405-A408 WeakPolarHBondContact O-CB 3.29Å; L405-A408 PolarHBondContact O-N 3.24Å; E406-A408 PolarHBondContact O-N 2.69Å; A408-A412 HydrophobicContact CB-CB 3.88Å
409	P	93.9	Very high	93.8	Very high	95 Å²	95	48 Å²	48	62%	0.617	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-70.3	154	179.5	29.8	-35.7	0	0	0	112	G411 A412	P409-G411 PolarHBondContact O-N 3.04Å; P409-A412 WeakPolarHBondContact O-CB 3.21Å; P409-A412 PolarHBondContact O-N 2.93Å
410	V	93.4	Very high	93.5	Very high	83 Å²	83	48.4 Å²	48.4	50%	0.503	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	131.7	166.9	175	0	0	0	0	109.9	L466 P468	V410-L466 WeakPolarHBondContact CG1-O 3.25Å; V410-P468 HydrophobicContact CG2-CG 4.11Å
411	G	92.1	Very high	93.1	Very high	47 Å²	47	52.9 Å²	52.9	49%	0.485	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-8.3	-170.9	0	0	0	0	0	115	P409 L465	P409-G411 PolarHBondContact O-N 3.04Å; G411-L465 PolarHBondContact N-O 3.1Å
412	A	93.7	Very high	92.9	Very high	22 Å²	22	51.6 Å²	51.6	18%	0.182	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-62	143.1	173.9	0	0	0	0	0	111.9	I404 A408 P409 T464 L465	I404-A412 HydrophobicContact CD1-CB 4.16Å; A408-A412 HydrophobicContact CB-CB 3.88Å; P409-A412 WeakPolarHBondContact O-CB 3.21Å; P409-A412 PolarHBondContact O-N 2.93Å; A412-T464 CarbonylContact O-C 3.59Å; A412-T464 VanDerWaalsContact O-CA 3.24Å; A412-T464 WeakPolarHBondContact O-CA 3.48Å; A412-L465 PolarHBondContact O-N 2.9Å
413	T	95.2	Very high	92.9	Very high	63 Å²	63	53.8 Å²	53.8	39%	0.387	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-90.2	134.4	178.6	-47.6	0	0	0	0	110.8	P423 Y462 L463 T464	T413-P423 HydrophobicContact CG2-CB 3.67Å; T413-Y462 HydrophobicContact CG2-CD1 4.35Å; T413-Y462 HydrophobicContact CG2-CG 4.48Å; T413-L463 WeakPolarHBondContact CA-O 3.47Å; T413-L463 WeakPolarHBondContact CG2-O 3.41Å; T413-T464 HydrophobicContact CG2-CG2 4.37Å
414	I	95.9	Very high	92.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-64	136.9	175.6	-52	-58.2	0	0	0	109.9	I404 P423 L424 F452 L463 I497	I404-I414 HydrophobicContact CB-CD1 3.8Å; I404-I414 HydrophobicContact CD1-CD1 4.24Å; I404-I414 HydrophobicContact CG1-CD1 3.96Å; I404-I414 HydrophobicContact CG2-CD1 4.19Å; I414-P423 WeakPolarHBondContact O-CA 3.41Å; I414-L424 HydrophobicContact CG2-CB 4.48Å; I414-L424 HydrophobicContact CG2-CD2 4.19Å; I414-L424 WeakPolarHBondContact O-CB 3.11Å; I414-L424 PolarHBondContact O-N 3.12Å; I414-F452 HydrophobicContact CD1-CD1 4.08Å; I414-F452 HydrophobicContact CD1-CE1 3.81Å; I414-F452 HydrophobicContact CG1-CD1 4.46Å; I414-L463 HydrophobicContact CB-CB 4.19Å; I414-L463 HydrophobicContact CG1-CB 3.71Å; I414-L463 PolarHBondContact N-O 3.36Å; I414-I497 HydrophobicContact CD1-CD1 4.19Å; I414-I497 HydrophobicContact CD1-CG2 4.29Å; I414-I497 HydrophobicContact CG1-CD1 4.04Å; I414-I497 HydrophobicContact CG2-CD1 4.34Å; I414-I497 HydrophobicContact CG2-CG1 4.29Å; I414-I497 HydrophobicContact CG2-CG2 4.19Å
415	S	95.9	Very high	92.7	Very high	5 Å²	5	58.2 Å²	58.2	4%	0.035	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-93.6	146.4	178.5	-173.1	0	0	0	0	112.5	G402 Y403 S417 L420 T422	G402-S415 CarbonylContact C-O 3.55Å; G402-S415 VanDerWaalsContact CA-O 3.23Å; G402-S415 WeakPolarHBondContact CA-O 3.38Å; Y403-S415 PolarHBondContact N-O 2.89Å; Y403-S415 PolarHBondContact O-N 3.37Å; S415-S417 VanDerWaalsContact C-N 3.27Å; S415-S417 PolarHBondContact OG-N 2.85Å; S415-S417 VanDerWaalsContact OG-N 3.14Å; S415-S417 PolarHBondContact OG-O 3.07Å; S415-S417 PolarHBondContact OG-OG 2.68Å; S415-L420 WeakPolarHBondContact OG-CA 3.41Å; S415-T422 CarbonylContact C-O 3.04Å; S415-T422 WeakPolarHBondContact CA-O 3.24Å; S415-T422 WeakPolarHBondContact CB-O 3.24Å; S415-T422 PolarHBondContact OG-O 3.35Å
416	E	93.7	Very high	92.8	Very high	88 Å²	88	55.7 Å²	55.7	41%	0.411	33%	0.327	S	S	.	.	S	Bend	trans	-76.1	-14.2	167.9	67.6	-169.9	-170.6	0	0	113	Y403 T422 L424	Y403-E416 WeakPolarHBondContact CE2-O 3.09Å; E416-T422 VanDerWaalsContact CD-OG1 3.29Å; E416-T422 WeakPolarHBondContact CG-OG1 3.3Å; E416-T422 PolarHBondContact N-O 3.13Å; E416-T422 WeakPolarHBondContact OE1-CB 3.25Å; E416-T422 PolarHBondContact OE1-OG1 2.87Å; E416-L424 HydrophobicContact CB-CB 4.45Å; E416-L424 HydrophobicContact CB-CD1 4.01Å
417	S	90.9	Very high	92.8	Very high	27 Å²	27	56.5 Å²	56.5	19%	0.189	33%	0.333	C	S	.	.	S	Bend	trans	-125.9	142.7	-169.4	56.1	0	0	0	0	112.6	S415 N419 L420 T421 T422	S415-S417 VanDerWaalsContact C-N 3.27Å; S415-S417 PolarHBondContact OG-N 2.85Å; S415-S417 VanDerWaalsContact OG-N 3.14Å; S415-S417 PolarHBondContact OG-O 3.07Å; S415-S417 PolarHBondContact OG-OG 2.68Å; S417-N419 PolarHBondContact O-N 3.12Å; S417-N419 VanDerWaalsContact O-N 3.1Å; S417-L420 PolarHBondContact O-N 2.97Å; S417-T421 PolarHBondContact OG-OG1 2.85Å; S417-T422 PolarHBondContact OG-OG1 2.95Å; S417-T422 VanDerWaalsContact OG-OG1 3.09Å
418	L	89.3	Confident	92.8	Very high	93 Å²	93	53.2 Å²	53.2	49%	0.487	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.6	176.3	-75.4	147	0	0	0	113.7	Y403 L420 M500	Y403-L418 HydrophobicContact CD1-CD2 3.71Å; Y403-L418 HydrophobicContact CD1-CG 4.02Å; Y403-L418 HydrophobicContact CE1-CD1 4.48Å; Y403-L418 HydrophobicContact CE1-CD2 3.48Å; Y403-L418 VanDerWaalsContact CE1-CD2 3.48Å; Y403-L418 HydrophobicContact CE1-CG 3.69Å; Y403-L418 HydrophobicContact CE2-CG 4.21Å; Y403-L418 HydrophobicContact CG-CD2 4.49Å; Y403-L418 HydrophobicContact CG-CG 4.42Å; L418-L420 VanDerWaalsContact C-N 3.26Å; L418-M500 WeakPolarHBondContact O-CE 3.33Å
419	N	88.3	Confident	92.8	Very high	135 Å²	135	53.2 Å²	53.2	72%	0.722	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	1	177.3	-63.2	-16.8	0	0	0	112.9	S417 T421	S417-N419 PolarHBondContact O-N 3.12Å; S417-N419 VanDerWaalsContact O-N 3.1Å; N419-T421 HydrophobicContact CB-CG2 3.99Å; N419-T421 PolarHBondContact O-N 3.36Å; N419-T421 VanDerWaalsContact O-N 3.16Å
420	L	89.6	Confident	92.6	Very high	70 Å²	70	48.9 Å²	48.9	37%	0.366	28%	0.279	S	S	.	.	S	Bend	trans	57	26.7	-179.9	-52.9	178.2	0	0	0	114.4	L405 S415 S417 L418 M500	L405-L420 HydrophobicContact CB-CD1 3.95Å; S415-L420 WeakPolarHBondContact OG-CA 3.41Å; S417-L420 PolarHBondContact O-N 2.97Å; L418-L420 VanDerWaalsContact C-N 3.26Å; L420-M500 HydrophobicContact CD1-SD 4.4Å; L420-M500 HydrophobicContact CD2-SD 3.9Å; L420-M500 HydrophobicContact CG-SD 4.2Å
421	T	88	Confident	92.2	Very high	104 Å²	104	50.5 Å²	50.5	64%	0.638	28%	0.28	S	S	*	.			trans	-90.2	-22.1	-172.7	52.1	0	0	0	0	114.9	S417 N419	S417-T421 PolarHBondContact OG-OG1 2.85Å; N419-T421 HydrophobicContact CB-CG2 3.99Å; N419-T421 PolarHBondContact O-N 3.36Å; N419-T421 VanDerWaalsContact O-N 3.16Å
422	T	91.4	Very high	91.6	Very high	50 Å²	50	49.3 Å²	49.3	31%	0.307	26%	0.262	S	S	.	.	S	Bend	trans	-135.8	130.6	-171.2	42.3	0	0	0	0	110.9	S415 E416 S417	S415-T422 CarbonylContact C-O 3.04Å; S415-T422 WeakPolarHBondContact CA-O 3.24Å; S415-T422 WeakPolarHBondContact CB-O 3.24Å; S415-T422 PolarHBondContact OG-O 3.35Å; E416-T422 VanDerWaalsContact CD-OG1 3.29Å; E416-T422 WeakPolarHBondContact CG-OG1 3.3Å; E416-T422 PolarHBondContact N-O 3.13Å; E416-T422 WeakPolarHBondContact OE1-CB 3.25Å; E416-T422 PolarHBondContact OE1-OG1 2.87Å; S417-T422 PolarHBondContact OG-OG1 2.95Å; S417-T422 VanDerWaalsContact OG-OG1 3.09Å
423	P	93.6	Very high	90.9	Very high	47 Å²	47	51.2 Å²	51.2	31%	0.305	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-73.8	141.2	-178.6	30.7	-35.3	0	0	0	111.1	T413 I414 R425 Y462	T413-P423 HydrophobicContact CG2-CB 3.67Å; I414-P423 WeakPolarHBondContact O-CA 3.41Å; P423-R425 PolarHBondContact O-N 3.48Å; P423-Y462 HydrophobicContact CB-CD1 3.86Å; P423-Y462 HydrophobicContact CB-CE1 3.9Å; P423-Y462 HydrophobicContact CG-CD1 4.25Å; P423-Y462 HydrophobicContact CG-CE1 3.77Å
424	L	94.8	Very high	90.1	Very high	8 Å²	8	54 Å²	54	4%	0.042	28%	0.277	C	S	.	.			trans	-63.3	113.8	178.5	178.5	59.6	0	0	0	110.7	Y400 Q401 I414 E416 Y462 L463	Y400-L424 HydrophobicContact CD1-CD1 4.24Å; Q401-L424 WeakPolarHBondContact O-CD1 3.43Å; I414-L424 HydrophobicContact CG2-CB 4.48Å; I414-L424 HydrophobicContact CG2-CD2 4.19Å; I414-L424 WeakPolarHBondContact O-CB 3.11Å; I414-L424 PolarHBondContact O-N 3.12Å; E416-L424 HydrophobicContact CB-CB 4.45Å; E416-L424 HydrophobicContact CB-CD1 4.01Å; L424-Y462 WeakPolarHBondContact O-CD1 3.38Å; L424-L463 HydrophobicContact CD2-CD1 4.37Å
425	R	94.3	Very high	89.3	Confident	133 Å²	133	58.8 Å²	58.8	50%	0.502	30%	0.303	S	S	.	.			trans	-89.8	111.7	179.4	-63.7	179.9	-179.4	-93.4	-2.7	110.3	Y400 P423 T460 Y462	Y400-R425 WeakPolarHBondContact CE1-O 3.48Å; P423-R425 PolarHBondContact O-N 3.48Å; R425-T460 HydrophobicContact CB-CG2 3.77Å; R425-T460 HydrophobicContact CG-CG2 3.77Å; R425-Y462 HydrophobicContact CG-CE1 3.97Å; R425-Y462 PolarHBondContact NH1-OH 2.91Å
426	I	95.2	Very high	88.5	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-97.3	130.7	168	-62	177	0	0	0	107.3	F395 Y400 L443 R461 L463 I481	F395-I426 HydrophobicContact CD1-CG2 4.07Å; F395-I426 HydrophobicContact CE1-CG2 3.79Å; Y400-I426 HydrophobicContact CD1-CG1 4.07Å; Y400-I426 HydrophobicContact CD2-CG1 4.22Å; Y400-I426 HydrophobicContact CE1-CB 4.41Å; Y400-I426 HydrophobicContact CE1-CG1 4.17Å; Y400-I426 HydrophobicContact CE2-CG1 4.3Å; Y400-I426 HydrophobicContact CE2-CG2 3.96Å; Y400-I426 HydrophobicContact CG-CG1 4.11Å; I426-L443 HydrophobicContact CG2-CD1 4.1Å; I426-R461 HydrophobicContact CB-CB 4.17Å; I426-R461 HydrophobicContact CG2-CB 4.47Å; I426-R461 PolarHBondContact N-O 2.6Å; I426-R461 WeakPolarHBondContact O-CB 3.49Å; I426-R461 PolarHBondContact O-N 3.16Å; I426-L463 HydrophobicContact CD1-CD1 3.69Å; I426-L463 HydrophobicContact CD1-CG 3.79Å; I426-I481 HydrophobicContact CD1-CD1 4.02Å; I426-I481 HydrophobicContact CG2-CD1 4.35Å
427	V	94.1	Very high	88	Confident	25 Å²	25	65.2 Å²	65.2	15%	0.152	34%	0.339	C	S	.	.			trans	-136.6	114	179.2	179.2	0	0	0	0	107.7	T396 Y400 L429 I459 T460	T396-V427 HydrophobicContact CG2-CB 4.08Å; T396-V427 HydrophobicContact CG2-CG1 3.77Å; T396-V427 WeakPolarHBondContact CG2-O 3.42Å; T396-V427 PolarHBondContact N-O 2.82Å; T396-V427 PolarHBondContact OG1-O 2.96Å; Y400-V427 PolarHBondContact OH-N 2.86Å; Y400-V427 PolarHBondContact OH-O 3.41Å; V427-L429 HydrophobicContact CG1-CD2 4.19Å; V427-L429 HydrophobicContact CG1-CG 4.16Å; V427-I459 HydrophobicContact CG1-CG2 4.11Å; V427-T460 HydrophobicContact CG2-CG2 4.27Å
428	A	92.6	Very high	87.6	Confident	6 Å²	6	66.2 Å²	66.2	5%	0.05	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140	166.5	0	0	0	0	0	108.4	Y394 F395 L441 L443 A483	Y394-A428 CarbonylContact O-C 3.57Å; Y394-A428 VanDerWaalsContact O-CA 3.27Å; Y394-A428 WeakPolarHBondContact O-CA 3.39Å; F395-A428 HydrophobicContact CD1-CB 3.85Å; F395-A428 HydrophobicContact CE1-CB 3.84Å; F395-A428 HydrophobicContact CG-CB 4.43Å; F395-A428 HydrophobicContact CZ-CB 4.41Å; A428-L441 HydrophobicContact CB-CD1 3.72Å; A428-L443 HydrophobicContact CB-CD2 4.19Å; A428-A483 HydrophobicContact CB-CB 3.9Å
429	L	92.4	Very high	87.4	Confident	17 Å²	17	62.3 Å²	62.3	9%	0.089	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	166.3	177.9	-64.3	175.9	0	0	0	109.1	P393 Y394 T396 V427 I459	P393-L429 CarbonylContact C-O 3.58Å; P393-L429 WeakPolarHBondContact CA-O 3.37Å; Y394-L429 WeakPolarHBondContact CD1-O 3.36Å; Y394-L429 HydrophobicContact CE1-CB 3.98Å; Y394-L429 HydrophobicContact CE2-CB 4.35Å; Y394-L429 PolarHBondContact N-O 2.93Å; Y394-L429 PolarHBondContact O-N 2.97Å; T396-L429 HydrophobicContact CG2-CD1 3.95Å; T396-L429 HydrophobicContact CG2-CG 4.2Å; V427-L429 HydrophobicContact CG1-CD2 4.19Å; V427-L429 HydrophobicContact CG1-CG 4.16Å; L429-I459 HydrophobicContact CD2-CG2 4.12Å
430	D	89.4	Confident	87.3	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.016	32%	0.323	C	S	.	.			trans	-133.4	141.2	175.7	-168.1	-29.1	0	0	0	106.6	D432 P439	D430-D432 PolarHBondContact OD1-N 2.97Å; D430-P439 HydrophobicContact CB-CB 3.8Å; D430-P439 HydrophobicContact CB-CG 4.46Å
431	K	85	Confident	87.4	Confident	118 Å²	118	60.2 Å²	60.2	51%	0.513	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-18.5	-178.5	-67.1	-172.7	-164.3	156.8	0	113.3	Q391 Y394 I433	Q391-K431 HydrophobicContact CB-CB 4Å; Q391-K431 HydrophobicContact CG-CB 3.98Å; Q391-K431 HydrophobicContact CG-CD 4.48Å; Y394-K431 HydrophobicContact CE1-CG 3.87Å; K431-I433 PolarHBondContact O-N 2.79Å; K431-I433 VanDerWaalsContact O-N 3.15Å
432	D	80.9	Confident	87.7	Confident	21 Å²	21	60.5 Å²	60.5	11%	0.112	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-5.1	175.6	-58.1	-21.3	0	0	0	111	N389 N390 Q391 D430	N389-D432 WeakPolarHBondContact CA-OD2 3.47Å; N389-D432 PolarHBondContact ND2-OD2 3.46Å; N390-D432 PolarHBondContact N-OD2 2.81Å; Q391-D432 VanDerWaalsContact CB-OD1 3.24Å; Q391-D432 WeakPolarHBondContact CB-OD1 3.38Å; Q391-D432 WeakPolarHBondContact CG-OD1 3.44Å; Q391-D432 PolarHBondContact N-OD1 3.43Å; Q391-D432 PolarHBondContact N-OD2 3.34Å; D430-D432 PolarHBondContact OD1-N 2.97Å
433	I	79.3	Confident	87.8	Confident	62 Å²	62	59 Å²	59	32%	0.318	29%	0.29	S	S	.	.	S	Bend	trans	-133.6	139.9	179.5	-63.3	176	0	0	0	109.1	K431 D435 K437 P439	K431-I433 PolarHBondContact O-N 2.79Å; K431-I433 VanDerWaalsContact O-N 3.15Å; I433-D435 PolarHBondContact O-N 2.97Å; I433-K437 HydrophobicContact CG2-CB 3.79Å; I433-K437 HydrophobicContact CG2-CD 4.47Å; I433-P439 HydrophobicContact CB-CB 4.48Å; I433-P439 HydrophobicContact CD1-CB 3.94Å
434	E	77.3	Confident	87.7	Confident	122 Å²	122	62 Å²	62	57%	0.57	30%	0.299	S	S	*	.			trans	-59.7	129.4	175.4	-63.6	172.6	146.3	0	0	111.4	T436 K437	E434-T436 PolarHBondContact O-N 2.89Å; E434-K437 HydrophobicContact CB-CD 4.46Å; E434-K437 PolarHBondContact O-N 2.89Å; E434-K437 VanDerWaalsContact OE2-CE 3.23Å; E434-K437 WeakPolarHBondContact OE2-CE 3.19Å; E434-K437 IonicContact OE2-NZ 3.68Å; E434-K437 PolarHBondContact OE2-NZ 3.18Å
435	D	80.2	Confident	87.8	Confident	100 Å²	100	62.7 Å²	62.7	54%	0.535	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.7	-18.2	178.4	-69.4	-14.8	0	0	0	117	I433	I433-D435 PolarHBondContact O-N 2.97Å
436	T	79.3	Confident	87.8	Confident	116 Å²	116	61.3 Å²	61.3	71%	0.712	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-9.4	-179.1	65.2	0	0	0	0	114.3	E434	E434-T436 PolarHBondContact O-N 2.89Å
437	K	81.3	Confident	87.7	Confident	112 Å²	112	65.3 Å²	65.3	49%	0.487	33%	0.326	S	S	.	.	S	Bend	trans	-103.9	155.7	177.6	-69	165.8	178.3	156.9	0	109.5	I433 E434 P439	I433-K437 HydrophobicContact CG2-CB 3.79Å; I433-K437 HydrophobicContact CG2-CD 4.47Å; E434-K437 HydrophobicContact CB-CD 4.46Å; E434-K437 PolarHBondContact O-N 2.89Å; E434-K437 VanDerWaalsContact OE2-CE 3.23Å; E434-K437 WeakPolarHBondContact OE2-CE 3.19Å; E434-K437 IonicContact OE2-NZ 3.68Å; E434-K437 PolarHBondContact OE2-NZ 3.18Å; K437-P439 VanDerWaalsContact O-CD 3.26Å; K437-P439 WeakPolarHBondContact O-CD 3.46Å
438	D	84.1	Confident	87.6	Confident	48 Å²	48	66.7 Å²	66.7	26%	0.257	33%	0.329	S	S	.	.			trans	-76.2	119.5	170.7	-171.1	-0.4	0	0	0	108.1	E440 G458 I459 R461	D438-E440 PolarHBondContact O-N 3.09Å; D438-E440 VanDerWaalsContact O-N 3.15Å; D438-E440 PolarHBondContact OD1-N 2.88Å; D438-E440 VanDerWaalsContact OD1-N 3.14Å; D438-G458 WeakPolarHBondContact OD2-CA 3.32Å; D438-G458 PolarHBondContact OD2-N 2.88Å; D438-I459 HydrophobicContact CB-CG1 4.05Å; D438-R461 IonicContact OD1-NH2 3.41Å; D438-R461 PolarHBondContact OD1-NH2 2.83Å
439	P	84	Confident	87.6	Confident	12 Å²	12	70.7 Å²	70.7	8%	0.078	35%	0.353	C	S	.	.			trans	-72.5	6.8	174.5	28.2	-33.1	0	0	0	113.6	D430 I433 K437 L441	D430-P439 HydrophobicContact CB-CB 3.8Å; D430-P439 HydrophobicContact CB-CG 4.46Å; I433-P439 HydrophobicContact CB-CB 4.48Å; I433-P439 HydrophobicContact CD1-CB 3.94Å; K437-P439 VanDerWaalsContact O-CD 3.26Å; K437-P439 WeakPolarHBondContact O-CD 3.46Å; P439-L441 HydrophobicContact CB-CD1 4.22Å; P439-L441 HydrophobicContact CB-CD2 4.36Å; P439-L441 HydrophobicContact CB-CG 3.88Å; P439-L441 HydrophobicContact CG-CD1 3.65Å; P439-L441 HydrophobicContact CG-CG 3.71Å; P439-L441 PolarHBondContact O-N 3.36Å
440	E	87.5	Confident	87.6	Confident	157 Å²	157	73 Å²	73	73%	0.734	37%	0.371	S	S	*	.			trans	58.1	16.2	178	-57.9	-161.7	156.7	0	0	115	D438	D438-E440 PolarHBondContact O-N 3.09Å; D438-E440 VanDerWaalsContact O-N 3.15Å; D438-E440 PolarHBondContact OD1-N 2.88Å; D438-E440 VanDerWaalsContact OD1-N 3.14Å
441	L	91.9	Very high	87.8	Confident	3 Å²	3	73.6 Å²	73.6	2%	0.016	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-52.1	138.5	-175.8	-61.1	171.2	0	0	0	113.5	P393 A428 P439 R461 A483 F484 D485	P393-L441 HydrophobicContact CB-CD1 4.01Å; P393-L441 HydrophobicContact CB-CD2 3.81Å; P393-L441 HydrophobicContact CG-CD2 3.5Å; P393-L441 VanDerWaalsContact CG-CD2 3.5Å; A428-L441 HydrophobicContact CB-CD1 3.72Å; P439-L441 HydrophobicContact CB-CD1 4.22Å; P439-L441 HydrophobicContact CB-CD2 4.36Å; P439-L441 HydrophobicContact CB-CG 3.88Å; P439-L441 HydrophobicContact CG-CD1 3.65Å; P439-L441 HydrophobicContact CG-CG 3.71Å; P439-L441 PolarHBondContact O-N 3.36Å; L441-R461 VanDerWaalsContact O-CZ 3.29Å; L441-R461 PolarHBondContact O-NH1 2.63Å; L441-R461 PolarHBondContact O-NH2 2.76Å; L441-A483 HydrophobicContact CD1-CB 4.29Å; L441-F484 WeakPolarHBondContact CA-O 3.23Å; L441-D485 HydrophobicContact CD2-CB 3.68Å
442	H	92.5	Very high	88.3	Confident	110 Å²	110	68.1 Å²	68.1	51%	0.509	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.6	167.1	-65.1	-46.9	0	0	0	109.6	F444 A483 F484	H442-F444 HydrophobicContact CB-CE2 4.15Å; H442-F444 HydrophobicContact CB-CZ 4.21Å; H442-A483 CarbonylContact O-C 3.58Å; H442-F484 PolarHBondContact N-O 3.26Å; H442-F484 PolarHBondContact O-N 3.22Å
443	L	94.3	Very high	89	Confident	18 Å²	18	69.7 Å²	69.7	9%	0.094	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.4	177.3	-62.3	-166	0	0	0	110.6	F395 I426 A428 V454 R461 I481 T482 A483	F395-L443 HydrophobicContact CE1-CD1 4.38Å; F395-L443 HydrophobicContact CE1-CD2 4.2Å; F395-L443 HydrophobicContact CZ-CD2 4.06Å; I426-L443 HydrophobicContact CG2-CD1 4.1Å; A428-L443 HydrophobicContact CB-CD2 4.19Å; L443-V454 HydrophobicContact CB-CG1 3.83Å; L443-V454 HydrophobicContact CB-CG2 4.48Å; L443-V454 HydrophobicContact CD1-CG2 3.99Å; L443-R461 HydrophobicContact CD1-CB 3.97Å; L443-R461 HydrophobicContact CD1-CG 3.73Å; L443-I481 HydrophobicContact CB-CD1 4.25Å; L443-I481 HydrophobicContact CB-CG1 4.4Å; L443-I481 HydrophobicContact CD1-CD1 3.95Å; L443-T482 WeakPolarHBondContact CA-O 3.4Å; L443-A483 HydrophobicContact CD2-CB 3.36Å
444	F	92.6	Very high	89.7	Confident	112 Å²	112	67.5 Å²	67.5	49%	0.491	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.3	177.9	-61.5	-73.9	0	0	0	110.7	H442 I481 T482 F484	H442-F444 HydrophobicContact CB-CE2 4.15Å; H442-F444 HydrophobicContact CB-CZ 4.21Å; F444-I481 WeakPolarHBondContact O-CA 3.14Å; F444-I481 WeakPolarHBondContact O-CG1 3.47Å; F444-T482 PolarHBondContact N-O 2.79Å; F444-T482 PolarHBondContact O-N 3.1Å; F444-F484 HydrophobicContact CD2-CB 4.21Å; F444-F484 HydrophobicContact CE2-CB 3.72Å; F444-F484 HydrophobicContact CE2-CD1 4.13Å; F444-F484 HydrophobicContact CE2-CG 4.17Å
445	L	95	Very high	90.4	Very high	22 Å²	22	63.6 Å²	63.6	12%	0.115	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.4	169.4	-72.8	67.1	0	0	0	107.6	D447 T449 F452 V454 L463 F479 L480 I481	L445-D447 VanDerWaalsContact C-N 3.33Å; L445-T449 HydrophobicContact CB-CG2 3.99Å; L445-T449 WeakPolarHBondContact O-CG2 3.34Å; L445-F452 HydrophobicContact CD2-CB 4.15Å; L445-V454 HydrophobicContact CD1-CB 4.11Å; L445-V454 HydrophobicContact CD1-CG1 3.76Å; L445-L463 HydrophobicContact CD2-CD2 4.08Å; L445-F479 HydrophobicContact CB-CD2 4.28Å; L445-F479 HydrophobicContact CB-CE2 4.47Å; L445-F479 HydrophobicContact CD2-CD2 4Å; L445-F479 HydrophobicContact CD2-CE2 3.45Å; L445-F479 VanDerWaalsContact CD2-CE2 3.45Å; L445-F479 HydrophobicContact CD2-CZ 3.86Å; L445-F479 HydrophobicContact CG-CD2 3.97Å; L445-F479 HydrophobicContact CG-CE2 3.68Å; L445-L480 WeakPolarHBondContact CA-O 3.14Å; L445-I481 HydrophobicContact CD1-CD1 4.2Å; L445-I481 HydrophobicContact CD1-CG1 4.34Å
446	N	94.4	Very high	90.9	Very high	104 Å²	104	63.6 Å²	63.6	56%	0.556	34%	0.34	S	S	*	.	S	Bend	trans	-77.3	-18.5	-178.7	79.3	-32.2	0	0	0	114	F479 L480	N446-F479 WeakPolarHBondContact OD1-CB 3.49Å; N446-L480 HydrophobicContact CB-CB 4.28Å; N446-L480 PolarHBondContact N-O 2.75Å; N446-L480 PolarHBondContact OD1-N 3.13Å; N446-L480 PolarHBondContact OD1-O 3.18Å
447	D	93.5	Very high	91.4	Very high	83 Å²	83	63 Å²	63	44%	0.444	34%	0.337	S	S	.	.	S	Bend	trans	-152	168.4	-177.2	-159.3	-1.7	0	0	0	110.2	L445 T449 F479	L445-D447 VanDerWaalsContact C-N 3.33Å; D447-T449 PolarHBondContact O-N 2.95Å; D447-T449 VanDerWaalsContact O-N 3.11Å; D447-F479 HydrophobicContact CB-CB 4.19Å
448	Y	93.2	Very high	91.7	Very high	54 Å²	54	58.9 Å²	58.9	21%	0.212	33%	0.326	C	S	.	.			trans	54.9	24.1	-179.5	-52.4	-79	0	0	0	115.6	S450 V451 F452 Q474 Y477 F479	Y448-S450 PolarHBondContact O-N 2.86Å; Y448-V451 HydrophobicContact CD1-CG2 4.46Å; Y448-V451 PolarHBondContact O-N 3.28Å; Y448-F452 PolarHBondContact O-N 3.25Å; Y448-Q474 PolarHBondContact OH-NE2 3.23Å; Y448-Q474 VanDerWaalsContact OH-NE2 3.15Å; Y448-Y477 AromaticContact CD1-CD1 3.45Å; Y448-Y477 HydrophobicContact CD1-CD1 3.45Å; Y448-Y477 VanDerWaalsContact CD1-CD1 3.45Å; Y448-Y477 AromaticContact CD1-CE1 3.85Å; Y448-Y477 HydrophobicContact CD1-CE1 3.85Å; Y448-Y477 HydrophobicContact CD2-CD1 4.41Å; Y448-Y477 AromaticContact CE1-CD1 3.51Å; Y448-Y477 HydrophobicContact CE1-CD1 3.51Å; Y448-Y477 AromaticContact CE1-CE1 3.9Å; Y448-Y477 HydrophobicContact CE1-CE1 3.9Å; Y448-Y477 HydrophobicContact CE2-CD1 4.49Å; Y448-Y477 AromaticContact CG-CD1 3.91Å; Y448-Y477 HydrophobicContact CG-CD1 3.91Å; Y448-F479 HydrophobicContact CD2-CB 4.05Å; Y448-F479 AromaticContact CD2-CD1 3.85Å; Y448-F479 HydrophobicContact CD2-CD1 3.85Å; Y448-F479 HydrophobicContact CD2-CG 4.35Å
449	T	91.5	Very high	92	Very high	91 Å²	91	59.3 Å²	59.3	56%	0.558	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.5	176.3	58.2	0	0	0	0	114.2	L445 D447 L466	L445-T449 HydrophobicContact CB-CG2 3.99Å; L445-T449 WeakPolarHBondContact O-CG2 3.34Å; D447-T449 PolarHBondContact O-N 2.95Å; D447-T449 VanDerWaalsContact O-N 3.11Å; T449-L466 WeakPolarHBondContact O-CD1 3.47Å
450	S	92.4	Very high	92.4	Very high	65 Å²	65	60.8 Å²	60.8	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-19.8	170.6	55.2	0	0	0	0	113.7	Y448 L466 Q467	Y448-S450 PolarHBondContact O-N 2.86Å; S450-L466 WeakPolarHBondContact O-CB 3.45Å; S450-Q467 VanDerWaalsContact O-CD 3.26Å; S450-Q467 VanDerWaalsContact O-CG 3.31Å; S450-Q467 WeakPolarHBondContact O-CG 3.27Å; S450-Q467 PolarHBondContact O-NE2 3.48Å
451	V	94	Very high	92.7	Very high	16 Å²	16	53.7 Å²	53.7	10%	0.097	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-38.1	-175.3	-173.5	0	0	0	0	111.2	Y448 L465 L466 V469 Y477	Y448-V451 HydrophobicContact CD1-CG2 4.46Å; Y448-V451 PolarHBondContact O-N 3.28Å; V451-L465 HydrophobicContact CG1-CD1 4.26Å; V451-L466 PolarHBondContact O-N 2.82Å; V451-V469 HydrophobicContact CG1-CG1 3.63Å; V451-Y477 HydrophobicContact CG1-CE1 4.27Å
452	F	95.7	Very high	92.9	Very high	3 Å²	3	56.4 Å²	56.4	1%	0.013	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	147.1	179.1	-52.5	-72	0	0	0	111.8	I414 L445 Y448 T464 L465 Y477 F479 I497	I414-F452 HydrophobicContact CD1-CD1 4.08Å; I414-F452 HydrophobicContact CD1-CE1 3.81Å; I414-F452 HydrophobicContact CG1-CD1 4.46Å; L445-F452 HydrophobicContact CD2-CB 4.15Å; Y448-F452 PolarHBondContact O-N 3.25Å; F452-T464 WeakPolarHBondContact CA-O 3.42Å; F452-L465 HydrophobicContact CD1-CD1 4.03Å; F452-L465 HydrophobicContact CE1-CD1 3.67Å; F452-Y477 AromaticContact CE2-CD1 3.7Å; F452-Y477 HydrophobicContact CE2-CD1 3.7Å; F452-Y477 HydrophobicContact CE2-CD2 4.31Å; F452-Y477 HydrophobicContact CE2-CE1 4.39Å; F452-Y477 AromaticContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CZ-CD1 4.17Å; F452-Y477 HydrophobicContact CZ-CD2 4.03Å; F452-Y477 AromaticContact CZ-CG 3.85Å; F452-Y477 HydrophobicContact CZ-CG 3.85Å; F452-F479 AromaticContact CD2-CE1 3.73Å; F452-F479 HydrophobicContact CD2-CE1 3.73Å; F452-F479 HydrophobicContact CD2-CZ 4.24Å; F452-F479 HydrophobicContact CE2-CE1 4.08Å; F452-F479 HydrophobicContact CG-CE1 4.48Å; F452-I497 HydrophobicContact CD1-CD1 3.88Å; F452-I497 HydrophobicContact CD2-CD1 4.11Å; F452-I497 HydrophobicContact CE1-CD1 3.65Å; F452-I497 HydrophobicContact CE2-CD1 3.9Å; F452-I497 HydrophobicContact CG-CD1 4.12Å; F452-I497 HydrophobicContact CZ-CD1 3.66Å; F452-I497 HydrophobicContact CZ-CG2 4.44Å
453	T	94.6	Very high	93	Very high	54 Å²	54	51.1 Å²	51.1	33%	0.331	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	154.5	165.2	-172.3	0	0	0	0	109.9	L463 T464 L466	T453-L463 CarbonylContact O-C 3.54Å; T453-L463 WeakPolarHBondContact O-CA 3.42Å; T453-T464 WeakPolarHBondContact CG2-OG1 3.24Å; T453-T464 PolarHBondContact N-O 2.96Å; T453-T464 PolarHBondContact O-N 2.83Å; T453-L466 HydrophobicContact CG2-CD2 3.71Å; T453-L466 HydrophobicContact CG2-CG 3.99Å
454	V	94.7	Very high	93	Very high	16 Å²	16	51.7 Å²	51.7	10%	0.097	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	148	170.9	64.9	0	0	0	0	110.1	L443 L445 R461 Y462 L463	L443-V454 HydrophobicContact CB-CG1 3.83Å; L443-V454 HydrophobicContact CB-CG2 4.48Å; L443-V454 HydrophobicContact CD1-CG2 3.99Å; L445-V454 HydrophobicContact CD1-CB 4.11Å; L445-V454 HydrophobicContact CD1-CG1 3.76Å; V454-R461 HydrophobicContact CG2-CB 3.93Å; V454-Y462 WeakPolarHBondContact CA-O 3.34Å; V454-L463 HydrophobicContact CB-CD2 3.99Å; V454-L463 HydrophobicContact CG2-CD2 4.46Å
455	T	93	Very high	93.2	Very high	40 Å²	40	46.5 Å²	46.5	25%	0.245	27%	0.27	C	S	.	.			trans	-61.9	132.6	175.9	49	0	0	0	0	111.4	T457 R461 Y462	T455-T457 PolarHBondContact O-N 3.22Å; T455-R461 WeakPolarHBondContact O-CD 3.44Å; T455-R461 PolarHBondContact O-NH1 2.97Å; T455-R461 VanDerWaalsContact OG1-CA 3.26Å; T455-R461 WeakPolarHBondContact OG1-CA 3.27Å; T455-Y462 HydrophobicContact CG2-CD2 4.41Å; T455-Y462 PolarHBondContact N-O 3.26Å; T455-Y462 PolarHBondContact OG1-N 2.79Å
456	P	89.9	Confident	93.1	Very high	99 Å²	99	49 Å²	49	64%	0.643	28%	0.284	S	S	*	.	S	Bend	trans	-81.4	-9.5	-168.6	31.9	-37.4	0	0	0	115.5	R461	P456-R461 PolarHBondContact O-NH1 2.86Å
457	T	89.4	Confident	93.1	Very high	105 Å²	105	48.9 Å²	48.9	64%	0.644	28%	0.279	S	S	*	.	S	Bend	trans	-143.5	163	-178.8	56.3	0	0	0	0	111.6	T455	T455-T457 PolarHBondContact O-N 3.22Å
458	G	88.4	Confident	93.1	Very high	24 Å²	24	49.9 Å²	49.9	25%	0.247	29%	0.29	C	S	.	.	S	Bend	trans	102.6	150.9	176.4	0	0	0	0	0	114.1	D438 T460 R461	D438-G458 WeakPolarHBondContact OD2-CA 3.32Å; D438-G458 PolarHBondContact OD2-N 2.88Å; G458-T460 VanDerWaalsContact C-N 3.32Å; G458-T460 PolarHBondContact O-N 3.31Å; G458-R461 WeakPolarHBondContact O-CD 3.32Å; G458-R461 PolarHBondContact O-NE 3.09Å; G458-R461 PolarHBondContact O-NH2 2.98Å
459	I	89.5	Confident	93.1	Very high	58 Å²	58	47.7 Å²	47.7	30%	0.297	28%	0.283	S	S	.	.	S	Bend	trans	-61.6	-40.3	176	-61.1	167.5	0	0	0	111.5	V427 L429 D438	V427-I459 HydrophobicContact CG1-CG2 4.11Å; L429-I459 HydrophobicContact CD2-CG2 4.12Å; D438-I459 HydrophobicContact CB-CG1 4.05Å
460	T	92.8	Very high	93.2	Very high	42 Å²	42	46 Å²	46	26%	0.258	27%	0.271	S	S	.	.	S	Bend	trans	-98	125.4	173.6	-54.3	0	0	0	0	110.7	R425 V427 G458 Y462	R425-T460 HydrophobicContact CB-CG2 3.77Å; R425-T460 HydrophobicContact CG-CG2 3.77Å; V427-T460 HydrophobicContact CG2-CG2 4.27Å; G458-T460 VanDerWaalsContact C-N 3.32Å; G458-T460 PolarHBondContact O-N 3.31Å; T460-Y462 HydrophobicContact CG2-CE1 3.99Å; T460-Y462 HydrophobicContact CG2-CE2 4.06Å
461	R	93.5	Very high	93.3	Very high	8 Å²	8	43.7 Å²	43.7	3%	0.03	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-108.4	146.9	-177.7	-55.3	-75.5	174	125.8	0.4	110.1	I426 D438 L441 L443 V454 T455 P456 G458	I426-R461 HydrophobicContact CB-CB 4.17Å; I426-R461 HydrophobicContact CG2-CB 4.47Å; I426-R461 PolarHBondContact N-O 2.6Å; I426-R461 WeakPolarHBondContact O-CB 3.49Å; I426-R461 PolarHBondContact O-N 3.16Å; D438-R461 IonicContact OD1-NH2 3.41Å; D438-R461 PolarHBondContact OD1-NH2 2.83Å; L441-R461 VanDerWaalsContact O-CZ 3.29Å; L441-R461 PolarHBondContact O-NH1 2.63Å; L441-R461 PolarHBondContact O-NH2 2.76Å; L443-R461 HydrophobicContact CD1-CB 3.97Å; L443-R461 HydrophobicContact CD1-CG 3.73Å; V454-R461 HydrophobicContact CG2-CB 3.93Å; T455-R461 WeakPolarHBondContact O-CD 3.44Å; T455-R461 PolarHBondContact O-NH1 2.97Å; T455-R461 VanDerWaalsContact OG1-CA 3.26Å; T455-R461 WeakPolarHBondContact OG1-CA 3.27Å; P456-R461 PolarHBondContact O-NH1 2.86Å; G458-R461 WeakPolarHBondContact O-CD 3.32Å; G458-R461 PolarHBondContact O-NE 3.09Å; G458-R461 PolarHBondContact O-NH2 2.98Å
462	Y	95.3	Very high	93.3	Very high	60 Å²	60	45.6 Å²	45.6	24%	0.235	26%	0.26	C	S	.	.			trans	-128.7	140.5	-177.5	-60.6	-74.2	0	0	0	110.5	T413 P423 L424 R425 V454 T455 T460	T413-Y462 HydrophobicContact CG2-CD1 4.35Å; T413-Y462 HydrophobicContact CG2-CG 4.48Å; P423-Y462 HydrophobicContact CB-CD1 3.86Å; P423-Y462 HydrophobicContact CB-CE1 3.9Å; P423-Y462 HydrophobicContact CG-CD1 4.25Å; P423-Y462 HydrophobicContact CG-CE1 3.77Å; L424-Y462 WeakPolarHBondContact O-CD1 3.38Å; R425-Y462 HydrophobicContact CG-CE1 3.97Å; R425-Y462 PolarHBondContact NH1-OH 2.91Å; V454-Y462 WeakPolarHBondContact CA-O 3.34Å; T455-Y462 HydrophobicContact CG2-CD2 4.41Å; T455-Y462 PolarHBondContact N-O 3.26Å; T455-Y462 PolarHBondContact OG1-N 2.79Å; T460-Y462 HydrophobicContact CG2-CE1 3.99Å; T460-Y462 HydrophobicContact CG2-CE2 4.06Å
463	L	95.4	Very high	93.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	132.4	170	-72.6	167.8	0	0	0	110.1	T413 I414 L424 I426 L445 T453 V454 F479 V495 I497	T413-L463 WeakPolarHBondContact CA-O 3.47Å; T413-L463 WeakPolarHBondContact CG2-O 3.41Å; I414-L463 HydrophobicContact CB-CB 4.19Å; I414-L463 HydrophobicContact CG1-CB 3.71Å; I414-L463 PolarHBondContact N-O 3.36Å; L424-L463 HydrophobicContact CD2-CD1 4.37Å; I426-L463 HydrophobicContact CD1-CD1 3.69Å; I426-L463 HydrophobicContact CD1-CG 3.79Å; L445-L463 HydrophobicContact CD2-CD2 4.08Å; T453-L463 CarbonylContact O-C 3.54Å; T453-L463 WeakPolarHBondContact O-CA 3.42Å; V454-L463 HydrophobicContact CB-CD2 3.99Å; V454-L463 HydrophobicContact CG2-CD2 4.46Å; L463-F479 HydrophobicContact CD1-CE2 4.46Å; L463-F479 HydrophobicContact CD1-CZ 4.02Å; L463-F479 HydrophobicContact CD2-CZ 4.45Å; L463-V495 HydrophobicContact CD1-CG1 3.81Å; L463-I497 HydrophobicContact CD1-CD1 4.34Å
464	T	94.9	Very high	93.2	Very high	30 Å²	30	54 Å²	54	18%	0.184	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155.4	174.8	61	0	0	0	0	111.8	A412 T413 F452 T453	A412-T464 CarbonylContact O-C 3.59Å; A412-T464 VanDerWaalsContact O-CA 3.24Å; A412-T464 WeakPolarHBondContact O-CA 3.48Å; T413-T464 HydrophobicContact CG2-CG2 4.37Å; F452-T464 WeakPolarHBondContact CA-O 3.42Å; T453-T464 WeakPolarHBondContact CG2-OG1 3.24Å; T453-T464 PolarHBondContact N-O 2.96Å; T453-T464 PolarHBondContact O-N 2.83Å
465	L	95.5	Very high	93.1	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	130.7	-175	-163.5	70.6	0	0	0	112.1	G411 A412 V451 F452 Q467 V469	G411-L465 PolarHBondContact N-O 3.1Å; A412-L465 PolarHBondContact O-N 2.9Å; V451-L465 HydrophobicContact CG1-CD1 4.26Å; F452-L465 HydrophobicContact CD1-CD1 4.03Å; F452-L465 HydrophobicContact CE1-CD1 3.67Å; L465-Q467 VanDerWaalsContact CD1-O 3.28Å; L465-Q467 WeakPolarHBondContact CD1-O 3.28Å; L465-Q467 WeakPolarHBondContact CD2-O 3.45Å; L465-Q467 WeakPolarHBondContact CG-O 3.43Å; L465-V469 HydrophobicContact CD1-CG1 3.89Å; L465-V469 HydrophobicContact CD1-CG2 4.35Å; L465-V469 HydrophobicContact CD2-CG2 4.49Å
466	L	94.4	Very high	93.2	Very high	76 Å²	76	60.5 Å²	60.5	40%	0.398	33%	0.327	S	S	.	.	S	Bend	trans	-100.2	-29.6	175.5	-70.7	-179.9	0	0	0	113.5	V410 T449 S450 V451 T453	V410-L466 WeakPolarHBondContact CG1-O 3.25Å; T449-L466 WeakPolarHBondContact O-CD1 3.47Å; S450-L466 WeakPolarHBondContact O-CB 3.45Å; V451-L466 PolarHBondContact O-N 2.82Å; T453-L466 HydrophobicContact CG2-CD2 3.71Å; T453-L466 HydrophobicContact CG2-CG 3.99Å
467	Q	93.3	Very high	93.5	Very high	100 Å²	100	56.6 Å²	56.6	47%	0.467	30%	0.3	S	S	.	.	S	Bend	trans	-134.9	147.3	179.3	-69.7	-180	1.5	0	0	109.1	S450 L465	S450-Q467 VanDerWaalsContact O-CD 3.26Å; S450-Q467 VanDerWaalsContact O-CG 3.31Å; S450-Q467 WeakPolarHBondContact O-CG 3.27Å; S450-Q467 PolarHBondContact O-NE2 3.48Å; L465-Q467 VanDerWaalsContact CD1-O 3.28Å; L465-Q467 WeakPolarHBondContact CD1-O 3.28Å; L465-Q467 WeakPolarHBondContact CD2-O 3.45Å; L465-Q467 WeakPolarHBondContact CG-O 3.43Å
468	P	93.2	Very high	93.8	Very high	104 Å²	104	55.1 Å²	55.1	68%	0.675	29%	0.291	S	S	*	.			trans	-52	146.9	171.9	-22.4	33.8	0	0	0	110.9	V410	V410-P468 HydrophobicContact CG2-CG 4.11Å
469	V	93.8	Very high	94.2	Very high	8 Å²	8	54.1 Å²	54.1	5%	0.048	28%	0.28	C	S	.	.			trans	-115.7	148.2	171.9	-71.8	0	0	0	0	108.6	I404 E406 V451 L465 Y477 V499	I404-V469 HydrophobicContact CG2-CG2 4.25Å; E406-V469 WeakPolarHBondContact CB-O 3.31Å; V451-V469 HydrophobicContact CG1-CG1 3.63Å; L465-V469 HydrophobicContact CD1-CG1 3.89Å; L465-V469 HydrophobicContact CD1-CG2 4.35Å; L465-V469 HydrophobicContact CD2-CG2 4.49Å; V469-Y477 HydrophobicContact CB-CE2 4.4Å; V469-Y477 HydrophobicContact CG1-CE2 3.99Å; V469-V499 HydrophobicContact CB-CG2 4.37Å; V469-V499 HydrophobicContact CG2-CG1 4.28Å; V469-V499 HydrophobicContact CG2-CG2 4.27Å
470	D	94	Very high	94.5	Very high	57 Å²	57	54.2 Å²	54.2	31%	0.305	28%	0.28	S	S	.	.			trans	-128	127.9	-177	172.1	-41	0	0	0	105.9	E472 E473 Q474	D470-E472 WeakPolarHBondContact OD1-CA 3.44Å; D470-E472 WeakPolarHBondContact OD1-CB 3.39Å; D470-E472 PolarHBondContact OD1-N 2.85Å; D470-E473 HydrophobicContact CB-CB 4.11Å; D470-E473 HydrophobicContact CB-CG 4.22Å; D470-E473 PolarHBondContact OD1-N 2.88Å; D470-Q474 PolarHBondContact O-N 2.75Å
471	R	94.8	Very high	94.6	Very high	15 Å²	15	52.2 Å²	52.2	6%	0.057	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-33.3	-174.4	-171.3	-151.4	68.7	101.7	0.9	111	E406 E473 Q475 V499 D501 A536 E538	E406-R471 WeakPolarHBondContact OE2-CA 3.39Å; E406-R471 WeakPolarHBondContact OE2-CB 3.46Å; E406-R471 PolarHBondContact OE2-N 2.82Å; R471-E473 VanDerWaalsContact C-N 3.32Å; R471-Q475 HydrophobicContact CG-CG 4.22Å; R471-Q475 WeakPolarHBondContact O-CG 3.32Å; R471-Q475 PolarHBondContact O-N 3.36Å; R471-V499 HydrophobicContact CB-CB 4.3Å; R471-V499 HydrophobicContact CB-CG1 3.81Å; R471-V499 HydrophobicContact CG-CB 4.28Å; R471-V499 HydrophobicContact CG-CG1 4.23Å; R471-D501 IonicContact CZ-OD1 3.61Å; R471-D501 IonicContact NE-OD1 2.98Å; R471-D501 PolarHBondContact NE-OD1 2.77Å; R471-D501 IonicContact NH2-OD1 2.94Å; R471-A536 PolarHBondContact NH2-O 2.72Å; R471-E538 IonicContact NH1-OE2 3.8Å; R471-E538 PolarHBondContact NH1-OE2 2.68Å
472	E	93.7	Very high	94.7	Very high	57 Å²	57	52.7 Å²	52.7	27%	0.266	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-34.9	174.8	-70.9	62.9	-121.9	0	0	111.4	D470 N505 A536	D470-E472 WeakPolarHBondContact OD1-CA 3.44Å; D470-E472 WeakPolarHBondContact OD1-CB 3.39Å; D470-E472 PolarHBondContact OD1-N 2.85Å; E472-N505 PolarHBondContact OE2-ND2 2.83Å; E472-A536 HydrophobicContact CG-CB 3.54Å
473	E	93	Very high	94.7	Very high	169 Å²	169	49.9 Å²	49.9	79%	0.79	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-53.3	169.9	-71.8	-163.5	161.6	0	0	112.2	D470 R471	D470-E473 HydrophobicContact CB-CB 4.11Å; D470-E473 HydrophobicContact CB-CG 4.22Å; D470-E473 PolarHBondContact OD1-N 2.88Å; R471-E473 VanDerWaalsContact C-N 3.32Å
474	Q	94	Very high	94.6	Very high	63 Å²	63	52.3 Å²	52.3	29%	0.294	27%	0.272	S	S	.	.			trans	-149.8	99.6	-176.8	-175.8	166.3	-14.5	0	0	114.5	Y448 D470 T476 Y477 V499	Y448-Q474 PolarHBondContact OH-NE2 3.23Å; Y448-Q474 VanDerWaalsContact OH-NE2 3.15Å; D470-Q474 PolarHBondContact O-N 2.75Å; Q474-T476 VanDerWaalsContact C-N 3.32Å; Q474-T476 WeakPolarHBondContact CG-O 3.42Å; Q474-T476 PolarHBondContact NE2-O 3.48Å; Q474-T476 PolarHBondContact O-N 2.97Å; Q474-Y477 HydrophobicContact CB-CE2 4.25Å; Q474-Y477 HydrophobicContact CG-CD2 4.42Å; Q474-Y477 HydrophobicContact CG-CE1 4.14Å; Q474-Y477 HydrophobicContact CG-CE2 3.97Å; Q474-Y477 WeakPolarHBondContact O-CE2 3.46Å; Q474-V499 WeakPolarHBondContact O-CG2 3.46Å
475	Q	92.9	Very high	94.4	Very high	113 Å²	113	52.6 Å²	52.6	53%	0.528	27%	0.272	S	S	.	.	S	Bend	trans	-62.3	-28.4	179.6	-58.7	-177.8	-7.2	0	0	115.4	R471 V499	R471-Q475 HydrophobicContact CG-CG 4.22Å; R471-Q475 WeakPolarHBondContact O-CG 3.32Å; R471-Q475 PolarHBondContact O-N 3.36Å; Q475-V499 PolarHBondContact O-N 3.17Å
476	T	95.2	Very high	93.9	Very high	81 Å²	81	54.9 Å²	54.9	50%	0.497	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	137.7	-172.9	56.2	0	0	0	0	113	Q474 I497	Q474-T476 VanDerWaalsContact C-N 3.32Å; Q474-T476 WeakPolarHBondContact CG-O 3.42Å; Q474-T476 PolarHBondContact NE2-O 3.48Å; Q474-T476 PolarHBondContact O-N 2.97Å; T476-I497 CarbonylContact C-O 3.56Å; T476-I497 WeakPolarHBondContact CA-O 3.31Å
477	Y	96	Very high	93.4	Very high	17 Å²	17	56.2 Å²	56.2	7%	0.067	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	120.7	174.4	-63.3	-98.6	0	0	0	109.1	Y448 V451 F452 V469 Q474 N496 I497 V499	Y448-Y477 AromaticContact CD1-CD1 3.45Å; Y448-Y477 HydrophobicContact CD1-CD1 3.45Å; Y448-Y477 VanDerWaalsContact CD1-CD1 3.45Å; Y448-Y477 AromaticContact CD1-CE1 3.85Å; Y448-Y477 HydrophobicContact CD1-CE1 3.85Å; Y448-Y477 HydrophobicContact CD2-CD1 4.41Å; Y448-Y477 AromaticContact CE1-CD1 3.51Å; Y448-Y477 HydrophobicContact CE1-CD1 3.51Å; Y448-Y477 AromaticContact CE1-CE1 3.9Å; Y448-Y477 HydrophobicContact CE1-CE1 3.9Å; Y448-Y477 HydrophobicContact CE2-CD1 4.49Å; Y448-Y477 AromaticContact CG-CD1 3.91Å; Y448-Y477 HydrophobicContact CG-CD1 3.91Å; V451-Y477 HydrophobicContact CG1-CE1 4.27Å; F452-Y477 AromaticContact CE2-CD1 3.7Å; F452-Y477 HydrophobicContact CE2-CD1 3.7Å; F452-Y477 HydrophobicContact CE2-CD2 4.31Å; F452-Y477 HydrophobicContact CE2-CE1 4.39Å; F452-Y477 AromaticContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CE2-CG 3.65Å; F452-Y477 HydrophobicContact CZ-CD1 4.17Å; F452-Y477 HydrophobicContact CZ-CD2 4.03Å; F452-Y477 AromaticContact CZ-CG 3.85Å; F452-Y477 HydrophobicContact CZ-CG 3.85Å; V469-Y477 HydrophobicContact CB-CE2 4.4Å; V469-Y477 HydrophobicContact CG1-CE2 3.99Å; Q474-Y477 HydrophobicContact CB-CE2 4.25Å; Q474-Y477 HydrophobicContact CG-CD2 4.42Å; Q474-Y477 HydrophobicContact CG-CE1 4.14Å; Q474-Y477 HydrophobicContact CG-CE2 3.97Å; Q474-Y477 WeakPolarHBondContact O-CE2 3.46Å; Y477-N496 CarbonylContact O-C 3.51Å; Y477-I497 PolarHBondContact N-O 2.79Å; Y477-I497 PolarHBondContact O-N 2.77Å; Y477-V499 HydrophobicContact CD2-CG2 3.99Å; Y477-V499 HydrophobicContact CE2-CG2 3.61Å
478	T	96.2	Very high	93.2	Very high	73 Å²	73	53.3 Å²	53.3	45%	0.448	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.5	179.2	-65.2	0	0	0	0	109.3	V494 V495 N496	T478-V494 HydrophobicContact CG2-CG1 4.06Å; T478-V495 WeakPolarHBondContact CA-O 3.23Å; T478-N496 WeakPolarHBondContact CB-OD1 3.45Å; T478-N496 WeakPolarHBondContact CG2-OD1 3.33Å; T478-N496 PolarHBondContact OG1-OD1 2.68Å
479	F	96.2	Very high	93.2	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	170.8	178.8	54.2	-91.2	0	0	0	111.4	L445 N446 D447 Y448 F452 L463 V495 I497	L445-F479 HydrophobicContact CB-CD2 4.28Å; L445-F479 HydrophobicContact CB-CE2 4.47Å; L445-F479 HydrophobicContact CD2-CD2 4Å; L445-F479 HydrophobicContact CD2-CE2 3.45Å; L445-F479 VanDerWaalsContact CD2-CE2 3.45Å; L445-F479 HydrophobicContact CD2-CZ 3.86Å; L445-F479 HydrophobicContact CG-CD2 3.97Å; L445-F479 HydrophobicContact CG-CE2 3.68Å; N446-F479 WeakPolarHBondContact OD1-CB 3.49Å; D447-F479 HydrophobicContact CB-CB 4.19Å; Y448-F479 HydrophobicContact CD2-CB 4.05Å; Y448-F479 AromaticContact CD2-CD1 3.85Å; Y448-F479 HydrophobicContact CD2-CD1 3.85Å; Y448-F479 HydrophobicContact CD2-CG 4.35Å; F452-F479 AromaticContact CD2-CE1 3.73Å; F452-F479 HydrophobicContact CD2-CE1 3.73Å; F452-F479 HydrophobicContact CD2-CZ 4.24Å; F452-F479 HydrophobicContact CE2-CE1 4.08Å; F452-F479 HydrophobicContact CG-CE1 4.48Å; L463-F479 HydrophobicContact CD1-CE2 4.46Å; L463-F479 HydrophobicContact CD1-CZ 4.02Å; L463-F479 HydrophobicContact CD2-CZ 4.45Å; F479-V495 HydrophobicContact CD2-CB 3.97Å; F479-V495 HydrophobicContact CD2-CG2 4.25Å; F479-V495 HydrophobicContact CE1-CB 4.46Å; F479-V495 HydrophobicContact CE1-CG1 4.29Å; F479-V495 HydrophobicContact CE2-CB 3.65Å; F479-V495 HydrophobicContact CE2-CG1 3.9Å; F479-V495 HydrophobicContact CE2-CG2 3.88Å; F479-V495 HydrophobicContact CG-CB 4.5Å; F479-V495 HydrophobicContact CZ-CB 3.93Å; F479-V495 HydrophobicContact CZ-CG1 3.71Å; F479-V495 PolarHBondContact N-O 3.12Å; F479-V495 PolarHBondContact O-N 3.24Å; F479-I497 HydrophobicContact CE1-CD1 3.78Å; F479-I497 HydrophobicContact CE1-CG1 4.31Å; F479-I497 HydrophobicContact CZ-CD1 3.96Å
480	L	96.7	Very high	93.2	Very high	59 Å²	59	54.4 Å²	54.4	31%	0.309	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	144.1	172.8	-57	176.6	0	0	0	109.9	L445 N446 P492 V493 V494	L445-L480 WeakPolarHBondContact CA-O 3.14Å; N446-L480 HydrophobicContact CB-CB 4.28Å; N446-L480 PolarHBondContact N-O 2.75Å; N446-L480 PolarHBondContact OD1-N 3.13Å; N446-L480 PolarHBondContact OD1-O 3.18Å; L480-P492 HydrophobicContact CB-CB 4.13Å; L480-P492 HydrophobicContact CD1-CB 4.07Å; L480-V493 CarbonylContact C-O 3.55Å; L480-V493 VanDerWaalsContact CA-O 3.32Å; L480-V493 WeakPolarHBondContact CA-O 3.32Å; L480-V494 HydrophobicContact CD2-CB 4.35Å; L480-V494 HydrophobicContact CD2-CG2 3.66Å
481	I	95.8	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.9	169	-163.8	169.4	0	0	0	109.8	F395 I426 L443 F444 L445 V493 V495	F395-I481 HydrophobicContact CE1-CG2 3.92Å; F395-I481 HydrophobicContact CE2-CG2 4.21Å; F395-I481 VanDerWaalsContact CE2-O 3.3Å; F395-I481 WeakPolarHBondContact CE2-O 3.3Å; F395-I481 HydrophobicContact CZ-CB 4.31Å; F395-I481 HydrophobicContact CZ-CG1 4.08Å; F395-I481 HydrophobicContact CZ-CG2 3.69Å; I426-I481 HydrophobicContact CD1-CD1 4.02Å; I426-I481 HydrophobicContact CG2-CD1 4.35Å; L443-I481 HydrophobicContact CB-CD1 4.25Å; L443-I481 HydrophobicContact CB-CG1 4.4Å; L443-I481 HydrophobicContact CD1-CD1 3.95Å; F444-I481 WeakPolarHBondContact O-CA 3.14Å; F444-I481 WeakPolarHBondContact O-CG1 3.47Å; L445-I481 HydrophobicContact CD1-CD1 4.2Å; L445-I481 HydrophobicContact CD1-CG1 4.34Å; I481-V493 HydrophobicContact CG2-CB 4.28Å; I481-V493 PolarHBondContact N-O 2.98Å; I481-V493 PolarHBondContact O-N 3.27Å; I481-V495 HydrophobicContact CB-CG2 4.04Å; I481-V495 HydrophobicContact CG2-CG2 3.64Å
482	T	95.6	Very high	93.2	Very high	19 Å²	19	62 Å²	62	12%	0.117	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141	-179.9	-62.4	0	0	0	0	109.1	L443 F444 E489	L443-T482 WeakPolarHBondContact CA-O 3.4Å; F444-T482 PolarHBondContact N-O 2.79Å; F444-T482 PolarHBondContact O-N 3.1Å; T482-E489 HydrophobicContact CG2-CB 4Å; T482-E489 HydrophobicContact CG2-CG 4.34Å
483	A	94.7	Very high	93.3	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	146.2	174.7	0	0	0	0	0	111.3	P393 F395 A428 L441 H442 L443 E489 S490	P393-A483 HydrophobicContact CB-CB 4.03Å; F395-A483 HydrophobicContact CE2-CB 4.18Å; F395-A483 HydrophobicContact CZ-CB 3.99Å; A428-A483 HydrophobicContact CB-CB 3.9Å; L441-A483 HydrophobicContact CD1-CB 4.29Å; H442-A483 CarbonylContact O-C 3.58Å; L443-A483 HydrophobicContact CD2-CB 3.36Å; A483-E489 CarbonylContact O-C 3.58Å; A483-E489 WeakPolarHBondContact O-CA 3.46Å; A483-S490 PolarHBondContact N-OG 2.92Å; A483-S490 PolarHBondContact O-N 3.39Å
484	F	93.3	Very high	93.5	Very high	52 Å²	52	54.5 Å²	54.5	23%	0.228	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	132.5	-178.9	178.8	-113.1	0	0	0	110.4	L441 H442 F444 G486 Q488 E489	L441-F484 WeakPolarHBondContact CA-O 3.23Å; H442-F484 PolarHBondContact N-O 3.26Å; H442-F484 PolarHBondContact O-N 3.22Å; F444-F484 HydrophobicContact CD2-CB 4.21Å; F444-F484 HydrophobicContact CE2-CB 3.72Å; F444-F484 HydrophobicContact CE2-CD1 4.13Å; F444-F484 HydrophobicContact CE2-CG 4.17Å; F484-G486 VanDerWaalsContact CE1-CA 3.41Å; F484-G486 WeakPolarHBondContact CZ-O 3.3Å; F484-Q488 WeakPolarHBondContact CA-O 3.49Å; F484-Q488 WeakPolarHBondContact CD2-O 3.31Å; F484-E489 HydrophobicContact CB-CG 4.48Å; F484-E489 HydrophobicContact CD2-CG 3.72Å; F484-E489 HydrophobicContact CE2-CG 4.46Å
485	D	90	Very high	93.6	Very high	36 Å²	36	51.5 Å²	51.5	19%	0.193	29%	0.285	C	S	.	.			trans	-96.6	-13.9	-178.2	57.8	8.1	0	0	0	114	N389 P393 L441 V487 Q488	N389-D485 PolarHBondContact ND2-OD2 2.83Å; N389-D485 PolarHBondContact OD1-OD2 2.88Å; P393-D485 HydrophobicContact CG-CB 3.81Å; L441-D485 HydrophobicContact CD2-CB 3.68Å; D485-V487 WeakPolarHBondContact OD1-CA 3.48Å; D485-V487 PolarHBondContact OD1-N 2.83Å; D485-Q488 PolarHBondContact N-O 3.28Å; D485-Q488 PolarHBondContact OD1-N 3.46Å; D485-Q488 VanDerWaalsContact OD1-O 3.08Å
486	G	84.9	Confident	93.7	Very high	49 Å²	49	48.4 Å²	48.4	51%	0.505	27%	0.272	S	S	.	.	S	Bend	trans	118.2	-15.8	-170.8	0	0	0	0	0	114.4	F484	F484-G486 VanDerWaalsContact CE1-CA 3.41Å; F484-G486 WeakPolarHBondContact CZ-O 3.3Å
487	V	85.2	Confident	93.8	Very high	104 Å²	104	44.6 Å²	44.6	63%	0.63	25%	0.249	S	C	*	.	S	Bend	trans	-129.3	-42.8	-175.6	-171	0	0	0	0	111.7	N389 D485	N389-V487 WeakPolarHBondContact OD1-CB 3.4Å; D485-V487 WeakPolarHBondContact OD1-CA 3.48Å; D485-V487 PolarHBondContact OD1-N 2.83Å
488	Q	88.2	Confident	93.8	Very high	39 Å²	39	48.9 Å²	48.9	18%	0.182	27%	0.265	C	S	.	.			trans	-132.5	150.6	-169.7	-59.4	175.7	80.4	0	0	112.3	N389 N390 Q391 S392 F484 D485	N389-Q488 PolarHBondContact OD1-NE2 3.4Å; N389-Q488 VanDerWaalsContact OD1-NE2 3.07Å; N390-Q488 PolarHBondContact O-OE1 3.44Å; Q391-Q488 VanDerWaalsContact C-NE2 3.29Å; Q391-Q488 PolarHBondContact O-NE2 3.21Å; Q391-Q488 VanDerWaalsContact O-NE2 3.12Å; S392-Q488 PolarHBondContact OG-OE1 3.3Å; F484-Q488 WeakPolarHBondContact CA-O 3.49Å; F484-Q488 WeakPolarHBondContact CD2-O 3.31Å; D485-Q488 PolarHBondContact N-O 3.28Å; D485-Q488 PolarHBondContact OD1-N 3.46Å; D485-Q488 VanDerWaalsContact OD1-O 3.08Å
489	E	92.3	Very high	93.7	Very high	128 Å²	128	45.4 Å²	45.4	60%	0.598	24%	0.244	S	C	*	.	B	Isolated β-bridge	trans	-106.9	146.4	175.3	-70.5	-178.6	-160	0	0	111.3	T482 A483 F484	T482-E489 HydrophobicContact CG2-CB 4Å; T482-E489 HydrophobicContact CG2-CG 4.34Å; A483-E489 CarbonylContact O-C 3.58Å; A483-E489 WeakPolarHBondContact O-CA 3.46Å; F484-E489 HydrophobicContact CB-CG 4.48Å; F484-E489 HydrophobicContact CD2-CG 3.72Å; F484-E489 HydrophobicContact CE2-CG 4.46Å
490	S	94	Very high	93.6	Very high	7 Å²	7	47.4 Å²	47.4	5%	0.049	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-72.3	160	172.4	77.6	0	0	0	0	112.6	P393 F395 A483	P393-S490 VanDerWaalsContact O-CA 3.22Å; P393-S490 WeakPolarHBondContact O-CA 3.18Å; P393-S490 WeakPolarHBondContact O-CB 3.38Å; F395-S490 VanDerWaalsContact CE2-OG 3.31Å; F395-S490 WeakPolarHBondContact CE2-OG 2.99Å; A483-S490 PolarHBondContact N-OG 2.92Å; A483-S490 PolarHBondContact O-N 3.39Å
491	E	93.7	Very high	93.4	Very high	167 Å²	167	46 Å²	46	78%	0.78	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-56.4	131.9	158.6	-72.9	-64.7	149.2	0	0	110.1
492	P	94.9	Very high	93.1	Very high	65 Å²	65	46.8 Å²	46.8	42%	0.422	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-69.8	138.9	-178.3	-20.6	32.5	0	0	0	113.2	L480	L480-P492 HydrophobicContact CB-CB 4.13Å; L480-P492 HydrophobicContact CD1-CB 4.07Å
493	V	96.1	Very high	93	Very high	14 Å²	14	46.7 Å²	46.7	9%	0.085	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.5	-179.5	167.2	0	0	0	0	112.1	F395 Y400 L480 I481	F395-V493 HydrophobicContact CB-CB 4.5Å; F395-V493 HydrophobicContact CB-CG2 3.82Å; F395-V493 HydrophobicContact CD2-CB 3.89Å; F395-V493 HydrophobicContact CD2-CG2 3.56Å; F395-V493 HydrophobicContact CE2-CB 4.37Å; F395-V493 HydrophobicContact CE2-CG2 4.42Å; F395-V493 HydrophobicContact CG-CB 4.2Å; F395-V493 HydrophobicContact CG-CG2 3.9Å; Y400-V493 HydrophobicContact CD2-CG1 3.77Å; Y400-V493 HydrophobicContact CE2-CG1 3.87Å; L480-V493 CarbonylContact C-O 3.55Å; L480-V493 VanDerWaalsContact CA-O 3.32Å; L480-V493 WeakPolarHBondContact CA-O 3.32Å; I481-V493 HydrophobicContact CG2-CB 4.28Å; I481-V493 PolarHBondContact N-O 2.98Å; I481-V493 PolarHBondContact O-N 3.27Å
494	V	96.7	Very high	92.8	Very high	54 Å²	54	49.9 Å²	49.9	33%	0.327	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.3	179.7	-175.9	0	0	0	0	111.4	S399 Y400 T478 L480	S399-V494 CarbonylContact C-O 3.6Å; S399-V494 VanDerWaalsContact CA-O 3.27Å; S399-V494 WeakPolarHBondContact CA-O 3.36Å; Y400-V494 PolarHBondContact N-O 3.1Å; T478-V494 HydrophobicContact CG2-CG1 4.06Å; L480-V494 HydrophobicContact CD2-CB 4.35Å; L480-V494 HydrophobicContact CD2-CG2 3.66Å
495	V	96.6	Very high	92.8	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.4	168.4	-173.3	0	0	0	0	108.7	Y400 L463 T478 F479 I481 I497	Y400-V495 HydrophobicContact CD2-CG2 4.38Å; Y400-V495 WeakPolarHBondContact O-CA 3.37Å; L463-V495 HydrophobicContact CD1-CG1 3.81Å; T478-V495 WeakPolarHBondContact CA-O 3.23Å; F479-V495 HydrophobicContact CD2-CB 3.97Å; F479-V495 HydrophobicContact CD2-CG2 4.25Å; F479-V495 HydrophobicContact CE1-CB 4.46Å; F479-V495 HydrophobicContact CE1-CG1 4.29Å; F479-V495 HydrophobicContact CE2-CB 3.65Å; F479-V495 HydrophobicContact CE2-CG1 3.9Å; F479-V495 HydrophobicContact CE2-CG2 3.88Å; F479-V495 HydrophobicContact CG-CB 4.5Å; F479-V495 HydrophobicContact CZ-CB 3.93Å; F479-V495 HydrophobicContact CZ-CG1 3.71Å; F479-V495 PolarHBondContact N-O 3.12Å; F479-V495 PolarHBondContact O-N 3.24Å; I481-V495 HydrophobicContact CB-CG2 4.04Å; I481-V495 HydrophobicContact CG2-CG2 3.64Å; V495-I497 HydrophobicContact CG1-CG1 4.22Å
496	N	96.4	Very high	92.9	Very high	48 Å²	48	50.6 Å²	50.6	26%	0.257	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	119	174.8	-67.5	-55.6	0	0	0	109.6	Y400 Q401 G402 Y477 T478	Y400-N496 PolarHBondContact O-N 3.01Å; Q401-N496 CarbonylContact C-O 3.59Å; Q401-N496 WeakPolarHBondContact CA-O 3.49Å; Q401-N496 PolarHBondContact NE2-O 2.72Å; Q401-N496 VanDerWaalsContact NE2-O 3.15Å; G402-N496 PolarHBondContact N-O 3.47Å; Y477-N496 CarbonylContact O-C 3.51Å; T478-N496 WeakPolarHBondContact CB-OD1 3.45Å; T478-N496 WeakPolarHBondContact CG2-OD1 3.33Å; T478-N496 PolarHBondContact OG1-OD1 2.68Å
497	I	95.9	Very high	93.4	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.6	174.6	-55	176.5	0	0	0	108.4	G402 I404 I414 F452 L463 T476 Y477 F479 V495	G402-I497 WeakPolarHBondContact O-CA 3.42Å; I404-I497 HydrophobicContact CG2-CG2 3.91Å; I414-I497 HydrophobicContact CD1-CD1 4.19Å; I414-I497 HydrophobicContact CD1-CG2 4.29Å; I414-I497 HydrophobicContact CG1-CD1 4.04Å; I414-I497 HydrophobicContact CG2-CD1 4.34Å; I414-I497 HydrophobicContact CG2-CG1 4.29Å; I414-I497 HydrophobicContact CG2-CG2 4.19Å; F452-I497 HydrophobicContact CD1-CD1 3.88Å; F452-I497 HydrophobicContact CD2-CD1 4.11Å; F452-I497 HydrophobicContact CE1-CD1 3.65Å; F452-I497 HydrophobicContact CE2-CD1 3.9Å; F452-I497 HydrophobicContact CG-CD1 4.12Å; F452-I497 HydrophobicContact CZ-CD1 3.66Å; F452-I497 HydrophobicContact CZ-CG2 4.44Å; L463-I497 HydrophobicContact CD1-CD1 4.34Å; T476-I497 CarbonylContact C-O 3.56Å; T476-I497 WeakPolarHBondContact CA-O 3.31Å; Y477-I497 PolarHBondContact N-O 2.79Å; Y477-I497 PolarHBondContact O-N 2.77Å; F479-I497 HydrophobicContact CE1-CD1 3.78Å; F479-I497 HydrophobicContact CE1-CG1 4.31Å; F479-I497 HydrophobicContact CZ-CD1 3.96Å; V495-I497 HydrophobicContact CG1-CG1 4.22Å
498	R	95.5	Very high	93.8	Very high	106 Å²	106	47.1 Å²	47.1	40%	0.4	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	128.7	170.3	178.8	173	178	178.5	0.2	109.7	G402 Y403 I404 E538	G402-R498 PolarHBondContact O-N 3.34Å; Y403-R498 WeakPolarHBondContact CA-O 3.48Å; Y403-R498 HydrophobicContact CD1-CB 4.08Å; Y403-R498 HydrophobicContact CE1-CB 4.29Å; I404-R498 PolarHBondContact N-O 2.76Å; I404-R498 VanDerWaalsContact N-O 3.16Å; R498-E538 IonicContact NH2-OE1 3.79Å; R498-E538 PolarHBondContact NH2-OE1 2.96Å; R498-E538 IonicContact NH2-OE2 2.74Å
499	V	95	Very high	94.1	Very high	1 Å²	1	46 Å²	46	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	135.8	168.2	-170.4	0	0	0	0	108.6	I404 E406 V469 R471 Q474 Q475 Y477	I404-V499 HydrophobicContact CG2-CG2 4.39Å; I404-V499 CarbonylContact O-C 3.56Å; I404-V499 WeakPolarHBondContact O-CA 3.05Å; E406-V499 HydrophobicContact CB-CG1 3.68Å; V469-V499 HydrophobicContact CB-CG2 4.37Å; V469-V499 HydrophobicContact CG2-CG1 4.28Å; V469-V499 HydrophobicContact CG2-CG2 4.27Å; R471-V499 HydrophobicContact CB-CB 4.3Å; R471-V499 HydrophobicContact CB-CG1 3.81Å; R471-V499 HydrophobicContact CG-CB 4.28Å; R471-V499 HydrophobicContact CG-CG1 4.23Å; Q474-V499 WeakPolarHBondContact O-CG2 3.46Å; Q475-V499 PolarHBondContact O-N 3.17Å; Y477-V499 HydrophobicContact CD2-CG2 3.99Å; Y477-V499 HydrophobicContact CE2-CG2 3.61Å
500	M	93.2	Very high	94.1	Very high	46 Å²	46	44.4 Å²	44.4	23%	0.227	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.3	176.8	-67.4	-178.7	56.5	0	0	109.7	I404 L405 E406 L418 L420	I404-M500 PolarHBondContact O-N 2.69Å; L405-M500 HydrophobicContact CD1-CB 3.95Å; E406-M500 PolarHBondContact N-O 2.86Å; L418-M500 WeakPolarHBondContact O-CE 3.33Å; L420-M500 HydrophobicContact CD1-SD 4.4Å; L420-M500 HydrophobicContact CD2-SD 3.9Å; L420-M500 HydrophobicContact CG-SD 4.2Å
501	D	92.6	Very high	93.9	Very high	29 Å²	29	49.3 Å²	49.3	16%	0.155	26%	0.263	C	S	.	.			trans	-63.3	138	-178.2	-167.5	86.7	0	0	0	114	L405 E406 R471 D537 E538 N541	L405-D501 VanDerWaalsContact CD1-O 3.31Å; L405-D501 WeakPolarHBondContact CD1-O 3.41Å; E406-D501 WeakPolarHBondContact OE1-CA 3.44Å; R471-D501 IonicContact CZ-OD1 3.61Å; R471-D501 IonicContact NE-OD1 2.98Å; R471-D501 PolarHBondContact NE-OD1 2.77Å; R471-D501 IonicContact NH2-OD1 2.94Å; D501-D537 WeakPolarHBondContact OD1-CA 3.38Å; D501-E538 HydrophobicContact CB-CB 3.76Å; D501-E538 VanDerWaalsContact CG-N 3.27Å; D501-E538 WeakPolarHBondContact OD1-CB 3.36Å; D501-E538 PolarHBondContact OD1-N 3.35Å; D501-E538 PolarHBondContact OD2-N 3.33Å; D501-N541 WeakPolarHBondContact OD2-CB 3.26Å; D501-N541 PolarHBondContact OD2-ND2 2.8Å
502	A	91	Very high	93.8	Very high	17 Å²	17	48.5 Å²	48.5	14%	0.14	26%	0.263	C	S	.	.			trans	-127.8	146.3	164.3	0	0	0	0	0	109.1	L405 E406 D504	L405-A502 HydrophobicContact CD1-CB 4.37Å; L405-A502 HydrophobicContact CG-CB 4.29Å; E406-A502 HydrophobicContact CG-CB 3.96Å; E406-A502 PolarHBondContact OE1-N 3.28Å; A502-D504 WeakPolarHBondContact O-CB 3.48Å; A502-D504 PolarHBondContact O-N 2.88Å
503	N	92.7	Very high	93.6	Very high	16 Å²	16	47.7 Å²	47.7	9%	0.086	26%	0.259	C	S	.	.	S	Bend	trans	-68.7	93.5	179.8	-158.3	60	0	0	0	109.7	D537 N541 D587 A589 E593 R595	N503-D537 VanDerWaalsContact CA-OD2 3.27Å; N503-D537 WeakPolarHBondContact CA-OD2 3.37Å; N503-D537 PolarHBondContact OD1-OD2 2.86Å; N503-N541 HydrophobicContact CB-CB 4.18Å; N503-N541 PolarHBondContact N-ND2 2.62Å; N503-N541 VanDerWaalsContact OD1-CA 3.26Å; N503-N541 WeakPolarHBondContact OD1-CA 3.18Å; N503-N541 WeakPolarHBondContact OD1-CB 3.46Å; N503-N541 PolarHBondContact OD1-O 2.89Å; N503-D587 PolarHBondContact ND2-OD2 2.97Å; N503-D587 PolarHBondContact OD1-OD2 3.12Å; N503-A589 HydrophobicContact CB-CB 4.29Å; N503-E593 PolarHBondContact ND2-O 2.95Å; N503-R595 PolarHBondContact O-NE 2.81Å; N503-R595 PolarHBondContact O-NH2 2.9Å
504	D	91.2	Very high	93.5	Very high	68 Å²	68	48.4 Å²	48.4	36%	0.364	26%	0.26	S	S	.	.			trans	-127.3	-35.1	-156.9	173.2	-74.8	0	0	0	111.6	A502 D537 R595	A502-D504 WeakPolarHBondContact O-CB 3.48Å; A502-D504 PolarHBondContact O-N 2.88Å; D504-D537 PolarHBondContact N-OD2 2.8Å; D504-R595 VanDerWaalsContact C-NH1 3.33Å; D504-R595 VanDerWaalsContact CA-NH2 3.34Å; D504-R595 VanDerWaalsContact O-CZ 3.26Å; D504-R595 PolarHBondContact O-NH1 2.91Å; D504-R595 PolarHBondContact O-NH2 3.3Å
505	N	92.3	Very high	93.3	Very high	55 Å²	55	51.6 Å²	51.6	29%	0.294	28%	0.275	S	S	.	.	S	Bend	trans	-83.2	-163.9	169.2	-68.8	-88.4	0	0	0	110.7	E472 D535 A536 D537 R595	E472-N505 PolarHBondContact OE2-ND2 2.83Å; N505-D535 VanDerWaalsContact CB-OD1 3.25Å; N505-D535 WeakPolarHBondContact CB-OD1 3.14Å; N505-A536 HydrophobicContact CB-CB 4.26Å; N505-D537 WeakPolarHBondContact CB-OD1 3.42Å; N505-D537 PolarHBondContact N-OD1 2.79Å; N505-D537 PolarHBondContact N-OD2 3.12Å; N505-D537 PolarHBondContact ND2-OD1 2.85Å; N505-R595 WeakPolarHBondContact O-CD 3.39Å; N505-R595 PolarHBondContact O-NE 3.46Å; N505-R595 PolarHBondContact O-NH1 3.5Å
506	T	93.2	Very high	93	Very high	47 Å²	47	52.5 Å²	52.5	29%	0.288	28%	0.281	S	S	.	.			trans	-156.1	137.5	179.8	-66.5	0	0	0	0	108.8	T508 D535 R595	T506-T508 PolarHBondContact O-N 3.44Å; T506-T508 PolarHBondContact O-OG1 3.36Å; T506-D535 VanDerWaalsContact C-OD2 3.27Å; T506-R595 HydrophobicContact CG2-CB 4.23Å
507	P	95.4	Very high	92.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.293	C	S	.	.			trans	-60.7	112.8	-176.6	-21.4	29.7	0	0	0	109.7	A533 D535 I544 A585 D587 S597	P507-A533 HydrophobicContact CB-CB 4.5Å; P507-D535 WeakPolarHBondContact CA-OD2 3.39Å; P507-D535 WeakPolarHBondContact CD-OD2 3.44Å; P507-D535 WeakPolarHBondContact CG-OD2 3.09Å; P507-I544 HydrophobicContact CB-CD1 4.13Å; P507-I544 HydrophobicContact CB-CG1 4.09Å; P507-I544 HydrophobicContact CB-CG2 4.3Å; P507-I544 HydrophobicContact CG-CG1 4.5Å; P507-A585 HydrophobicContact CB-CB 3.92Å; P507-D587 HydrophobicContact CG-CB 4.19Å; P507-S597 WeakPolarHBondContact O-CB 3.37Å; P507-S597 PolarHBondContact O-OG 3.33Å
508	T	93.8	Very high	92.3	Very high	80 Å²	80	56.4 Å²	56.4	49%	0.491	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-116.1	123.8	-168.3	-66.9	0	0	0	0	111.2	T506 A533 V534	T506-T508 PolarHBondContact O-N 3.44Å; T506-T508 PolarHBondContact O-OG1 3.36Å; T508-A533 CarbonylContact O-C 3.52Å; T508-A533 VanDerWaalsContact O-CA 3.24Å; T508-A533 WeakPolarHBondContact O-CA 2.81Å; T508-V534 PolarHBondContact N-O 3.24Å; T508-V534 PolarHBondContact O-N 3.33Å
509	F	94.2	Very high	92	Very high	17 Å²	17	54.8 Å²	54.8	8%	0.075	29%	0.287	C	S	.	.			trans	-76.2	137.3	170.7	-66.4	-77.9	0	0	0	110.9	E511 L531 A533 Y546 V583 A585 S597 C599	F509-E511 VanDerWaalsContact C-N 3.29Å; F509-E511 WeakPolarHBondContact CB-O 3.18Å; F509-E511 PolarHBondContact O-N 3.17Å; F509-L531 HydrophobicContact CE1-CB 4.2Å; F509-A533 HydrophobicContact CD1-CB 3.93Å; F509-A533 HydrophobicContact CE1-CB 4.05Å; F509-A533 HydrophobicContact CG-CB 4.26Å; F509-A533 HydrophobicContact CZ-CB 4.48Å; F509-Y546 HydrophobicContact CE1-CD1 4.17Å; F509-Y546 AromaticContact CE1-CE1 3.9Å; F509-Y546 HydrophobicContact CE1-CE1 3.9Å; F509-Y546 HydrophobicContact CZ-CD1 4.23Å; F509-Y546 HydrophobicContact CZ-CE1 4.3Å; F509-V583 HydrophobicContact CZ-CG1 4.38Å; F509-A585 HydrophobicContact CD2-CB 4.45Å; F509-A585 HydrophobicContact CE1-CB 4.14Å; F509-A585 HydrophobicContact CE2-CB 3.6Å; F509-A585 HydrophobicContact CZ-CB 3.41Å; F509-A585 VanDerWaalsContact CZ-CB 3.41Å; F509-S597 WeakPolarHBondContact CD2-OG 3.41Å; F509-C599 HydrophobicContact CB-CB 4.16Å; F509-C599 HydrophobicContact CD1-CB 4.33Å; F509-C599 HydrophobicContact CD2-CB 3.65Å; F509-C599 HydrophobicContact CE2-CB 4.05Å; F509-C599 HydrophobicContact CG-CB 3.8Å
510	P	91.1	Very high	91.5	Very high	93 Å²	93	56.8 Å²	56.8	60%	0.604	30%	0.299	S	S	*	.	S	Bend	trans	-59.2	-34.9	175	-27.4	35.1	0	0	0	114.3	T532	P510-T532 WeakPolarHBondContact CD-O 3.17Å
511	E	91.4	Very high	91.1	Very high	111 Å²	111	58.9 Å²	58.9	52%	0.519	31%	0.312	S	S	.	.			trans	-121.5	141.8	175.4	-53.9	-176	173.5	0	0	111.1	F509 S513 Y514	F509-E511 VanDerWaalsContact C-N 3.29Å; F509-E511 WeakPolarHBondContact CB-O 3.18Å; F509-E511 PolarHBondContact O-N 3.17Å; E511-S513 VanDerWaalsContact C-N 3.3Å; E511-Y514 HydrophobicContact CB-CD1 4.25Å; E511-Y514 HydrophobicContact CB-CE1 3.71Å; E511-Y514 HydrophobicContact CB-CE2 4.26Å; E511-Y514 HydrophobicContact CG-CE1 4.02Å; E511-Y514 PolarHBondContact N-OH 2.68Å; E511-Y514 WeakPolarHBondContact O-CE2 3.18Å; E511-Y514 PolarHBondContact O-OH 3.44Å
512	I	90	Very high	90.8	Very high	149 Å²	149	59.6 Å²	59.6	76%	0.764	31%	0.314	S	S	*	.	S	Bend	trans	-70.6	-30.6	178.9	-58.6	169.2	0	0	0	110.8	C599 T600	I512-C599 WeakPolarHBondContact O-CA 3.48Å; I512-C599 WeakPolarHBondContact O-CB 3.16Å; I512-T600 PolarHBondContact O-N 3.22Å
513	S	92.6	Very high	90.5	Very high	49 Å²	49	61.9 Å²	61.9	34%	0.343	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.1	178.8	57.1	0	0	0	0	111.9	E511 T600	E511-S513 VanDerWaalsContact C-N 3.3Å; S513-T600 CarbonylContact C-O 3.56Å; S513-T600 WeakPolarHBondContact CA-O 3.47Å; S513-T600 WeakPolarHBondContact CB-O 3.48Å
514	Y	92.6	Very high	90.2	Very high	29 Å²	29	64.3 Å²	64.3	11%	0.114	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.2	178.9	-57.8	-91.4	0	0	0	109.8	E511 I529 L531 C599 T600 V601 Y602	E511-Y514 HydrophobicContact CB-CD1 4.25Å; E511-Y514 HydrophobicContact CB-CE1 3.71Å; E511-Y514 HydrophobicContact CB-CE2 4.26Å; E511-Y514 HydrophobicContact CG-CE1 4.02Å; E511-Y514 PolarHBondContact N-OH 2.68Å; E511-Y514 WeakPolarHBondContact O-CE2 3.18Å; E511-Y514 PolarHBondContact O-OH 3.44Å; Y514-I529 HydrophobicContact CD1-CD1 3.89Å; Y514-I529 HydrophobicContact CG-CD1 3.82Å; Y514-L531 HydrophobicContact CD2-CD2 3.58Å; Y514-L531 HydrophobicContact CE2-CD2 3.6Å; Y514-L531 HydrophobicContact CG-CD2 4.1Å; Y514-C599 HydrophobicContact CD2-CB 4.44Å; Y514-C599 HydrophobicContact CE2-CB 4.02Å; Y514-T600 PolarHBondContact N-O 3.28Å; Y514-V601 HydrophobicContact CD2-CG2 4.41Å; Y514-V601 CarbonylContact O-C 3.55Å; Y514-V601 WeakPolarHBondContact O-CA 3.38Å; Y514-Y602 PolarHBondContact O-N 3.31Å
515	D	92.3	Very high	90	Very high	121 Å²	121	63.3 Å²	63.3	65%	0.647	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	124.7	173.7	-68.1	-64.9	0	0	0	110.5	Y602	D515-Y602 WeakPolarHBondContact OD1-CB 3.42Å
516	V	90.8	Very high	89.8	Confident	19 Å²	19	63.8 Å²	63.8	12%	0.115	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.4	-173.7	-169.7	0	0	0	0	111.1	V528 I529 V601 Y602 I603 E604	V516-V528 HydrophobicContact CB-CG1 4.49Å; V516-V528 HydrophobicContact CG1-CG1 3.72Å; V516-V528 WeakPolarHBondContact CG1-O 3.46Å; V516-I529 HydrophobicContact CG2-CB 4.03Å; V516-I529 HydrophobicContact CG2-CD1 3.72Å; V516-I529 HydrophobicContact CG2-CG1 4.43Å; V516-I529 HydrophobicContact CG2-CG2 4.28Å; V516-V601 HydrophobicContact CB-CG1 4.43Å; V516-V601 HydrophobicContact CG2-CG1 3.67Å; V516-Y602 PolarHBondContact N-O 3.21Å; V516-I603 HydrophobicContact CB-CG1 4.45Å; V516-I603 WeakPolarHBondContact O-CA 3.32Å; V516-E604 PolarHBondContact O-N 2.87Å
517	Y	89	Confident	89.6	Confident	131 Å²	131	65.2 Å²	65.2	51%	0.514	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.4	174.5	-58.6	-71.4	0	0	0	109.9	E604 L606	Y517-E604 HydrophobicContact CD1-CB 4.03Å; Y517-E604 HydrophobicContact CE1-CB 4.23Å; Y517-E604 WeakPolarHBondContact CE1-OE2 2.94Å; Y517-L606 HydrophobicContact CD1-CD1 3.76Å; Y517-L606 HydrophobicContact CD1-CG 4.17Å; Y517-L606 HydrophobicContact CG-CD1 3.99Å
518	V	89.4	Confident	89.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	151.2	172.4	-62.9	0	0	0	0	109.5	M522 V528 L573 I603 E604 V605 L606	V518-M522 HydrophobicContact CB-SD 3.76Å; V518-M522 HydrophobicContact CG1-CE 4.48Å; V518-M522 HydrophobicContact CG1-SD 4.12Å; V518-V528 HydrophobicContact CG1-CB 4.3Å; V518-V528 HydrophobicContact CG1-CG1 3.66Å; V518-V528 HydrophobicContact CG1-CG2 3.89Å; V518-L573 HydrophobicContact CB-CD1 4.04Å; V518-L573 HydrophobicContact CG2-CD1 3.76Å; V518-I603 HydrophobicContact CB-CG2 4.23Å; V518-I603 HydrophobicContact CG1-CG2 3.76Å; V518-I603 HydrophobicContact CG2-CG2 3.48Å; V518-I603 VanDerWaalsContact CG2-CG2 3.48Å; V518-E604 PolarHBondContact N-O 2.9Å; V518-V605 HydrophobicContact CG2-CB 4.27Å; V518-V605 HydrophobicContact CG2-CG1 4.5Å; V518-V605 HydrophobicContact CG2-CG2 3.77Å; V518-V605 CarbonylContact O-C 3.6Å; V518-V605 WeakPolarHBondContact O-CA 3.23Å; V518-L606 PolarHBondContact O-N 2.81Å
519	Y	87.8	Confident	89.3	Confident	72 Å²	72	63.9 Å²	63.9	28%	0.282	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146	-175.4	-54.5	-84.2	0	0	0	110.7	D521 M522 L606 P607 N609	Y519-D521 WeakPolarHBondContact CB-OD1 3.32Å; Y519-D521 PolarHBondContact O-N 3.07Å; Y519-D521 VanDerWaalsContact O-N 3.11Å; Y519-M522 HydrophobicContact CD2-SD 4.39Å; Y519-M522 PolarHBondContact N-SD 3.16Å; Y519-M522 VanDerWaalsContact O-CB 3.3Å; Y519-M522 WeakPolarHBondContact O-CB 3.25Å; Y519-M522 WeakPolarHBondContact O-CG 3.28Å; Y519-M522 PolarHBondContact O-N 2.93Å; Y519-L606 WeakPolarHBondContact CA-O 3.41Å; Y519-L606 HydrophobicContact CD1-CB 3.76Å; Y519-L606 HydrophobicContact CD1-CD1 4.47Å; Y519-L606 HydrophobicContact CE1-CB 3.95Å; Y519-L606 HydrophobicContact CE1-CD1 3.83Å; Y519-L606 HydrophobicContact CE1-CG 4.5Å; Y519-P607 WeakPolarHBondContact CD1-O 3.33Å; Y519-N609 HydrophobicContact CD1-CB 3.95Å; Y519-N609 HydrophobicContact CD2-CB 4.48Å; Y519-N609 HydrophobicContact CE1-CB 3.98Å; Y519-N609 HydrophobicContact CG-CB 4.21Å
520	T	85.2	Confident	89.3	Confident	43 Å²	43	67.5 Å²	67.5	26%	0.264	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-2.2	-177.7	59.4	0	0	0	0	115.1	L573 V575 V605 L606 P608	T520-L573 HydrophobicContact CG2-CB 4.28Å; T520-L573 VanDerWaalsContact CG2-O 3.23Å; T520-L573 WeakPolarHBondContact CG2-O 3.32Å; T520-V575 HydrophobicContact CG2-CB 4.44Å; T520-V575 HydrophobicContact CG2-CG2 3.5Å; T520-V605 HydrophobicContact CG2-CG1 3.49Å; T520-V605 VanDerWaalsContact CG2-CG1 3.49Å; T520-L606 PolarHBondContact N-O 3.23Å; T520-L606 VanDerWaalsContact N-O 3.12Å; T520-P608 VanDerWaalsContact OG1-CD 3.31Å; T520-P608 WeakPolarHBondContact OG1-CD 3.49Å
521	D	84.7	Confident	89.4	Confident	91 Å²	91	63.1 Å²	63.1	49%	0.487	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-1.2	169	57.7	-27.9	0	0	0	113.7	Y519 P608	Y519-D521 WeakPolarHBondContact CB-OD1 3.32Å; Y519-D521 PolarHBondContact O-N 3.07Å; Y519-D521 VanDerWaalsContact O-N 3.11Å; D521-P608 HydrophobicContact CB-CB 3.98Å; D521-P608 HydrophobicContact CB-CG 4.29Å; D521-P608 WeakPolarHBondContact OD1-CA 3.42Å
522	M	85.9	Confident	89.5	Confident	43 Å²	43	61.5 Å²	61.5	21%	0.212	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-69.2	138.8	169.2	-64.3	177.1	69.3	0	0	110.9	V518 Y519 D526 S527 I567	V518-M522 HydrophobicContact CB-SD 3.76Å; V518-M522 HydrophobicContact CG1-CE 4.48Å; V518-M522 HydrophobicContact CG1-SD 4.12Å; Y519-M522 HydrophobicContact CD2-SD 4.39Å; Y519-M522 PolarHBondContact N-SD 3.16Å; Y519-M522 VanDerWaalsContact O-CB 3.3Å; Y519-M522 WeakPolarHBondContact O-CB 3.25Å; Y519-M522 WeakPolarHBondContact O-CG 3.28Å; Y519-M522 PolarHBondContact O-N 2.93Å; M522-D526 WeakPolarHBondContact CA-OD2 3.32Å; M522-D526 HydrophobicContact CB-CB 4.21Å; M522-D526 HydrophobicContact CE-CB 3.81Å; M522-S527 WeakPolarHBondContact CE-O 3.44Å; M522-I567 HydrophobicContact CB-CD1 3.43Å; M522-I567 VanDerWaalsContact CB-CD1 3.43Å; M522-I567 HydrophobicContact CE-CD1 4.06Å; M522-I567 HydrophobicContact CG-CD1 4.47Å; M522-I567 HydrophobicContact SD-CD1 4.38Å
523	S	84.9	Confident	89.6	Confident	65 Å²	65	54.9 Å²	54.9	46%	0.455	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-89.7	155	-179.6	-64.9	0	0	0	0	112.2	G525 D526	S523-G525 PolarHBondContact O-N 3.15Å; S523-D526 PolarHBondContact N-OD2 2.71Å; S523-D526 VanDerWaalsContact O-CB 3.23Å; S523-D526 WeakPolarHBondContact O-CB 3.23Å; S523-D526 PolarHBondContact O-N 2.96Å
524	P	86.6	Confident	89.6	Confident	68 Å²	68	57.1 Å²	57.1	44%	0.442	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	129.1	167.4	-26.7	35.8	0	0	0	111.7
525	G	85.9	Confident	89.7	Confident	47 Å²	47	56.9 Å²	56.9	49%	0.485	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-11.5	-171.1	0	0	0	0	0	115.2	S523 I567	S523-G525 PolarHBondContact O-N 3.15Å; G525-I567 PolarHBondContact N-O 3.33Å
526	D	88.7	Confident	89.7	Confident	65 Å²	65	53.4 Å²	53.4	35%	0.348	31%	0.31	S	S	.	.			trans	-65.1	142.6	174.3	-74.9	-7.1	0	0	0	111.2	M522 S523 S566 I567	M522-D526 WeakPolarHBondContact CA-OD2 3.32Å; M522-D526 HydrophobicContact CB-CB 4.21Å; M522-D526 HydrophobicContact CE-CB 3.81Å; S523-D526 PolarHBondContact N-OD2 2.71Å; S523-D526 VanDerWaalsContact O-CB 3.23Å; S523-D526 WeakPolarHBondContact O-CB 3.23Å; S523-D526 PolarHBondContact O-N 2.96Å; D526-S566 WeakPolarHBondContact O-CA 3.3Å; D526-S566 VanDerWaalsContact O-CB 3.25Å; D526-S566 WeakPolarHBondContact O-CB 3.31Å; D526-I567 HydrophobicContact CB-CD1 4.41Å; D526-I567 PolarHBondContact O-N 3.48Å; D526-I567 VanDerWaalsContact O-N 3.07Å
527	S	89.7	Confident	89.9	Confident	76 Å²	76	53 Å²	53	53%	0.531	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	132.4	-177.5	-62.4	0	0	0	0	111.6	M522	M522-S527 WeakPolarHBondContact CE-O 3.44Å
528	V	91	Very high	90	Very high	21 Å²	21	50.6 Å²	50.6	13%	0.127	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-57.5	179.4	176.3	0	0	0	0	110.3	V516 V518 F556 V565 I567 I603	V516-V528 HydrophobicContact CB-CG1 4.49Å; V516-V528 HydrophobicContact CG1-CG1 3.72Å; V516-V528 WeakPolarHBondContact CG1-O 3.46Å; V518-V528 HydrophobicContact CG1-CB 4.3Å; V518-V528 HydrophobicContact CG1-CG1 3.66Å; V518-V528 HydrophobicContact CG1-CG2 3.89Å; V528-F556 HydrophobicContact CG2-CD1 3.97Å; V528-F556 HydrophobicContact CG2-CE1 3.86Å; V528-V565 HydrophobicContact CB-CB 4.42Å; V528-V565 HydrophobicContact CB-CG1 4.19Å; V528-V565 WeakPolarHBondContact CB-O 3.24Å; V528-V565 PolarHBondContact N-O 2.81Å; V528-I567 HydrophobicContact CG2-CG1 4Å; V528-I603 HydrophobicContact CG1-CD1 3.98Å; V528-I603 HydrophobicContact CG1-CG1 4.44Å
529	I	92.3	Very high	90.1	Very high	31 Å²	31	53.4 Å²	53.4	16%	0.159	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	143.1	176.2	-176.7	164.6	0	0	0	110	Y514 V516 L531 V565 V601	Y514-I529 HydrophobicContact CD1-CD1 3.89Å; Y514-I529 HydrophobicContact CG-CD1 3.82Å; V516-I529 HydrophobicContact CG2-CB 4.03Å; V516-I529 HydrophobicContact CG2-CD1 3.72Å; V516-I529 HydrophobicContact CG2-CG1 4.43Å; V516-I529 HydrophobicContact CG2-CG2 4.28Å; I529-L531 HydrophobicContact CD1-CD2 3.99Å; I529-L531 HydrophobicContact CG1-CD2 4.22Å; I529-L531 HydrophobicContact CG2-CD2 4.41Å; I529-L531 HydrophobicContact CG2-CG 4.3Å; I529-V565 HydrophobicContact CG2-CB 3.88Å; I529-V565 HydrophobicContact CG2-CG2 3.93Å; I529-V565 PolarHBondContact N-O 3.06Å; I529-V565 PolarHBondContact O-N 3.47Å; I529-V601 HydrophobicContact CG2-CG1 4.01Å; I529-V601 HydrophobicContact CG2-CG2 4.49Å
530	Q	93	Very high	90.2	Very high	94 Å²	94	52.8 Å²	52.8	44%	0.439	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	109.1	167.2	-171	70.3	58.3	0	0	108.1	T562 L564	Q530-T562 VanDerWaalsContact NE2-C 3.29Å; Q530-T562 PolarHBondContact NE2-O 3.44Å; Q530-L564 VanDerWaalsContact NE2-N 3.12Å
531	L	93.5	Very high	90.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	33%	0.329	C	S	.	.			trans	-86.7	138.7	172.1	-64.4	173.4	0	0	0	109.8	F509 Y514 I529 I558 G563 V565 V583 V601	F509-L531 HydrophobicContact CE1-CB 4.2Å; Y514-L531 HydrophobicContact CD2-CD2 3.58Å; Y514-L531 HydrophobicContact CE2-CD2 3.6Å; Y514-L531 HydrophobicContact CG-CD2 4.1Å; I529-L531 HydrophobicContact CD1-CD2 3.99Å; I529-L531 HydrophobicContact CG1-CD2 4.22Å; I529-L531 HydrophobicContact CG2-CD2 4.41Å; I529-L531 HydrophobicContact CG2-CG 4.3Å; L531-I558 HydrophobicContact CD1-CD1 4.16Å; L531-G563 PolarHBondContact N-O 2.91Å; L531-V565 HydrophobicContact CD1-CG2 4Å; L531-V565 HydrophobicContact CG-CG2 4.42Å; L531-V583 HydrophobicContact CD1-CB 3.85Å; L531-V583 HydrophobicContact CD1-CG1 3.68Å; L531-V583 HydrophobicContact CD1-CG2 3.76Å; L531-V601 HydrophobicContact CD1-CG2 3.9Å; L531-V601 HydrophobicContact CD2-CG2 4.01Å; L531-V601 HydrophobicContact CG-CG2 4.46Å
532	T	93.1	Very high	90.9	Very high	76 Å²	76	48.2 Å²	48.2	47%	0.466	31%	0.314	S	S	.	.			trans	-133.4	115.1	174.9	53.7	0	0	0	0	108.6	P510	P510-T532 WeakPolarHBondContact CD-O 3.17Å
533	A	93	Very high	91.2	Very high	10 Å²	10	51.4 Å²	51.4	8%	0.083	33%	0.329	C	S	.	.			trans	-93.6	162	160.4	0	0	0	0	0	109.6	P507 T508 F509 I544 Y546 A585	P507-A533 HydrophobicContact CB-CB 4.5Å; T508-A533 CarbonylContact O-C 3.52Å; T508-A533 VanDerWaalsContact O-CA 3.24Å; T508-A533 WeakPolarHBondContact O-CA 2.81Å; F509-A533 HydrophobicContact CD1-CB 3.93Å; F509-A533 HydrophobicContact CE1-CB 4.05Å; F509-A533 HydrophobicContact CG-CB 4.26Å; F509-A533 HydrophobicContact CZ-CB 4.48Å; A533-I544 VanDerWaalsContact C-CD1 3.41Å; A533-I544 HydrophobicContact CB-CD1 3.81Å; A533-I544 HydrophobicContact CB-CG2 4.36Å; A533-I544 VanDerWaalsContact O-CD1 3.28Å; A533-I544 WeakPolarHBondContact O-CD1 3.24Å; A533-Y546 HydrophobicContact CB-CE1 4.07Å; A533-Y546 PolarHBondContact N-OH 2.67Å; A533-A585 HydrophobicContact CB-CB 3.61Å
534	V	93.1	Very high	91.7	Very high	97 Å²	97	49.5 Å²	49.5	59%	0.588	31%	0.313	S	S	*	.	B	Isolated β-bridge	trans	-124.2	138.2	174.6	-177.8	0	0	0	0	108.3	T508	T508-V534 PolarHBondContact N-O 3.24Å; T508-V534 PolarHBondContact O-N 3.33Å
535	D	94.1	Very high	92.1	Very high	24 Å²	24	47 Å²	47	13%	0.128	30%	0.297	C	S	.	.			trans	-133.7	148.3	169.8	-151.4	-28	0	0	0	107.4	N505 T506 P507 I544	N505-D535 VanDerWaalsContact CB-OD1 3.25Å; N505-D535 WeakPolarHBondContact CB-OD1 3.14Å; T506-D535 VanDerWaalsContact C-OD2 3.27Å; P507-D535 WeakPolarHBondContact CA-OD2 3.39Å; P507-D535 WeakPolarHBondContact CD-OD2 3.44Å; P507-D535 WeakPolarHBondContact CG-OD2 3.09Å; D535-I544 HydrophobicContact CB-CD1 4.02Å; D535-I544 HydrophobicContact CB-CG1 4.05Å
536	A	92.9	Very high	92.6	Very high	47 Å²	47	45.7 Å²	45.7	39%	0.388	28%	0.278	S	S	.	.			trans	-102.8	-22.7	-169.7	0	0	0	0	0	113.2	R471 E472 N505	R471-A536 PolarHBondContact NH2-O 2.72Å; E472-A536 HydrophobicContact CG-CB 3.54Å; N505-A536 HydrophobicContact CB-CB 4.26Å
537	D	93.8	Very high	92.9	Very high	10 Å²	10	48 Å²	48	5%	0.053	29%	0.287	C	S	.	.	S	Bend	trans	-61.7	161.6	-177.1	-58.2	-7.6	0	0	0	113	D501 N503 D504 N505 N541 G542	D501-D537 WeakPolarHBondContact OD1-CA 3.38Å; N503-D537 VanDerWaalsContact CA-OD2 3.27Å; N503-D537 WeakPolarHBondContact CA-OD2 3.37Å; N503-D537 PolarHBondContact OD1-OD2 2.86Å; D504-D537 PolarHBondContact N-OD2 2.8Å; N505-D537 WeakPolarHBondContact CB-OD1 3.42Å; N505-D537 PolarHBondContact N-OD1 2.79Å; N505-D537 PolarHBondContact N-OD2 3.12Å; N505-D537 PolarHBondContact ND2-OD1 2.85Å; D537-N541 HydrophobicContact CB-CB 3.5Å; D537-G542 VanDerWaalsContact O-CA 3.25Å; D537-G542 WeakPolarHBondContact O-CA 3.15Å; D537-G542 PolarHBondContact O-N 3.26Å
538	E	91.3	Very high	93.1	Very high	82 Å²	82	46 Å²	46	38%	0.383	27%	0.27	S	S	.	.	S	Bend	trans	-84.8	140.2	-175.6	-155	174.6	161.4	0	0	112.9	R471 R498 D501 S540 N541	R471-E538 IonicContact NH1-OE2 3.8Å; R471-E538 PolarHBondContact NH1-OE2 2.68Å; R498-E538 IonicContact NH2-OE1 3.79Å; R498-E538 PolarHBondContact NH2-OE1 2.96Å; R498-E538 IonicContact NH2-OE2 2.74Å; D501-E538 HydrophobicContact CB-CB 3.76Å; D501-E538 VanDerWaalsContact CG-N 3.27Å; D501-E538 WeakPolarHBondContact OD1-CB 3.36Å; D501-E538 PolarHBondContact OD1-N 3.35Å; D501-E538 PolarHBondContact OD2-N 3.33Å; E538-S540 PolarHBondContact O-N 3.39Å; E538-N541 PolarHBondContact O-N 2.91Å
539	G	90.9	Very high	93.2	Very high	59 Å²	59	48.5 Å²	48.5	61%	0.608	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	-123.9	168.6	0	0	0	0	0	113.2	N541 G542 E543	G539-N541 PolarHBondContact O-N 3.42Å; G539-G542 PolarHBondContact O-N 2.86Å; G539-E543 WeakPolarHBondContact O-CB 3.44Å; G539-E543 PolarHBondContact O-N 2.83Å
540	S	91.4	Very high	93.1	Very high	58 Å²	58	51.7 Å²	51.7	41%	0.406	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22	-178.1	51.3	0	0	0	0	114	E538 N588 A589	E538-S540 PolarHBondContact O-N 3.39Å; S540-N588 CarbonylContact O-C 3.58Å; S540-N588 VanDerWaalsContact O-C 3.23Å; S540-N588 WeakPolarHBondContact O-CA 3.33Å; S540-N588 WeakPolarHBondContact O-CB 3.11Å; S540-N588 PolarHBondContact O-N 3.34Å; S540-A589 PolarHBondContact O-N 3.44Å
541	N	91.9	Very high	92.8	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.107	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-41	179.7	-65.3	-3.6	0	0	0	109.5	D501 N503 D537 E538 G539 D587 A589	D501-N541 WeakPolarHBondContact OD2-CB 3.26Å; D501-N541 PolarHBondContact OD2-ND2 2.8Å; N503-N541 HydrophobicContact CB-CB 4.18Å; N503-N541 PolarHBondContact N-ND2 2.62Å; N503-N541 VanDerWaalsContact OD1-CA 3.26Å; N503-N541 WeakPolarHBondContact OD1-CA 3.18Å; N503-N541 WeakPolarHBondContact OD1-CB 3.46Å; N503-N541 PolarHBondContact OD1-O 2.89Å; D537-N541 HydrophobicContact CB-CB 3.5Å; E538-N541 PolarHBondContact O-N 2.91Å; G539-N541 PolarHBondContact O-N 3.42Å; N541-D587 WeakPolarHBondContact O-CB 3.34Å; N541-A589 WeakPolarHBondContact OD1-CB 2.97Å
542	G	91.6	Very high	92.1	Very high	18 Å²	18	48.7 Å²	48.7	19%	0.186	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.5	170.8	0	0	0	0	0	116.3	D537 G539 I544	D537-G542 VanDerWaalsContact O-CA 3.25Å; D537-G542 WeakPolarHBondContact O-CA 3.15Å; D537-G542 PolarHBondContact O-N 3.26Å; G539-G542 PolarHBondContact O-N 2.86Å; G542-I544 PolarHBondContact O-N 2.93Å
543	E	93.4	Very high	91.5	Very high	111 Å²	111	51.4 Å²	51.4	52%	0.519	30%	0.303	S	S	.	.			trans	-81.8	101.4	-175.3	-167.9	-172.2	-158.3	0	0	111.9	G539 D587 N588	G539-E543 WeakPolarHBondContact O-CB 3.44Å; G539-E543 PolarHBondContact O-N 2.83Å; E543-D587 CarbonylContact O-C 3.52Å; E543-N588 HydrophobicContact CB-CB 4.31Å; E543-N588 WeakPolarHBondContact CG-ND2 3.14Å; E543-N588 VanDerWaalsContact O-CG 3.26Å; E543-N588 PolarHBondContact O-N 2.82Å; E543-N588 PolarHBondContact O-ND2 3.41Å; E543-N588 PolarHBondContact OE2-ND2 3.34Å
544	I	94.5	Very high	91.1	Very high	25 Å²	25	53.5 Å²	53.5	13%	0.128	33%	0.325	C	S	.	.			trans	-78.7	140.3	-174.3	-53.8	175.8	0	0	0	112.5	P507 A533 D535 G542 Y546 A585 S586	P507-I544 HydrophobicContact CB-CD1 4.13Å; P507-I544 HydrophobicContact CB-CG1 4.09Å; P507-I544 HydrophobicContact CB-CG2 4.3Å; P507-I544 HydrophobicContact CG-CG1 4.5Å; A533-I544 VanDerWaalsContact C-CD1 3.41Å; A533-I544 HydrophobicContact CB-CD1 3.81Å; A533-I544 HydrophobicContact CB-CG2 4.36Å; A533-I544 VanDerWaalsContact O-CD1 3.28Å; A533-I544 WeakPolarHBondContact O-CD1 3.24Å; D535-I544 HydrophobicContact CB-CD1 4.02Å; D535-I544 HydrophobicContact CB-CG1 4.05Å; G542-I544 PolarHBondContact O-N 2.93Å; I544-Y546 HydrophobicContact CG2-CD1 4.46Å; I544-Y546 HydrophobicContact CG2-CD2 4.5Å; I544-Y546 HydrophobicContact CG2-CE1 3.97Å; I544-Y546 HydrophobicContact CG2-CE2 4.01Å; I544-A585 HydrophobicContact CG2-CB 3.77Å; I544-S586 CarbonylContact C-O 3.53Å
545	S	95	Very high	91	Very high	15 Å²	15	50.4 Å²	50.4	11%	0.105	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.8	167.5	72.4	0	0	0	0	113.2	K560 A585 S586	S545-K560 CarbonylContact C-O 3.57Å; S545-K560 WeakPolarHBondContact CA-O 3.19Å; S545-K560 WeakPolarHBondContact OG-CE 3.48Å; S545-A585 WeakPolarHBondContact O-CA 3.38Å; S545-S586 PolarHBondContact N-O 2.71Å; S545-S586 PolarHBondContact O-N 2.7Å; S545-S586 PolarHBondContact OG-O 2.86Å
546	Y	95.7	Very high	91	Very high	19 Å²	19	49.7 Å²	49.7	8%	0.075	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.1	-172.1	-56.2	-88.1	0	0	0	113.4	F509 A533 I544 I558 K560 Q584 A585	F509-Y546 HydrophobicContact CE1-CD1 4.17Å; F509-Y546 AromaticContact CE1-CE1 3.9Å; F509-Y546 HydrophobicContact CE1-CE1 3.9Å; F509-Y546 HydrophobicContact CZ-CD1 4.23Å; F509-Y546 HydrophobicContact CZ-CE1 4.3Å; A533-Y546 HydrophobicContact CB-CE1 4.07Å; A533-Y546 PolarHBondContact N-OH 2.67Å; I544-Y546 HydrophobicContact CG2-CD1 4.46Å; I544-Y546 HydrophobicContact CG2-CD2 4.5Å; I544-Y546 HydrophobicContact CG2-CE1 3.97Å; I544-Y546 HydrophobicContact CG2-CE2 4.01Å; Y546-I558 HydrophobicContact CG-CD1 4.4Å; Y546-K560 WeakPolarHBondContact CD2-O 3.26Å; Y546-K560 PolarHBondContact N-O 2.88Å; Y546-Q584 WeakPolarHBondContact CA-O 3.32Å; Y546-A585 HydrophobicContact CD1-CB 4.08Å; Y546-A585 HydrophobicContact CE1-CB 4.03Å
547	E	94.8	Very high	91	Very high	115 Å²	115	50.6 Å²	50.6	54%	0.537	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	138.5	178.4	-177.4	168.3	-166.4	0	0	112	L549 V583 Q584	E547-L549 HydrophobicContact CG-CD2 4.45Å; E547-L549 PolarHBondContact O-N 2.98Å; E547-V583 CarbonylContact O-C 3.53Å; E547-V583 WeakPolarHBondContact O-CA 3.42Å; E547-V583 WeakPolarHBondContact O-CG1 3.26Å; E547-Q584 PolarHBondContact N-O 2.81Å; E547-Q584 PolarHBondContact O-N 3.35Å
548	I	94.2	Very high	91	Very high	33 Å²	33	51.6 Å²	51.6	17%	0.169	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	107.7	168.6	-64	161.5	0	0	0	107.7	F556 I558 L581 V583	I548-F556 HydrophobicContact CD1-CB 4.33Å; I548-I558 HydrophobicContact CD1-CB 3.86Å; I548-I558 HydrophobicContact CD1-CG2 4.06Å; I548-I558 HydrophobicContact CG1-CB 3.92Å; I548-I558 HydrophobicContact CG1-CG2 3.77Å; I548-L581 HydrophobicContact CD1-CD1 4.39Å; I548-V583 HydrophobicContact CG1-CG2 4.13Å
549	L	93.4	Very high	91.1	Very high	74 Å²	74	51.3 Å²	51.3	39%	0.387	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-48.2	179.6	-61.6	179.1	0	0	0	112.1	E547 T582 Q584 I598	E547-L549 HydrophobicContact CG-CD2 4.45Å; E547-L549 PolarHBondContact O-N 2.98Å; L549-T582 HydrophobicContact CD1-CG2 4.25Å; L549-T582 PolarHBondContact N-O 2.86Å; L549-Q584 HydrophobicContact CD1-CB 3.99Å; L549-Q584 HydrophobicContact CD2-CB 4.14Å; L549-Q584 HydrophobicContact CG-CB 3.91Å; L549-I598 HydrophobicContact CD1-CG2 4Å
550	V	91.2	Very high	91.3	Very high	98 Å²	98	54.6 Å²	54.6	59%	0.594	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.5	158.3	-171.1	-172.2	0	0	0	0	109.9	G552 L581 T582	V550-G552 PolarHBondContact O-N 3.47Å; V550-L581 WeakPolarHBondContact O-CA 3.46Å; V550-T582 PolarHBondContact O-N 2.8Å
551	G	85.4	Confident	91.3	Very high	25 Å²	25	56.9 Å²	56.9	26%	0.258	32%	0.317	S	S	.	.	S	Bend	trans	96.5	-19.7	166.8	0	0	0	0	0	115.4	K553 A580	G551-K553 VanDerWaalsContact C-N 3.31Å; G551-K553 PolarHBondContact O-N 2.73Å; G551-A580 WeakPolarHBondContact CA-O 3.34Å
552	G	78.5	Confident	91.3	Very high	7 Å²	7	59 Å²	59	7%	0.072	33%	0.33	C	S	.	.			trans	-66.7	-21.9	-179	0	0	0	0	0	115.9	V550 G554 D555	V550-G552 PolarHBondContact O-N 3.47Å; G552-G554 PolarHBondContact O-N 3.07Å; G552-D555 WeakPolarHBondContact O-CB 3.4Å; G552-D555 PolarHBondContact O-N 2.88Å
553	K	81.7	Confident	91.3	Very high	133 Å²	133	58.1 Å²	58.1	58%	0.578	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	1.7	-174.9	-54.2	-175	-162.7	131.6	0	116.6	G551 T578 Y579	G551-K553 VanDerWaalsContact C-N 3.31Å; G551-K553 PolarHBondContact O-N 2.73Å; K553-T578 PolarHBondContact NZ-O 2.9Å; K553-Y579 HydrophobicContact CB-CE1 4.28Å; K553-Y579 HydrophobicContact CD-CD1 4.11Å; K553-Y579 HydrophobicContact CD-CE1 3.73Å; K553-Y579 HydrophobicContact CG-CD1 4.22Å; K553-Y579 HydrophobicContact CG-CE1 4.09Å; K553-Y579 VanDerWaalsContact NZ-CE1 3.34Å
554	G	85.2	Confident	91.4	Very high	54 Å²	54	54.8 Å²	54.8	56%	0.557	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-4.7	-167.4	0	0	0	0	0	113.9	G552 A568	G552-G554 PolarHBondContact O-N 3.07Å; G554-A568 WeakPolarHBondContact O-CB 3.3Å
555	D	90.2	Very high	91.3	Very high	31 Å²	31	53.6 Å²	53.6	17%	0.166	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.9	-174.3	-62.4	-23	0	0	0	113.5	G552 A568 V571 Y579	G552-D555 WeakPolarHBondContact O-CB 3.4Å; G552-D555 PolarHBondContact O-N 2.88Å; D555-A568 PolarHBondContact O-N 3.23Å; D555-V571 HydrophobicContact CB-CG1 3.86Å; D555-V571 WeakPolarHBondContact OD1-CG1 3.4Å; D555-Y579 HydrophobicContact CB-CE1 3.94Å; D555-Y579 WeakPolarHBondContact OD2-CE1 3.39Å; D555-Y579 VanDerWaalsContact OD2-CZ 3.22Å; D555-Y579 PolarHBondContact OD2-OH 3.34Å
556	F	93.3	Very high	91.2	Very high	10 Å²	10	54 Å²	54	4%	0.044	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.9	-179.9	-58.3	-80.5	0	0	0	111.4	V528 I548 V565 S566 I567 L573 Y579 L581 I603	V528-F556 HydrophobicContact CG2-CD1 3.97Å; V528-F556 HydrophobicContact CG2-CE1 3.86Å; I548-F556 HydrophobicContact CD1-CB 4.33Å; F556-V565 HydrophobicContact CB-CG1 4.16Å; F556-V565 HydrophobicContact CD1-CG1 4.34Å; F556-S566 WeakPolarHBondContact CA-O 3.46Å; F556-I567 HydrophobicContact CE1-CG1 4.37Å; F556-L573 HydrophobicContact CZ-CD2 4.17Å; F556-Y579 HydrophobicContact CD2-CD1 4.24Å; F556-Y579 HydrophobicContact CD2-CE1 4.47Å; F556-Y579 HydrophobicContact CD2-CG 4.43Å; F556-Y579 AromaticContact CE2-CD1 3.71Å; F556-Y579 HydrophobicContact CE2-CD1 3.71Å; F556-Y579 AromaticContact CE2-CD2 3.69Å; F556-Y579 HydrophobicContact CE2-CD2 3.69Å; F556-Y579 AromaticContact CE2-CE1 3.84Å; F556-Y579 HydrophobicContact CE2-CE1 3.84Å; F556-Y579 AromaticContact CE2-CE2 3.86Å; F556-Y579 HydrophobicContact CE2-CE2 3.86Å; F556-Y579 AromaticContact CE2-CG 3.63Å; F556-Y579 HydrophobicContact CE2-CG 3.63Å; F556-Y579 AromaticContact CE2-CZ 3.92Å; F556-Y579 HydrophobicContact CZ-CD2 4.15Å; F556-Y579 HydrophobicContact CZ-CE2 4.22Å; F556-Y579 HydrophobicContact CZ-CG 4.49Å; F556-L581 HydrophobicContact CB-CD1 4.08Å; F556-L581 HydrophobicContact CD2-CD1 4.37Å; F556-L581 HydrophobicContact CD2-CD2 4Å; F556-L581 HydrophobicContact CG-CD1 4.18Å; F556-I603 HydrophobicContact CD1-CD1 4.06Å; F556-I603 HydrophobicContact CD2-CD1 4.17Å; F556-I603 HydrophobicContact CE1-CD1 3.82Å; F556-I603 HydrophobicContact CE1-CG2 4.45Å; F556-I603 HydrophobicContact CE2-CD1 3.94Å; F556-I603 HydrophobicContact CG-CD1 4.23Å; F556-I603 HydrophobicContact CZ-CD1 3.76Å; F556-I603 HydrophobicContact CZ-CG2 3.95Å
557	V	92.8	Very high	91	Very high	65 Å²	65	53.1 Å²	53.1	39%	0.394	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.4	171.3	-67.8	0	0	0	0	109.7	V565 S566 A568	V557-V565 WeakPolarHBondContact O-CA 3.41Å; V557-S566 WeakPolarHBondContact CG2-OG 3.5Å; V557-S566 PolarHBondContact N-O 2.8Å; V557-S566 PolarHBondContact O-N 3.37Å; V557-A568 HydrophobicContact CG1-CB 3.94Å
558	I	94.6	Very high	90.8	Very high	31 Å²	31	47.9 Å²	47.9	16%	0.159	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.9	172.7	-166.7	162.7	0	0	0	110.3	L531 Y546 I548 K560 L564 V565 V583	L531-I558 HydrophobicContact CD1-CD1 4.16Å; Y546-I558 HydrophobicContact CG-CD1 4.4Å; I548-I558 HydrophobicContact CD1-CB 3.86Å; I548-I558 HydrophobicContact CD1-CG2 4.06Å; I548-I558 HydrophobicContact CG1-CB 3.92Å; I548-I558 HydrophobicContact CG1-CG2 3.77Å; I558-K560 PolarHBondContact O-N 2.83Å; I558-L564 CarbonylContact C-O 3.55Å; I558-L564 WeakPolarHBondContact CA-O 3.2Å; I558-V565 HydrophobicContact CB-CG2 4.38Å; I558-V565 HydrophobicContact CD1-CG2 3.85Å; I558-V565 HydrophobicContact CG1-CG2 4.05Å; I558-V583 HydrophobicContact CD1-CG1 3.52Å
559	N	94.1	Very high	90.5	Very high	76 Å²	76	51.7 Å²	51.7	41%	0.406	30%	0.303	S	S	.	.			trans	-76.9	118.4	170	-179.6	-53.5	0	0	0	109.4	T561 T562 G563 L564	N559-T561 VanDerWaalsContact C-N 3.26Å; N559-T561 PolarHBondContact O-N 3.03Å; N559-T561 VanDerWaalsContact O-N 3.17Å; N559-T561 PolarHBondContact OD1-N 2.76Å; N559-T561 VanDerWaalsContact OD1-N 3.09Å; N559-T561 PolarHBondContact OD1-OG1 3.07Å; N559-T562 WeakPolarHBondContact CB-OG1 3.27Å; N559-T562 VanDerWaalsContact CG-OG1 3.26Å; N559-T562 PolarHBondContact OD1-N 2.97Å; N559-T562 PolarHBondContact OD1-OG1 2.79Å; N559-G563 WeakPolarHBondContact O-CA 3.42Å; N559-G563 PolarHBondContact O-N 2.84Å; N559-L564 HydrophobicContact CB-CB 4.23Å; N559-L564 PolarHBondContact N-O 2.85Å
560	K	94	Very high	90	Very high	128 Å²	128	51.8 Å²	51.8	56%	0.557	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.6	-172.2	-176.9	172.6	178.5	-180	0	114.5	S545 Y546 I558	S545-K560 CarbonylContact C-O 3.57Å; S545-K560 WeakPolarHBondContact CA-O 3.19Å; S545-K560 WeakPolarHBondContact OG-CE 3.48Å; Y546-K560 WeakPolarHBondContact CD2-O 3.26Å; Y546-K560 PolarHBondContact N-O 2.88Å; I558-K560 PolarHBondContact O-N 2.83Å
561	T	92.1	Very high	89.7	Confident	106 Å²	106	48.4 Å²	48.4	65%	0.65	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-35.1	-176.6	54.8	0	0	0	0	113.2	N559	N559-T561 VanDerWaalsContact C-N 3.26Å; N559-T561 PolarHBondContact O-N 3.03Å; N559-T561 VanDerWaalsContact O-N 3.17Å; N559-T561 PolarHBondContact OD1-N 2.76Å; N559-T561 VanDerWaalsContact OD1-N 3.09Å; N559-T561 PolarHBondContact OD1-OG1 3.07Å
562	T	91.3	Very high	89.6	Confident	64 Å²	64	55.8 Å²	55.8	39%	0.393	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-31.2	179.8	67.3	0	0	0	0	112.7	Q530 N559 L564	Q530-T562 VanDerWaalsContact NE2-C 3.29Å; Q530-T562 PolarHBondContact NE2-O 3.44Å; N559-T562 WeakPolarHBondContact CB-OG1 3.27Å; N559-T562 VanDerWaalsContact CG-OG1 3.26Å; N559-T562 PolarHBondContact OD1-N 2.97Å; N559-T562 PolarHBondContact OD1-OG1 2.79Å; T562-L564 VanDerWaalsContact C-N 3.35Å; T562-L564 VanDerWaalsContact OG1-CB 3.32Å; T562-L564 WeakPolarHBondContact OG1-CB 3.39Å; T562-L564 PolarHBondContact OG1-N 3.12Å
563	G	92.1	Very high	89.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	33%	0.331	C	S	.	.			trans	82.7	11	-168.5	0	0	0	0	0	113.8	L531 N559 V565	L531-G563 PolarHBondContact N-O 2.91Å; N559-G563 WeakPolarHBondContact O-CA 3.42Å; N559-G563 PolarHBondContact O-N 2.84Å; G563-V565 PolarHBondContact O-N 2.67Å
564	L	94.4	Very high	90	Very high	42 Å²	42	55 Å²	55	22%	0.22	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	116.7	178.4	179.3	60.6	0	0	0	110.6	Q530 I558 N559 T562	Q530-L564 VanDerWaalsContact NE2-N 3.12Å; I558-L564 CarbonylContact C-O 3.55Å; I558-L564 WeakPolarHBondContact CA-O 3.2Å; N559-L564 HydrophobicContact CB-CB 4.23Å; N559-L564 PolarHBondContact N-O 2.85Å; T562-L564 VanDerWaalsContact C-N 3.35Å; T562-L564 VanDerWaalsContact OG1-CB 3.32Å; T562-L564 WeakPolarHBondContact OG1-CB 3.39Å; T562-L564 PolarHBondContact OG1-N 3.12Å
565	V	93.2	Very high	89.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	129.8	168.3	-176.7	0	0	0	0	108.9	V528 I529 L531 F556 V557 I558 G563 L581	V528-V565 HydrophobicContact CB-CB 4.42Å; V528-V565 HydrophobicContact CB-CG1 4.19Å; V528-V565 WeakPolarHBondContact CB-O 3.24Å; V528-V565 PolarHBondContact N-O 2.81Å; I529-V565 HydrophobicContact CG2-CB 3.88Å; I529-V565 HydrophobicContact CG2-CG2 3.93Å; I529-V565 PolarHBondContact N-O 3.06Å; I529-V565 PolarHBondContact O-N 3.47Å; L531-V565 HydrophobicContact CD1-CG2 4Å; L531-V565 HydrophobicContact CG-CG2 4.42Å; F556-V565 HydrophobicContact CB-CG1 4.16Å; F556-V565 HydrophobicContact CD1-CG1 4.34Å; V557-V565 WeakPolarHBondContact O-CA 3.41Å; I558-V565 HydrophobicContact CB-CG2 4.38Å; I558-V565 HydrophobicContact CD1-CG2 3.85Å; I558-V565 HydrophobicContact CG1-CG2 4.05Å; G563-V565 PolarHBondContact O-N 2.67Å; V565-L581 HydrophobicContact CG1-CD1 3.95Å
566	S	92.8	Very high	89.4	Confident	22 Å²	22	57.5 Å²	57.5	15%	0.154	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	159.9	177.4	60.3	0	0	0	0	112.1	D526 F556 V557 A568	D526-S566 WeakPolarHBondContact O-CA 3.3Å; D526-S566 VanDerWaalsContact O-CB 3.25Å; D526-S566 WeakPolarHBondContact O-CB 3.31Å; F556-S566 WeakPolarHBondContact CA-O 3.46Å; V557-S566 WeakPolarHBondContact CG2-OG 3.5Å; V557-S566 PolarHBondContact N-O 2.8Å; V557-S566 PolarHBondContact O-N 3.37Å; S566-A568 PolarHBondContact O-N 2.92Å
567	I	91.7	Very high	89.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	131.5	175.7	-58.6	170.9	0	0	0	109.6	M522 G525 D526 V528 F556 V571 L573	M522-I567 HydrophobicContact CB-CD1 3.43Å; M522-I567 VanDerWaalsContact CB-CD1 3.43Å; M522-I567 HydrophobicContact CE-CD1 4.06Å; M522-I567 HydrophobicContact CG-CD1 4.47Å; M522-I567 HydrophobicContact SD-CD1 4.38Å; G525-I567 PolarHBondContact N-O 3.33Å; D526-I567 HydrophobicContact CB-CD1 4.41Å; D526-I567 PolarHBondContact O-N 3.48Å; D526-I567 VanDerWaalsContact O-N 3.07Å; V528-I567 HydrophobicContact CG2-CG1 4Å; F556-I567 HydrophobicContact CE1-CG1 4.37Å; I567-V571 HydrophobicContact CG2-CB 4.33Å; I567-V571 HydrophobicContact CG2-CG1 4.47Å; I567-L573 HydrophobicContact CD1-CD1 3.59Å; I567-L573 HydrophobicContact CD1-CG 4.34Å; I567-L573 HydrophobicContact CG1-CD1 4.24Å
568	A	91.2	Very high	89.1	Confident	5 Å²	5	61.3 Å²	61.3	4%	0.041	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-68.9	149.4	-175.6	0	0	0	0	0	112.9	G554 D555 V557 S566 G570 V571	G554-A568 WeakPolarHBondContact O-CB 3.3Å; D555-A568 PolarHBondContact O-N 3.23Å; V557-A568 HydrophobicContact CG1-CB 3.94Å; S566-A568 PolarHBondContact O-N 2.92Å; A568-G570 PolarHBondContact O-N 2.91Å; A568-V571 HydrophobicContact CB-CG2 3.99Å; A568-V571 PolarHBondContact O-N 2.81Å
569	P	86.7	Confident	88.9	Confident	113 Å²	113	60.3 Å²	60.3	73%	0.734	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	125.3	178.5	-26.4	35.6	0	0	0	113.4
570	G	82.9	Confident	88.9	Confident	76 Å²	76	58.8 Å²	58.8	78%	0.784	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	13.1	175.2	0	0	0	0	0	115.7	A568	A568-G570 PolarHBondContact O-N 2.91Å
571	V	85.3	Confident	88.9	Confident	27 Å²	27	52.7 Å²	52.7	16%	0.164	33%	0.332	C	S	.	.			trans	-98.7	136.6	-179.4	172.5	0	0	0	0	111.3	D555 I567 A568 L573	D555-V571 HydrophobicContact CB-CG1 3.86Å; D555-V571 WeakPolarHBondContact OD1-CG1 3.4Å; I567-V571 HydrophobicContact CG2-CB 4.33Å; I567-V571 HydrophobicContact CG2-CG1 4.47Å; A568-V571 HydrophobicContact CB-CG2 3.99Å; A568-V571 PolarHBondContact O-N 2.81Å; V571-L573 HydrophobicContact CG1-CD2 4.48Å
572	E	82.6	Confident	89	Confident	180 Å²	180	49.3 Å²	49.3	84%	0.841	31%	0.312	S	S	*	.			trans	-109.8	119.8	171.2	-68.2	-175.9	173.3	0	0	109.5
573	L	84.8	Confident	89.2	Confident	20 Å²	20	46.3 Å²	46.3	11%	0.105	29%	0.293	C	S	.	.			trans	-74.7	137.5	-179.9	-64.9	179.1	0	0	0	111.4	V518 T520 F556 I567 V571 V605	V518-L573 HydrophobicContact CB-CD1 4.04Å; V518-L573 HydrophobicContact CG2-CD1 3.76Å; T520-L573 HydrophobicContact CG2-CB 4.28Å; T520-L573 VanDerWaalsContact CG2-O 3.23Å; T520-L573 WeakPolarHBondContact CG2-O 3.32Å; F556-L573 HydrophobicContact CZ-CD2 4.17Å; I567-L573 HydrophobicContact CD1-CD1 3.59Å; I567-L573 HydrophobicContact CD1-CG 4.34Å; I567-L573 HydrophobicContact CG1-CD1 4.24Å; V571-L573 HydrophobicContact CG1-CD2 4.48Å; L573-V605 HydrophobicContact CB-CG1 3.85Å; L573-V605 HydrophobicContact CD2-CG2 4.46Å
574	I	84	Confident	89.4	Confident	103 Å²	103	47.8 Å²	47.8	53%	0.528	30%	0.3	S	S	.	.			trans	-109.4	122.4	-178.2	-58.7	176.4	0	0	0	109.8	G576 Q577 V605	I574-G576 PolarHBondContact O-N 2.87Å; I574-Q577 HydrophobicContact CB-CG 4.23Å; I574-Q577 WeakPolarHBondContact O-CB 3.38Å; I574-Q577 PolarHBondContact O-N 2.99Å; I574-Q577 VanDerWaalsContact O-N 3.07Å; I574-V605 WeakPolarHBondContact O-CB 3.3Å; I574-V605 WeakPolarHBondContact O-CG1 3.45Å
575	V	84.3	Confident	89.4	Confident	80 Å²	80	45.8 Å²	45.8	49%	0.485	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	131.6	178.1	-179	0	0	0	0	111.3	T520 Q577 P607	T520-V575 HydrophobicContact CG2-CB 4.44Å; T520-V575 HydrophobicContact CG2-CG2 3.5Å; V575-Q577 VanDerWaalsContact C-N 3.3Å; V575-P607 HydrophobicContact CG1-CG 3.87Å; V575-P607 HydrophobicContact CG2-CB 4.49Å; V575-P607 HydrophobicContact CG2-CG 4.46Å
576	G	80.3	Confident	89.5	Confident	59 Å²	59	46.3 Å²	46.3	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	4.1	178.4	0	0	0	0	0	114.7	I574 V605	I574-G576 PolarHBondContact O-N 2.87Å; G576-V605 PolarHBondContact N-O 2.95Å
577	Q	87.4	Confident	89.6	Confident	58 Å²	58	45.3 Å²	45.3	27%	0.271	29%	0.286	S	S	.	.			trans	-72.6	144.6	159.4	-77.7	-148.4	57.4	0	0	110.9	I574 V575 Y579 V605	I574-Q577 HydrophobicContact CB-CG 4.23Å; I574-Q577 WeakPolarHBondContact O-CB 3.38Å; I574-Q577 PolarHBondContact O-N 2.99Å; I574-Q577 VanDerWaalsContact O-N 3.07Å; V575-Q577 VanDerWaalsContact C-N 3.3Å; Q577-Y579 HydrophobicContact CB-CE2 3.9Å; Q577-V605 HydrophobicContact CB-CG2 4.16Å; Q577-V605 WeakPolarHBondContact O-CG2 3.33Å; Q577-V605 PolarHBondContact O-N 2.03Å
578	T	90.8	Very high	89.7	Confident	96 Å²	96	47.7 Å²	47.7	59%	0.589	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	148	170.9	55.1	0	0	0	0	110.2	K553 I603 E604	K553-T578 PolarHBondContact NZ-O 2.9Å; T578-I603 CarbonylContact C-O 3.55Å; T578-I603 VanDerWaalsContact CA-O 3.27Å; T578-I603 WeakPolarHBondContact CA-O 3.48Å; T578-E604 HydrophobicContact CG2-CG 4.4Å
579	Y	91.7	Very high	89.7	Confident	10 Å²	10	47.5 Å²	47.5	4%	0.039	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151.2	176.4	-54	-104	0	0	0	109.5	K553 D555 F556 Q577 Y602 I603 V605	K553-Y579 HydrophobicContact CB-CE1 4.28Å; K553-Y579 HydrophobicContact CD-CD1 4.11Å; K553-Y579 HydrophobicContact CD-CE1 3.73Å; K553-Y579 HydrophobicContact CG-CD1 4.22Å; K553-Y579 HydrophobicContact CG-CE1 4.09Å; K553-Y579 VanDerWaalsContact NZ-CE1 3.34Å; D555-Y579 HydrophobicContact CB-CE1 3.94Å; D555-Y579 WeakPolarHBondContact OD2-CE1 3.39Å; D555-Y579 VanDerWaalsContact OD2-CZ 3.22Å; D555-Y579 PolarHBondContact OD2-OH 3.34Å; F556-Y579 HydrophobicContact CD2-CD1 4.24Å; F556-Y579 HydrophobicContact CD2-CE1 4.47Å; F556-Y579 HydrophobicContact CD2-CG 4.43Å; F556-Y579 AromaticContact CE2-CD1 3.71Å; F556-Y579 HydrophobicContact CE2-CD1 3.71Å; F556-Y579 AromaticContact CE2-CD2 3.69Å; F556-Y579 HydrophobicContact CE2-CD2 3.69Å; F556-Y579 AromaticContact CE2-CE1 3.84Å; F556-Y579 HydrophobicContact CE2-CE1 3.84Å; F556-Y579 AromaticContact CE2-CE2 3.86Å; F556-Y579 HydrophobicContact CE2-CE2 3.86Å; F556-Y579 AromaticContact CE2-CG 3.63Å; F556-Y579 HydrophobicContact CE2-CG 3.63Å; F556-Y579 AromaticContact CE2-CZ 3.92Å; F556-Y579 HydrophobicContact CZ-CD2 4.15Å; F556-Y579 HydrophobicContact CZ-CE2 4.22Å; F556-Y579 HydrophobicContact CZ-CG 4.49Å; Q577-Y579 HydrophobicContact CB-CE2 3.9Å; Y579-Y602 WeakPolarHBondContact O-CA 3.07Å; Y579-I603 HydrophobicContact CD2-CB 4.44Å; Y579-I603 PolarHBondContact N-O 2.87Å; Y579-I603 PolarHBondContact O-N 3.38Å; Y579-V605 HydrophobicContact CD2-CG2 4.4Å; Y579-V605 HydrophobicContact CE2-CG2 3.8Å
580	A	93.7	Very high	89.8	Confident	44 Å²	44	45.2 Å²	45.2	36%	0.364	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	92.2	171.3	0	0	0	0	0	106.3	G551 T600 V601 Y602	G551-A580 WeakPolarHBondContact CA-O 3.34Å; A580-T600 HydrophobicContact CB-CG2 4.21Å; A580-V601 CarbonylContact C-O 3.49Å; A580-V601 WeakPolarHBondContact CA-O 3.39Å; A580-Y602 HydrophobicContact CB-CD1 3.83Å; A580-Y602 HydrophobicContact CB-CE1 3.79Å
581	L	94	Very high	90.1	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	121.8	-179.6	-47.7	-171.6	0	0	0	108.6	I548 V550 F556 V565 V583 T600 V601 I603	I548-L581 HydrophobicContact CD1-CD1 4.39Å; V550-L581 WeakPolarHBondContact O-CA 3.46Å; F556-L581 HydrophobicContact CB-CD1 4.08Å; F556-L581 HydrophobicContact CD2-CD1 4.37Å; F556-L581 HydrophobicContact CD2-CD2 4Å; F556-L581 HydrophobicContact CG-CD1 4.18Å; V565-L581 HydrophobicContact CG1-CD1 3.95Å; L581-V583 HydrophobicContact CB-CG2 4.11Å; L581-T600 CarbonylContact O-C 3.58Å; L581-T600 VanDerWaalsContact O-CA 3.29Å; L581-T600 WeakPolarHBondContact O-CA 3.01Å; L581-V601 HydrophobicContact CB-CB 4.13Å; L581-V601 HydrophobicContact CG-CB 4.39Å; L581-V601 PolarHBondContact N-O 2.8Å; L581-V601 PolarHBondContact O-N 3.02Å; L581-I603 HydrophobicContact CD1-CD1 3.53Å; L581-I603 HydrophobicContact CD2-CD1 4.41Å; L581-I603 HydrophobicContact CG-CD1 3.8Å
582	T	94.8	Very high	90.2	Very high	36 Å²	36	50.6 Å²	50.6	22%	0.221	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	109.9	165.7	-53.9	0	0	0	0	107.6	L549 V550 I598	L549-T582 HydrophobicContact CD1-CG2 4.25Å; L549-T582 PolarHBondContact N-O 2.86Å; V550-T582 PolarHBondContact O-N 2.8Å; T582-I598 HydrophobicContact CG2-CB 4.23Å; T582-I598 HydrophobicContact CG2-CD1 4.27Å; T582-I598 HydrophobicContact CG2-CG2 4.38Å
583	V	94.7	Very high	90.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.2	-179.7	-174.8	0	0	0	0	109.2	F509 L531 E547 I548 I558 L581 I598 C599 V601	F509-V583 HydrophobicContact CZ-CG1 4.38Å; L531-V583 HydrophobicContact CD1-CB 3.85Å; L531-V583 HydrophobicContact CD1-CG1 3.68Å; L531-V583 HydrophobicContact CD1-CG2 3.76Å; E547-V583 CarbonylContact O-C 3.53Å; E547-V583 WeakPolarHBondContact O-CA 3.42Å; E547-V583 WeakPolarHBondContact O-CG1 3.26Å; I548-V583 HydrophobicContact CG1-CG2 4.13Å; I558-V583 HydrophobicContact CD1-CG1 3.52Å; L581-V583 HydrophobicContact CB-CG2 4.11Å; V583-I598 CarbonylContact O-C 3.56Å; V583-I598 VanDerWaalsContact O-CA 3.22Å; V583-I598 WeakPolarHBondContact O-CA 3.43Å; V583-C599 PolarHBondContact N-O 3.46Å; V583-C599 PolarHBondContact O-N 3.43Å; V583-V601 HydrophobicContact CG2-CG2 4.18Å
584	Q	95.4	Very high	90.9	Very high	32 Å²	32	51.6 Å²	51.6	15%	0.15	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.8	174.4	-169.8	173.8	-78.1	0	0	110.1	Y546 E547 L549 S586 H596 S597 I598	Y546-Q584 WeakPolarHBondContact CA-O 3.32Å; E547-Q584 PolarHBondContact N-O 2.81Å; E547-Q584 PolarHBondContact O-N 3.35Å; L549-Q584 HydrophobicContact CD1-CB 3.99Å; L549-Q584 HydrophobicContact CD2-CB 4.14Å; L549-Q584 HydrophobicContact CG-CB 3.91Å; Q584-S586 PolarHBondContact NE2-OG 2.89Å; Q584-H596 HydrophobicContact CG-CB 3.95Å; Q584-S597 WeakPolarHBondContact CA-O 3.27Å; Q584-S597 WeakPolarHBondContact CG-O 3.32Å; Q584-I598 HydrophobicContact CB-CG2 4.06Å; Q584-I598 HydrophobicContact CG-CG2 4.12Å
585	A	95.4	Very high	91.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.8	160.1	0	0	0	0	0	107.6	P507 F509 A533 I544 S545 Y546 H596 S597	P507-A585 HydrophobicContact CB-CB 3.92Å; F509-A585 HydrophobicContact CD2-CB 4.45Å; F509-A585 HydrophobicContact CE1-CB 4.14Å; F509-A585 HydrophobicContact CE2-CB 3.6Å; F509-A585 HydrophobicContact CZ-CB 3.41Å; F509-A585 VanDerWaalsContact CZ-CB 3.41Å; A533-A585 HydrophobicContact CB-CB 3.61Å; I544-A585 HydrophobicContact CG2-CB 3.77Å; S545-A585 WeakPolarHBondContact O-CA 3.38Å; Y546-A585 HydrophobicContact CD1-CB 4.08Å; Y546-A585 HydrophobicContact CE1-CB 4.03Å; A585-H596 CarbonylContact O-C 3.54Å; A585-H596 WeakPolarHBondContact O-CA 3.19Å; A585-H596 WeakPolarHBondContact O-CB 3.34Å; A585-S597 PolarHBondContact N-O 2.92Å; A585-S597 PolarHBondContact O-N 3Å
586	S	95.2	Very high	91.8	Very high	11 Å²	11	52 Å²	52	8%	0.077	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.8	179.8	-58.9	0	0	0	0	110.5	I544 S545 Q584 R595 H596	I544-S586 CarbonylContact C-O 3.53Å; S545-S586 PolarHBondContact N-O 2.71Å; S545-S586 PolarHBondContact O-N 2.7Å; S545-S586 PolarHBondContact OG-O 2.86Å; Q584-S586 PolarHBondContact NE2-OG 2.89Å; S586-R595 WeakPolarHBondContact CA-O 3.31Å; S586-H596 VanDerWaalsContact OG-CB 3.25Å; S586-H596 WeakPolarHBondContact OG-CB 3.21Å
587	D	95.3	Very high	92.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.283	C	S	.	.			trans	-65.5	170.9	170.2	65.5	51.3	0	0	0	112	N503 P507 N541 E543 A589 R594 R595	N503-D587 PolarHBondContact ND2-OD2 2.97Å; N503-D587 PolarHBondContact OD1-OD2 3.12Å; P507-D587 HydrophobicContact CG-CB 4.19Å; N541-D587 WeakPolarHBondContact O-CB 3.34Å; E543-D587 CarbonylContact O-C 3.52Å; D587-A589 WeakPolarHBondContact OD1-CA 3.4Å; D587-A589 WeakPolarHBondContact OD1-CB 3.45Å; D587-A589 PolarHBondContact OD1-N 2.71Å; D587-R594 PolarHBondContact O-NE 2.98Å; D587-R594 VanDerWaalsContact OD1-CA 3.3Å; D587-R594 WeakPolarHBondContact OD1-CA 2.99Å; D587-R594 WeakPolarHBondContact OD1-CB 3.49Å; D587-R594 VanDerWaalsContact OD1-CG 3.27Å; D587-R594 WeakPolarHBondContact OD1-CG 3.41Å; D587-R594 IonicContact OD1-NE 3.11Å; D587-R595 PolarHBondContact N-O 2.81Å; D587-R595 WeakPolarHBondContact OD2-CA 3.31Å; D587-R595 WeakPolarHBondContact OD2-CB 3.48Å; D587-R595 PolarHBondContact OD2-N 3.14Å
588	N	93.2	Very high	92.9	Very high	51 Å²	51	52.3 Å²	52.3	27%	0.273	29%	0.294	S	S	.	.			trans	-99.3	14.5	173.5	-73	-26.7	0	0	0	112.8	S540 E543	S540-N588 CarbonylContact O-C 3.58Å; S540-N588 VanDerWaalsContact O-C 3.23Å; S540-N588 WeakPolarHBondContact O-CA 3.33Å; S540-N588 WeakPolarHBondContact O-CB 3.11Å; S540-N588 PolarHBondContact O-N 3.34Å; E543-N588 HydrophobicContact CB-CB 4.31Å; E543-N588 WeakPolarHBondContact CG-ND2 3.14Å; E543-N588 VanDerWaalsContact O-CG 3.26Å; E543-N588 PolarHBondContact O-N 2.82Å; E543-N588 PolarHBondContact O-ND2 3.41Å; E543-N588 PolarHBondContact OE2-ND2 3.34Å
589	A	90.4	Very high	93	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	27%	0.266	C	S	.	.	S	Bend	trans	-60.7	165.7	176.7	0	0	0	0	0	111.7	N503 S540 N541 D587 R594	N503-A589 HydrophobicContact CB-CB 4.29Å; S540-A589 PolarHBondContact O-N 3.44Å; N541-A589 WeakPolarHBondContact OD1-CB 2.97Å; D587-A589 WeakPolarHBondContact OD1-CA 3.4Å; D587-A589 WeakPolarHBondContact OD1-CB 3.45Å; D587-A589 PolarHBondContact OD1-N 2.71Å; A589-R594 PolarHBondContact O-NH2 3.41Å
590	P	89.8	Confident	93.2	Very high	65 Å²	65	49 Å²	49	42%	0.422	27%	0.274	S	S	.	.			trans	-53.5	144.6	177.7	-26.5	36.2	0	0	0	112.1	A592 E593 R594	P590-A592 PolarHBondContact O-N 2.94Å; P590-E593 PolarHBondContact O-N 3.49Å; P590-R594 PolarHBondContact O-N 3.34Å
591	P	88.6	Confident	93.2	Very high	115 Å²	115	46.9 Å²	46.9	75%	0.747	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-11.7	-172.5	-27.3	35.2	0	0	0	117.1
592	A	88.7	Confident	93.2	Very high	102 Å²	102	52.2 Å²	52.2	84%	0.843	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-22	174.9	0	0	0	0	0	113.5	P590	P590-A592 PolarHBondContact O-N 2.94Å
593	E	88.4	Confident	93	Very high	117 Å²	117	50.6 Å²	50.6	55%	0.547	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-13.6	-175.1	-72.9	160.1	-155.7	0	0	112.3	N503 P590 R595	N503-E593 PolarHBondContact ND2-O 2.95Å; P590-E593 PolarHBondContact O-N 3.49Å; E593-R595 WeakPolarHBondContact O-CG 3.34Å; E593-R595 PolarHBondContact O-N 2.83Å
594	R	92.1	Very high	92.9	Very high	103 Å²	103	54.6 Å²	54.6	39%	0.389	29%	0.287	S	S	.	.			trans	-55.3	128.9	-180	174.4	170.7	-58.1	140	11.9	113.7	D587 A589 P590	D587-R594 PolarHBondContact O-NE 2.98Å; D587-R594 VanDerWaalsContact OD1-CA 3.3Å; D587-R594 WeakPolarHBondContact OD1-CA 2.99Å; D587-R594 WeakPolarHBondContact OD1-CB 3.49Å; D587-R594 VanDerWaalsContact OD1-CG 3.27Å; D587-R594 WeakPolarHBondContact OD1-CG 3.41Å; D587-R594 IonicContact OD1-NE 3.11Å; A589-R594 PolarHBondContact O-NH2 3.41Å; P590-R594 PolarHBondContact O-N 3.34Å
595	R	93.5	Very high	92.6	Very high	89 Å²	89	53.1 Å²	53.1	34%	0.336	28%	0.28	S	S	.	.			trans	-111.8	158.7	177.5	-59	173	176.1	-136.7	8.6	110	N503 D504 N505 T506 S586 D587 E593	N503-R595 PolarHBondContact O-NE 2.81Å; N503-R595 PolarHBondContact O-NH2 2.9Å; D504-R595 VanDerWaalsContact C-NH1 3.33Å; D504-R595 VanDerWaalsContact CA-NH2 3.34Å; D504-R595 VanDerWaalsContact O-CZ 3.26Å; D504-R595 PolarHBondContact O-NH1 2.91Å; D504-R595 PolarHBondContact O-NH2 3.3Å; N505-R595 WeakPolarHBondContact O-CD 3.39Å; N505-R595 PolarHBondContact O-NE 3.46Å; N505-R595 PolarHBondContact O-NH1 3.5Å; T506-R595 HydrophobicContact CG2-CB 4.23Å; S586-R595 WeakPolarHBondContact CA-O 3.31Å; D587-R595 PolarHBondContact N-O 2.81Å; D587-R595 WeakPolarHBondContact OD2-CA 3.31Å; D587-R595 WeakPolarHBondContact OD2-CB 3.48Å; D587-R595 PolarHBondContact OD2-N 3.14Å; E593-R595 WeakPolarHBondContact O-CG 3.34Å; E593-R595 PolarHBondContact O-N 2.83Å
596	H	94.5	Very high	92.2	Very high	102 Å²	102	55.2 Å²	55.2	47%	0.472	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	152.1	-176.9	61.4	85	0	0	0	112.3	Q584 A585 S586	Q584-H596 HydrophobicContact CG-CB 3.95Å; A585-H596 CarbonylContact O-C 3.54Å; A585-H596 WeakPolarHBondContact O-CA 3.19Å; A585-H596 WeakPolarHBondContact O-CB 3.34Å; S586-H596 VanDerWaalsContact OG-CB 3.25Å; S586-H596 WeakPolarHBondContact OG-CB 3.21Å
597	S	95.1	Very high	91.5	Very high	28 Å²	28	58.4 Å²	58.4	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	169.8	165.4	79.1	0	0	0	0	111.3	P507 F509 Q584 A585	P507-S597 WeakPolarHBondContact O-CB 3.37Å; P507-S597 PolarHBondContact O-OG 3.33Å; F509-S597 WeakPolarHBondContact CD2-OG 3.41Å; Q584-S597 WeakPolarHBondContact CA-O 3.27Å; Q584-S597 WeakPolarHBondContact CG-O 3.32Å; A585-S597 PolarHBondContact N-O 2.92Å; A585-S597 PolarHBondContact O-N 3Å
598	I	94.8	Very high	90.6	Very high	96 Å²	96	61.3 Å²	61.3	49%	0.492	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.7	177.7	57.1	172.5	0	0	0	110.9	L549 T582 V583 Q584	L549-I598 HydrophobicContact CD1-CG2 4Å; T582-I598 HydrophobicContact CG2-CB 4.23Å; T582-I598 HydrophobicContact CG2-CD1 4.27Å; T582-I598 HydrophobicContact CG2-CG2 4.38Å; V583-I598 CarbonylContact O-C 3.56Å; V583-I598 VanDerWaalsContact O-CA 3.22Å; V583-I598 WeakPolarHBondContact O-CA 3.43Å; Q584-I598 HydrophobicContact CB-CG2 4.06Å; Q584-I598 HydrophobicContact CG-CG2 4.12Å
599	C	94.5	Very high	89.2	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.014	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	163.5	166.5	66.8	0	0	0	0	110.6	F509 I512 Y514 V583	F509-C599 HydrophobicContact CB-CB 4.16Å; F509-C599 HydrophobicContact CD1-CB 4.33Å; F509-C599 HydrophobicContact CD2-CB 3.65Å; F509-C599 HydrophobicContact CE2-CB 4.05Å; F509-C599 HydrophobicContact CG-CB 3.8Å; I512-C599 WeakPolarHBondContact O-CA 3.48Å; I512-C599 WeakPolarHBondContact O-CB 3.16Å; Y514-C599 HydrophobicContact CD2-CB 4.44Å; Y514-C599 HydrophobicContact CE2-CB 4.02Å; V583-C599 PolarHBondContact N-O 3.46Å; V583-C599 PolarHBondContact O-N 3.43Å
600	T	94.2	Very high	87.5	Confident	35 Å²	35	69.9 Å²	69.9	22%	0.215	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	118	177.2	-54.6	0	0	0	0	111.6	I512 S513 Y514 A580 L581 Y602	I512-T600 PolarHBondContact O-N 3.22Å; S513-T600 CarbonylContact C-O 3.56Å; S513-T600 WeakPolarHBondContact CA-O 3.47Å; S513-T600 WeakPolarHBondContact CB-O 3.48Å; Y514-T600 PolarHBondContact N-O 3.28Å; A580-T600 HydrophobicContact CB-CG2 4.21Å; L581-T600 CarbonylContact O-C 3.58Å; L581-T600 VanDerWaalsContact O-CA 3.29Å; L581-T600 WeakPolarHBondContact O-CA 3.01Å; T600-Y602 HydrophobicContact CG2-CD1 4.27Å; T600-Y602 HydrophobicContact CG2-CD2 4.42Å; T600-Y602 HydrophobicContact CG2-CE1 3.78Å; T600-Y602 HydrophobicContact CG2-CE2 3.95Å
601	V	94.2	Very high	85.7	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.1	172.6	-170.3	0	0	0	0	109.4	Y514 V516 I529 L531 A580 L581 V583 I603	Y514-V601 HydrophobicContact CD2-CG2 4.41Å; Y514-V601 CarbonylContact O-C 3.55Å; Y514-V601 WeakPolarHBondContact O-CA 3.38Å; V516-V601 HydrophobicContact CB-CG1 4.43Å; V516-V601 HydrophobicContact CG2-CG1 3.67Å; I529-V601 HydrophobicContact CG2-CG1 4.01Å; I529-V601 HydrophobicContact CG2-CG2 4.49Å; L531-V601 HydrophobicContact CD1-CG2 3.9Å; L531-V601 HydrophobicContact CD2-CG2 4.01Å; L531-V601 HydrophobicContact CG-CG2 4.46Å; A580-V601 CarbonylContact C-O 3.49Å; A580-V601 WeakPolarHBondContact CA-O 3.39Å; L581-V601 HydrophobicContact CB-CB 4.13Å; L581-V601 HydrophobicContact CG-CB 4.39Å; L581-V601 PolarHBondContact N-O 2.8Å; L581-V601 PolarHBondContact O-N 3.02Å; V583-V601 HydrophobicContact CG2-CG2 4.18Å; V601-I603 HydrophobicContact CG1-CD1 4.3Å; V601-I603 HydrophobicContact CG1-CG1 3.86Å
602	Y	93.6	Very high	83.7	Confident	111 Å²	111	72.4 Å²	72.4	44%	0.435	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.8	170.7	-63.8	-68.7	0	0	0	109.3	Y514 D515 V516 Y579 A580 T600	Y514-Y602 PolarHBondContact O-N 3.31Å; D515-Y602 WeakPolarHBondContact OD1-CB 3.42Å; V516-Y602 PolarHBondContact N-O 3.21Å; Y579-Y602 WeakPolarHBondContact O-CA 3.07Å; A580-Y602 HydrophobicContact CB-CD1 3.83Å; A580-Y602 HydrophobicContact CB-CE1 3.79Å; T600-Y602 HydrophobicContact CG2-CD1 4.27Å; T600-Y602 HydrophobicContact CG2-CD2 4.42Å; T600-Y602 HydrophobicContact CG2-CE1 3.78Å; T600-Y602 HydrophobicContact CG2-CE2 3.95Å
603	I	92.3	Very high	81.9	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.4	-179.2	-54.7	172.5	0	0	0	109.1	V516 V518 V528 F556 T578 Y579 L581 V601	V516-I603 HydrophobicContact CB-CG1 4.45Å; V516-I603 WeakPolarHBondContact O-CA 3.32Å; V518-I603 HydrophobicContact CB-CG2 4.23Å; V518-I603 HydrophobicContact CG1-CG2 3.76Å; V518-I603 HydrophobicContact CG2-CG2 3.48Å; V518-I603 VanDerWaalsContact CG2-CG2 3.48Å; V528-I603 HydrophobicContact CG1-CD1 3.98Å; V528-I603 HydrophobicContact CG1-CG1 4.44Å; F556-I603 HydrophobicContact CD1-CD1 4.06Å; F556-I603 HydrophobicContact CD2-CD1 4.17Å; F556-I603 HydrophobicContact CE1-CD1 3.82Å; F556-I603 HydrophobicContact CE1-CG2 4.45Å; F556-I603 HydrophobicContact CE2-CD1 3.94Å; F556-I603 HydrophobicContact CG-CD1 4.23Å; F556-I603 HydrophobicContact CZ-CD1 3.76Å; F556-I603 HydrophobicContact CZ-CG2 3.95Å; T578-I603 CarbonylContact C-O 3.55Å; T578-I603 VanDerWaalsContact CA-O 3.27Å; T578-I603 WeakPolarHBondContact CA-O 3.48Å; Y579-I603 HydrophobicContact CD2-CB 4.44Å; Y579-I603 PolarHBondContact N-O 2.87Å; Y579-I603 PolarHBondContact O-N 3.38Å; L581-I603 HydrophobicContact CD1-CD1 3.53Å; L581-I603 HydrophobicContact CD2-CD1 4.41Å; L581-I603 HydrophobicContact CG-CD1 3.8Å; V601-I603 HydrophobicContact CG1-CD1 4.3Å; V601-I603 HydrophobicContact CG1-CG1 3.86Å
604	E	91.4	Very high	80.3	Confident	84 Å²	84	69.8 Å²	69.8	39%	0.393	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.6	172.3	-176.4	177.6	179.3	0	0	110.6	V516 Y517 V518 T578 L606	V516-E604 PolarHBondContact O-N 2.87Å; Y517-E604 HydrophobicContact CD1-CB 4.03Å; Y517-E604 HydrophobicContact CE1-CB 4.23Å; Y517-E604 WeakPolarHBondContact CE1-OE2 2.94Å; V518-E604 PolarHBondContact N-O 2.9Å; T578-E604 HydrophobicContact CG2-CG 4.4Å; E604-L606 HydrophobicContact CG-CD2 4.01Å
605	V	90	Very high	78.6	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.006	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	109	178.8	-174.2	0	0	0	0	111	V518 T520 L573 I574 G576 Q577 Y579	V518-V605 HydrophobicContact CG2-CB 4.27Å; V518-V605 HydrophobicContact CG2-CG1 4.5Å; V518-V605 HydrophobicContact CG2-CG2 3.77Å; V518-V605 CarbonylContact O-C 3.6Å; V518-V605 WeakPolarHBondContact O-CA 3.23Å; T520-V605 HydrophobicContact CG2-CG1 3.49Å; T520-V605 VanDerWaalsContact CG2-CG1 3.49Å; L573-V605 HydrophobicContact CB-CG1 3.85Å; L573-V605 HydrophobicContact CD2-CG2 4.46Å; I574-V605 WeakPolarHBondContact O-CB 3.3Å; I574-V605 WeakPolarHBondContact O-CG1 3.45Å; G576-V605 PolarHBondContact N-O 2.95Å; Q577-V605 HydrophobicContact CB-CG2 4.16Å; Q577-V605 WeakPolarHBondContact O-CG2 3.33Å; Q577-V605 PolarHBondContact O-N 2.03Å; Y579-V605 HydrophobicContact CD2-CG2 4.4Å; Y579-V605 HydrophobicContact CE2-CG2 3.8Å
606	L	85.7	Confident	77.3	Confident	45 Å²	45	74.2 Å²	74.2	24%	0.236	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	157.3	179.9	-60.3	-175.5	0	0	0	112.8	Y517 V518 Y519 T520 E604	Y517-L606 HydrophobicContact CD1-CD1 3.76Å; Y517-L606 HydrophobicContact CD1-CG 4.17Å; Y517-L606 HydrophobicContact CG-CD1 3.99Å; V518-L606 PolarHBondContact O-N 2.81Å; Y519-L606 WeakPolarHBondContact CA-O 3.41Å; Y519-L606 HydrophobicContact CD1-CB 3.76Å; Y519-L606 HydrophobicContact CD1-CD1 4.47Å; Y519-L606 HydrophobicContact CE1-CB 3.95Å; Y519-L606 HydrophobicContact CE1-CD1 3.83Å; Y519-L606 HydrophobicContact CE1-CG 4.5Å; T520-L606 PolarHBondContact N-O 3.23Å; T520-L606 VanDerWaalsContact N-O 3.12Å; E604-L606 HydrophobicContact CG-CD2 4.01Å
607	P	81	Confident	76	Confident	77 Å²	77	74.3 Å²	74.3	50%	0.5	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-61.4	161.2	169.5	-16.7	29.5	0	0	0	112.3	Y519 V575 N609	Y519-P607 WeakPolarHBondContact CD1-O 3.33Å; V575-P607 HydrophobicContact CG1-CG 3.87Å; V575-P607 HydrophobicContact CG2-CB 4.49Å; V575-P607 HydrophobicContact CG2-CG 4.46Å; P607-N609 PolarHBondContact O-N 2.9Å
608	P	75.9	Confident	74.7	Confident	61 Å²	61	78.5 Å²	78.5	40%	0.396	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-52.1	137.4	-175.2	-28.8	37.5	0	0	0	114.2	T520 D521 N610	T520-P608 VanDerWaalsContact OG1-CD 3.31Å; T520-P608 WeakPolarHBondContact OG1-CD 3.49Å; D521-P608 HydrophobicContact CB-CB 3.98Å; D521-P608 HydrophobicContact CB-CG 4.29Å; D521-P608 WeakPolarHBondContact OD1-CA 3.42Å; P608-N610 PolarHBondContact O-N 3.42Å
609	N	63.6	Low	73.4	Confident	73 Å²	73	82.8 Å²	82.8	39%	0.39	43%	0.433	S	S	.	.			trans	-76.3	90	-175.2	-173.3	4.3	0	0	0	111.9	Y519 P607 Q611	Y519-N609 HydrophobicContact CD1-CB 3.95Å; Y519-N609 HydrophobicContact CD2-CB 4.48Å; Y519-N609 HydrophobicContact CE1-CB 3.98Å; Y519-N609 HydrophobicContact CG-CB 4.21Å; P607-N609 PolarHBondContact O-N 2.9Å; N609-Q611 PolarHBondContact O-N 2.86Å; N609-Q611 VanDerWaalsContact O-N 3.09Å; N609-Q611 WeakPolarHBondContact OD1-CB 3.48Å; N609-Q611 PolarHBondContact OD1-N 3.39Å; N609-Q611 VanDerWaalsContact OD1-N 3.11Å
610	N	55.9	Low	71.9	Confident	160 Å²	160	90.6 Å²	90.6	86%	0.856	47%	0.471	S	S	*	.			trans	-72.4	8.7	177.8	-92.2	-28	0	0	0	115.1	P608	P608-N610 PolarHBondContact O-N 3.42Å
611	Q	50.9	Low	70.9	Confident	161 Å²	161	92.8 Å²	92.8	75%	0.752	48%	0.476	S	S	*	.			trans	-91.4	114	174.5	-61.5	-171.4	3.6	0	0	111	N609	N609-Q611 PolarHBondContact O-N 2.86Å; N609-Q611 VanDerWaalsContact O-N 3.09Å; N609-Q611 WeakPolarHBondContact OD1-CB 3.48Å; N609-Q611 PolarHBondContact OD1-N 3.39Å; N609-Q611 VanDerWaalsContact OD1-N 3.11Å
612	S	47.7	Very low	69.6	Low	71 Å²	71	98.7 Å²	98.7	50%	0.497	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-69	139.7	171.3	-64.4	0	0	0	0	110.6
613	P	51.3	Low	68.5	Low	107 Å²	107	97.3 Å²	97.3	70%	0.695	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-63.6	140.2	-177.2	23.9	-33.4	0	0	0	112.1
614	P	53.5	Low	67.4	Low	57 Å²	57	106.6 Å²	106.6	37%	0.37	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-66.9	135.9	-175.3	25.7	-34.3	0	0	0	112	F616 H640	P614-F616 HydrophobicContact CG-CE2 4.36Å; P614-H640 HydrophobicContact CB-CB 3.84Å; P614-H640 VanDerWaalsContact CB-CD2 3.48Å; P614-H640 WeakPolarHBondContact CB-CD2 3.26Å
615	R	57.1	Low	66.3	Low	188 Å²	188	105.9 Å²	105.9	71%	0.709	56%	0.562	S	S	*	*	B	Isolated β-bridge	trans	-87.4	117.8	174.8	-81.5	-171.6	167.1	-150	-4.1	111.5	H640 R641	R615-H640 WeakPolarHBondContact O-CA 3.35Å; R615-H640 WeakPolarHBondContact O-CB 3.39Å; R615-R641 PolarHBondContact N-O 3.31Å; R615-R641 VanDerWaalsContact N-O 3.14Å; R615-R641 PolarHBondContact O-N 2.87Å
616	F	65.7	Low	65.5	Low	97 Å²	97	109.6 Å²	109.6	43%	0.425	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-82.9	148	166.9	-64.3	-82.5	0	0	0	111.2	P614 Q618 L638 H640	P614-F616 HydrophobicContact CG-CE2 4.36Å; F616-Q618 PolarHBondContact O-N 2.85Å; F616-L638 HydrophobicContact CD1-CB 4.33Å; F616-L638 HydrophobicContact CD1-CD1 4.32Å; F616-L638 HydrophobicContact CE1-CB 4.05Å; F616-L638 HydrophobicContact CE1-CD1 4.03Å; F616-H640 HydrophobicContact CD1-CB 4.11Å; F616-H640 HydrophobicContact CE1-CB 4.06Å; F616-H640 HydrophobicContact CZ-CB 4.46Å
617	P	67.4	Low	64.6	Low	104 Å²	104	117.1 Å²	117.1	68%	0.675	62%	0.622	S	S	*	*	S	Bend	trans	-74.2	-17.5	-177.8	27.7	-35.6	0	0	0	115.1	Y621 Q639	P617-Y621 WeakPolarHBondContact CD-OH 3.35Å; P617-Q639 VanDerWaalsContact CD-O 3.25Å; P617-Q639 WeakPolarHBondContact CD-O 3.26Å
618	Q	68.4	Low	64.2	Low	117 Å²	117	117.3 Å²	117.3	55%	0.547	63%	0.63	S	S	.	*			trans	-129.9	145.8	176.4	-62.4	-179.5	-53.6	0	0	110.2	F616 Y621	F616-Q618 PolarHBondContact O-N 2.85Å; Q618-Y621 HydrophobicContact CB-CD1 4.48Å; Q618-Y621 HydrophobicContact CB-CE1 3.91Å; Q618-Y621 HydrophobicContact CB-CE2 4.31Å; Q618-Y621 HydrophobicContact CG-CE1 4.29Å; Q618-Y621 PolarHBondContact N-OH 2.84Å
619	L	67.9	Low	63.9	Low	185 Å²	185	118 Å²	118	97%	0.969	63%	0.629	S	S	*	*	S	Bend	trans	-77.4	-24.7	174.7	-88.9	102.2	0	0	0	113.4
620	M	62	Low	64.2	Low	167 Å²	167	124.7 Å²	124.7	82%	0.823	65%	0.648	S	S	*	*			trans	-139.4	143.2	178	-68.1	-169.3	-71.1	0	0	109.5
621	Y	72.6	Confident	64.6	Low	81 Å²	81	123.8 Å²	123.8	32%	0.318	64%	0.642	S	S	.	*			trans	-122.2	129.2	170.7	-60.2	-88.3	0	0	0	107.4	P617 Q618 L636 L638	P617-Y621 WeakPolarHBondContact CD-OH 3.35Å; Q618-Y621 HydrophobicContact CB-CD1 4.48Å; Q618-Y621 HydrophobicContact CB-CE1 3.91Å; Q618-Y621 HydrophobicContact CB-CE2 4.31Å; Q618-Y621 HydrophobicContact CG-CE1 4.29Å; Q618-Y621 PolarHBondContact N-OH 2.84Å; Y621-L636 HydrophobicContact CD1-CD2 3.76Å; Y621-L636 HydrophobicContact CD2-CD2 4.43Å; Y621-L636 HydrophobicContact CG-CD2 3.71Å; Y621-L638 HydrophobicContact CD1-CD2 3.94Å; Y621-L638 HydrophobicContact CD2-CD2 4.04Å; Y621-L638 HydrophobicContact CE1-CD2 3.48Å; Y621-L638 VanDerWaalsContact CE1-CD2 3.48Å; Y621-L638 HydrophobicContact CE2-CD1 4.49Å; Y621-L638 HydrophobicContact CE2-CD2 3.62Å; Y621-L638 HydrophobicContact CG-CD2 4.2Å
622	S	67.2	Low	65.3	Low	123 Å²	123	117.1 Å²	117.1	86%	0.86	62%	0.617	S	S	*	*			trans	-111.2	141.6	173.7	-178.4	0	0	0	0	108.9
623	L	70.6	Confident	66.3	Low	83 Å²	83	115.1 Å²	115.1	44%	0.435	61%	0.605	S	S	.	*			trans	-149	129.7	-177.1	-145.5	108.1	0	0	0	109.5	V625 L635 L636	L623-V625 HydrophobicContact CD2-CG2 4.04Å; L623-L635 WeakPolarHBondContact CD1-O 3.42Å; L623-L635 HydrophobicContact CD2-CB 4.15Å; L623-L635 HydrophobicContact CD2-CD2 4.38Å; L623-L635 WeakPolarHBondContact CD2-O 2.96Å; L623-L636 HydrophobicContact CD1-CB 4.39Å; L623-L636 HydrophobicContact CD1-CD1 4.05Å
624	E	69.6	Low	67.1	Low	196 Å²	196	114.3 Å²	114.3	92%	0.916	59%	0.594	S	S	*	*			trans	-83.2	133.6	169.2	-69.4	177	176.1	0	0	109.5
625	V	69.3	Low	67.9	Low	69 Å²	69	113.8 Å²	113.8	42%	0.418	59%	0.588	S	S	.	*			trans	-127.5	127.6	-178.3	-177.1	0	0	0	0	108.5	L623 M629 L635	L623-V625 HydrophobicContact CD2-CG2 4.04Å; V625-M629 HydrophobicContact CG1-CB 4.25Å; V625-M629 HydrophobicContact CG1-SD 3.88Å; V625-L635 HydrophobicContact CG1-CD2 4.43Å; V625-L635 HydrophobicContact CG2-CD2 4Å
626	S	72	Confident	68.6	Low	80 Å²	80	107 Å²	107	56%	0.559	57%	0.565	S	S	*	*			trans	-82.1	142.9	175.9	176.2	0	0	0	0	110.9	A628 M629	S626-A628 PolarHBondContact O-N 3.34Å; S626-A628 VanDerWaalsContact O-N 3.1Å; S626-A628 PolarHBondContact OG-N 2.9Å; S626-M629 WeakPolarHBondContact O-CB 3.21Å; S626-M629 PolarHBondContact O-N 3.16Å
627	E	66.6	Low	68.5	Low	202 Å²	202	106.7 Å²	106.7	94%	0.944	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-26.2	173.9	71.6	175.6	-133.2	0	0	113.2	M629	E627-M629 PolarHBondContact O-N 2.92Å
628	A	72.5	Confident	68.4	Low	82 Å²	82	102.9 Å²	102.9	68%	0.678	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	2.2	179.2	0	0	0	0	0	113.7	S626 R630	S626-A628 PolarHBondContact O-N 3.34Å; S626-A628 VanDerWaalsContact O-N 3.1Å; S626-A628 PolarHBondContact OG-N 2.9Å; A628-R630 PolarHBondContact O-N 3.04Å
629	M	70.8	Confident	68	Low	74 Å²	74	101.6 Å²	101.6	37%	0.365	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-77.1	120.9	-176.5	-166.2	155.3	179.6	0	0	111.3	V625 S626 E627 A633 L635	V625-M629 HydrophobicContact CG1-CB 4.25Å; V625-M629 HydrophobicContact CG1-SD 3.88Å; S626-M629 WeakPolarHBondContact O-CB 3.21Å; S626-M629 PolarHBondContact O-N 3.16Å; E627-M629 PolarHBondContact O-N 2.92Å; M629-A633 HydrophobicContact CE-CB 3.47Å; M629-A633 VanDerWaalsContact CE-CB 3.47Å; M629-A633 HydrophobicContact CG-CB 3.9Å; M629-L635 HydrophobicContact CE-CD2 3.8Å; M629-L635 HydrophobicContact SD-CD2 4.16Å
630	R	70.2	Confident	67.5	Low	214 Å²	214	93.9 Å²	93.9	81%	0.808	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-67.1	142.4	-176.8	-64.9	-176	-177	-179.2	0.6	112.5	A628 G632 A633	A628-R630 PolarHBondContact O-N 3.04Å; R630-G632 PolarHBondContact O-N 3.41Å; R630-A633 VanDerWaalsContact O-CB 3.29Å; R630-A633 WeakPolarHBondContact O-CB 3.04Å; R630-A633 PolarHBondContact O-N 2.84Å; R630-A633 VanDerWaalsContact O-N 3.1Å
631	I	63.5	Low	67.2	Low	141 Å²	141	95.9 Å²	95.9	72%	0.723	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	133.8	166.9	-58.2	173.2	0	0	0	109.7
632	G	64.8	Low	66	Low	22 Å²	22	96 Å²	96	23%	0.227	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	4	-178.1	0	0	0	0	0	116	R630 R665 W666	R630-G632 PolarHBondContact O-N 3.41Å; G632-R665 WeakPolarHBondContact O-CG 3.49Å; G632-R665 PolarHBondContact O-NE 3.46Å; G632-R665 PolarHBondContact O-NH2 3.4Å; G632-W666 PolarHBondContact N-O 3.39Å; G632-W666 VanDerWaalsContact N-O 3.11Å
633	A	69.4	Low	65.1	Low	29 Å²	29	93 Å²	93	24%	0.24	48%	0.478	C	S	.	.			trans	-67	149.4	167.5	0	0	0	0	0	111.8	M629 R630 R665 W666	M629-A633 HydrophobicContact CE-CB 3.47Å; M629-A633 VanDerWaalsContact CE-CB 3.47Å; M629-A633 HydrophobicContact CG-CB 3.9Å; R630-A633 VanDerWaalsContact O-CB 3.29Å; R630-A633 WeakPolarHBondContact O-CB 3.04Å; R630-A633 PolarHBondContact O-N 2.84Å; R630-A633 VanDerWaalsContact O-N 3.1Å; A633-R665 WeakPolarHBondContact O-CA 3.33Å; A633-R665 WeakPolarHBondContact O-CG 3.46Å; A633-W666 PolarHBondContact O-N 2.64Å; A633-W666 VanDerWaalsContact O-N 3.09Å
634	I	67.3	Low	63.9	Low	90 Å²	90	95.5 Å²	95.5	46%	0.462	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.4	175.7	-62.4	172.4	0	0	0	108.3	L664	I634-L664 WeakPolarHBondContact CA-O 3.15Å
635	L	70.2	Confident	62.6	Low	46 Å²	46	91 Å²	91	24%	0.241	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-45.3	-178.6	-60.9	167.1	0	0	0	111.4	L623 V625 M629 L664 W666	L623-L635 WeakPolarHBondContact CD1-O 3.42Å; L623-L635 HydrophobicContact CD2-CB 4.15Å; L623-L635 HydrophobicContact CD2-CD2 4.38Å; L623-L635 WeakPolarHBondContact CD2-O 2.96Å; V625-L635 HydrophobicContact CG1-CD2 4.43Å; V625-L635 HydrophobicContact CG2-CD2 4Å; M629-L635 HydrophobicContact CE-CD2 3.8Å; M629-L635 HydrophobicContact SD-CD2 4.16Å; L635-L664 PolarHBondContact N-O 3.12Å; L635-W666 HydrophobicContact CD1-CB 4.36Å; L635-W666 HydrophobicContact CD1-CG 4.38Å
636	L	71.6	Confident	61.3	Low	45 Å²	45	99.2 Å²	99.2	24%	0.236	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	137.9	-172.6	-171.3	62.3	0	0	0	110.6	Y621 L623 L638 L664	Y621-L636 HydrophobicContact CD1-CD2 3.76Å; Y621-L636 HydrophobicContact CD2-CD2 4.43Å; Y621-L636 HydrophobicContact CG-CD2 3.71Å; L623-L636 HydrophobicContact CD1-CB 4.39Å; L623-L636 HydrophobicContact CD1-CD1 4.05Å; L636-L638 HydrophobicContact CD2-CD2 3.55Å; L636-L638 HydrophobicContact CD2-CG 4.01Å; L636-L638 HydrophobicContact CG-CD2 3.93Å; L636-L638 HydrophobicContact CG-CG 4.16Å; L636-L664 HydrophobicContact CB-CB 4.44Å; L636-L664 HydrophobicContact CB-CD1 4.3Å; L636-L664 HydrophobicContact CD2-CD1 4.43Å; L636-L664 PolarHBondContact O-N 2.84Å
637	N	64.9	Low	59.5	Low	91 Å²	91	105.2 Å²	105.2	49%	0.487	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	106.8	170.4	-82.4	-39.9	0	0	0	109.1	S663	N637-S663 WeakPolarHBondContact OD1-CB 3.42Å; N637-S663 PolarHBondContact OD1-OG 3.12Å
638	L	64.4	Low	58.4	Low	23 Å²	23	99.4 Å²	99.4	12%	0.12	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	135.7	177.9	-67.7	178.7	0	0	0	110.8	F616 Y621 L636 H662 L664	F616-L638 HydrophobicContact CD1-CB 4.33Å; F616-L638 HydrophobicContact CD1-CD1 4.32Å; F616-L638 HydrophobicContact CE1-CB 4.05Å; F616-L638 HydrophobicContact CE1-CD1 4.03Å; Y621-L638 HydrophobicContact CD1-CD2 3.94Å; Y621-L638 HydrophobicContact CD2-CD2 4.04Å; Y621-L638 HydrophobicContact CE1-CD2 3.48Å; Y621-L638 VanDerWaalsContact CE1-CD2 3.48Å; Y621-L638 HydrophobicContact CE2-CD1 4.49Å; Y621-L638 HydrophobicContact CE2-CD2 3.62Å; Y621-L638 HydrophobicContact CG-CD2 4.2Å; L636-L638 HydrophobicContact CD2-CD2 3.55Å; L636-L638 HydrophobicContact CD2-CG 4.01Å; L636-L638 HydrophobicContact CG-CD2 3.93Å; L636-L638 HydrophobicContact CG-CG 4.16Å; L638-H662 PolarHBondContact N-O 2.73Å; L638-H662 PolarHBondContact O-N 3.38Å; L638-L664 HydrophobicContact CD1-CD1 3.68Å; L638-L664 HydrophobicContact CD1-CG 4.44Å; L638-L664 HydrophobicContact CG-CD1 4.29Å
639	Q	61.3	Low	56.9	Low	91 Å²	91	100.5 Å²	100.5	43%	0.425	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.8	167.3	-69.9	-171.6	-47.5	0	0	108.5	P617 R661	P617-Q639 VanDerWaalsContact CD-O 3.25Å; P617-Q639 WeakPolarHBondContact CD-O 3.26Å; Q639-R661 HydrophobicContact CG-CG 3.88Å
640	H	57.3	Low	55.3	Low	23 Å²	23	108.7 Å²	108.7	11%	0.106	54%	0.542	C	S	.	.			trans	-110.4	164.4	170.1	59	-101.1	0	0	0	110.4	P614 R615 F616 D642 H662	P614-H640 HydrophobicContact CB-CB 3.84Å; P614-H640 VanDerWaalsContact CB-CD2 3.48Å; P614-H640 WeakPolarHBondContact CB-CD2 3.26Å; R615-H640 WeakPolarHBondContact O-CA 3.35Å; R615-H640 WeakPolarHBondContact O-CB 3.39Å; F616-H640 HydrophobicContact CD1-CB 4.11Å; F616-H640 HydrophobicContact CE1-CB 4.06Å; F616-H640 HydrophobicContact CZ-CB 4.46Å; H640-D642 IonicContact CD2-OD1 3.74Å; H640-H662 AromaticContact CE1-CD2 3.66Å; H640-H662 AromaticContact CE1-NE2 3.84Å
641	R	54.2	Low	53.8	Low	209 Å²	209	103.7 Å²	103.7	79%	0.789	54%	0.537	S	S	*	.	B	Isolated β-bridge	trans	-121.8	133	165.2	-74.1	-176.4	177	177.6	-0.2	109.2	R615 S643	R615-R641 PolarHBondContact N-O 3.31Å; R615-R641 VanDerWaalsContact N-O 3.14Å; R615-R641 PolarHBondContact O-N 2.87Å; R641-S643 PolarHBondContact O-N 2.97Å
642	D	49	Very low	52.7	Low	84 Å²	84	108.5 Å²	108.5	45%	0.449	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-71.2	125.3	165.7	-59.8	-24.3	0	0	0	108.7	H640	H640-D642 IonicContact CD2-OD1 3.74Å
643	S	48.3	Very low	51.6	Low	58 Å²	58	116.6 Å²	116.6	41%	0.406	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-76.1	126.5	168.8	48.2	0	0	0	0	109.4	R641	R641-S643 PolarHBondContact O-N 2.97Å
644	Q	45	Very low	50.2	Low	136 Å²	136	121.9 Å²	121.9	64%	0.636	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-50.1	146.9	175	-72.6	-103.7	9.9	0	0	111.9
645	P	43	Very low	49	Very low	101 Å²	101	128.4 Å²	128.4	66%	0.656	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-58.2	151.1	174.6	-21.2	32.6	0	0	0	112
646	R	40.1	Very low	47.6	Very low	242 Å²	242	131.3 Å²	131.3	91%	0.913	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-58.2	144.9	177.2	-87.3	178.1	164.3	168	-5.2	112.1	G648	R646-G648 PolarHBondContact O-N 3.44Å
647	E	35.5	Very low	46.2	Very low	206 Å²	206	135.6 Å²	135.6	96%	0.963	66%	0.66	S	S	*	*	S	Bend	trans	-53.2	114.1	-178.9	-162.6	164	-151.4	0	0	112.2
648	G	44	Very low	45.3	Very low	81 Å²	81	138.2 Å²	138.2	84%	0.835	67%	0.669	S	S	*	*			trans	175.6	-26.2	-177.9	0	0	0	0	0	116.3	R646	R646-G648 PolarHBondContact O-N 3.44Å
649	S	40.5	Very low	44.3	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	69%	0.692	S	S	*	*	S	Bend	trans	-108.3	133.2	179.6	46.4	0	0	0	0	112.3
650	R	37.8	Very low	43.6	Very low	246 Å²	246	142 Å²	142	93%	0.928	69%	0.694	S	S	*	*			trans	-72	139.1	-175.7	-68.2	178.3	177.3	174.9	-1.1	111.6
651	P	37.6	Very low	42.9	Very low	109 Å²	109	149.6 Å²	149.6	71%	0.708	72%	0.722	S	S	*	*			trans	-81.7	141.8	-171.7	32	-35.7	0	0	0	113.6
652	R	40.8	Very low	42.8	Very low	243 Å²	243	145.1 Å²	145.1	92%	0.917	71%	0.709	S	S	*	*			trans	-136.2	123	154.9	-81.7	-170.9	170.6	-175.9	-3.3	109.6
653	E	40.9	Very low	42.7	Very low	192 Å²	192	144.1 Å²	144.1	90%	0.897	71%	0.709	S	S	*	*			trans	53.3	86.9	164.1	-62.1	-176.9	159.4	0	0	118.1
654	H	40.9	Very low	42.8	Very low	140 Å²	140	144.6 Å²	144.6	65%	0.648	71%	0.707	S	S	*	*			trans	-73.8	125.2	165.5	-72.1	-68.3	0	0	0	112.3
655	R	41.9	Very low	43.1	Very low	227 Å²	227	145.4 Å²	145.4	86%	0.857	70%	0.704	S	S	*	*			trans	-82.9	148.4	148.1	-64.1	-175.1	-168.3	-160.5	3.5	109	L657	R655-L657 PolarHBondContact O-N 3.46Å; R655-L657 VanDerWaalsContact O-N 3.15Å
656	P	41.1	Very low	43	Very low	107 Å²	107	146.3 Å²	146.3	70%	0.695	69%	0.694	S	S	*	*			trans	-72.5	107.2	176.4	28.6	-33.1	0	0	0	110.9	H658	P656-H658 PolarHBondContact O-N 2.82Å; P656-H658 PolarHBondContact O-ND1 2.92Å
657	L	41.7	Very low	43.2	Very low	134 Å²	134	140.7 Å²	140.7	70%	0.702	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-54	124.4	168.5	-80.2	145.2	0	0	0	109.8	R655	R655-L657 PolarHBondContact O-N 3.46Å; R655-L657 VanDerWaalsContact O-N 3.15Å
658	H	46.2	Very low	43.4	Very low	146 Å²	146	137.2 Å²	137.2	68%	0.676	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-84.1	144.9	177.3	-72.7	21.8	0	0	0	109.7	P656 H660	P656-H658 PolarHBondContact O-N 2.82Å; P656-H658 PolarHBondContact O-ND1 2.92Å; H658-H660 PolarHBondContact O-N 2.82Å
659	P	42.9	Very low	42.9	Very low	91 Å²	91	137 Å²	137	59%	0.591	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-66.7	116.9	176.9	27	-33.5	0	0	0	110.4
660	H	46.6	Very low	42.4	Very low	102 Å²	102	141.8 Å²	141.8	47%	0.472	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-67.2	134.5	172.6	-71.1	-73.3	0	0	0	110.5	H658	H658-H660 PolarHBondContact O-N 2.82Å
661	R	43.5	Very low	42	Very low	183 Å²	183	138.7 Å²	138.7	69%	0.691	67%	0.673	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.5	128.6	172.3	-83.4	-178	172.3	179	-2.2	108.5	Q639	Q639-R661 HydrophobicContact CG-CG 3.88Å
662	H	52.5	Low	42.2	Very low	115 Å²	115	138.9 Å²	138.9	53%	0.532	67%	0.668	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.8	134.6	165.9	-72.4	-102.2	0	0	0	109.3	L638 H640	L638-H662 PolarHBondContact N-O 2.73Å; L638-H662 PolarHBondContact O-N 3.38Å; H640-H662 AromaticContact CE1-CD2 3.66Å; H640-H662 AromaticContact CE1-NE2 3.84Å
663	S	45.3	Very low	42.1	Very low	63 Å²	63	135.9 Å²	135.9	44%	0.441	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	115.6	175.1	-58.8	0	0	0	0	108.7	N637 R665	N637-S663 WeakPolarHBondContact OD1-CB 3.42Å; N637-S663 PolarHBondContact OD1-OG 3.12Å; S663-R665 PolarHBondContact O-N 2.88Å
664	L	51.1	Low	42.1	Very low	68 Å²	68	131.5 Å²	131.5	36%	0.356	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.9	127.4	167.7	-81.2	163.8	0	0	0	108.7	I634 L635 L636 L638 L672	I634-L664 WeakPolarHBondContact CA-O 3.15Å; L635-L664 PolarHBondContact N-O 3.12Å; L636-L664 HydrophobicContact CB-CB 4.44Å; L636-L664 HydrophobicContact CB-CD1 4.3Å; L636-L664 HydrophobicContact CD2-CD1 4.43Å; L636-L664 PolarHBondContact O-N 2.84Å; L638-L664 HydrophobicContact CD1-CD1 3.68Å; L638-L664 HydrophobicContact CD1-CG 4.44Å; L638-L664 HydrophobicContact CG-CD1 4.29Å; L664-L672 HydrophobicContact CD2-CD1 4.23Å
665	R	50.4	Low	42.2	Very low	154 Å²	154	133.3 Å²	133.3	58%	0.581	67%	0.668	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-125.8	138	-173.4	-154.1	178.9	-164	180	2.9	109.1	G632 A633 S663 Q667	G632-R665 WeakPolarHBondContact O-CG 3.49Å; G632-R665 PolarHBondContact O-NE 3.46Å; G632-R665 PolarHBondContact O-NH2 3.4Å; A633-R665 WeakPolarHBondContact O-CA 3.33Å; A633-R665 WeakPolarHBondContact O-CG 3.46Å; S663-R665 PolarHBondContact O-N 2.88Å; R665-Q667 PolarHBondContact O-N 2.68Å; R665-Q667 VanDerWaalsContact O-N 3.08Å
666	W	42.2	Very low	42.2	Very low	119 Å²	119	127.7 Å²	127.7	45%	0.451	66%	0.662	S	S	.	*			trans	-69.3	108.4	179.6	-142.3	94.4	0	0	0	109.8	G632 A633 L635	G632-W666 PolarHBondContact N-O 3.39Å; G632-W666 VanDerWaalsContact N-O 3.11Å; A633-W666 PolarHBondContact O-N 2.64Å; A633-W666 VanDerWaalsContact O-N 3.09Å; L635-W666 HydrophobicContact CD1-CB 4.36Å; L635-W666 HydrophobicContact CD1-CG 4.38Å
667	Q	45	Very low	42.3	Very low	125 Å²	125	130.9 Å²	130.9	58%	0.584	67%	0.667	S	S	*	*			trans	-141.4	138	175.6	-73.7	-173.5	-63.5	0	0	109.2	R665	R665-Q667 PolarHBondContact O-N 2.68Å; R665-Q667 VanDerWaalsContact O-N 3.08Å
668	T	38.3	Very low	42.3	Very low	132 Å²	132	133.4 Å²	133.4	81%	0.81	68%	0.675	S	S	*	*	S	Bend	trans	-68.3	123.6	165.6	48.2	0	0	0	0	109.2
669	G	33.4	Very low	42	Very low	76 Å²	76	132.4 Å²	132.4	78%	0.784	69%	0.685	S	S	*	*			trans	126.5	18	173.6	0	0	0	0	0	117.9
670	W	29.6	Very low	41.8	Very low	205 Å²	205	131.6 Å²	131.6	78%	0.777	69%	0.693	S	S	*	*			trans	-122.3	126.4	168.7	-73.9	83.6	0	0	0	111	L672	W670-L672 VanDerWaalsContact C-N 3.29Å; W670-L672 PolarHBondContact O-N 3.48Å
671	N	31.2	Very low	41.5	Very low	181 Å²	181	135.1 Å²	135.1	97%	0.968	72%	0.715	S	S	*	*			trans	-72.4	82	172.2	-84.6	-13	0	0	0	110.9
672	L	40.4	Very low	41.2	Very low	114 Å²	114	129.2 Å²	129.2	60%	0.597	71%	0.711	S	S	*	*			trans	-99.7	125	161.3	-85.8	156.6	0	0	0	108.3	L664 W670 C674	L664-L672 HydrophobicContact CD2-CD1 4.23Å; W670-L672 VanDerWaalsContact C-N 3.29Å; W670-L672 PolarHBondContact O-N 3.48Å; L672-C674 PolarHBondContact O-N 3.46Å
673	N	38.7	Very low	40.4	Very low	180 Å²	180	135.8 Å²	135.8	96%	0.963	73%	0.731	S	S	*	*			trans	-68.2	82.8	170.8	-93.8	-0.4	0	0	0	109.8
674	C	41.6	Very low	39.9	Very low	99 Å²	99	145.7 Å²	145.7	67%	0.669	77%	0.771	S	S	*	*			trans	-92.3	117.1	171.1	-70.5	0	0	0	0	109.2	L672	L672-C674 PolarHBondContact O-N 3.46Å
675	H	43.3	Very low	39.3	Very low	179 Å²	179	149.6 Å²	149.6	83%	0.829	79%	0.791	S	S	*	*			trans	-91.9	114.7	169.4	-151.5	60	0	0	0	108
676	C	42.4	Very low	38.8	Very low	109 Å²	109	149.4 Å²	149.4	74%	0.736	80%	0.802	S	S	*	*			trans	-111.2	111.6	179.6	-64.8	0	0	0	0	109.4
677	E	42.3	Very low	38.6	Very low	173 Å²	173	151.1 Å²	151.1	81%	0.808	82%	0.822	S	S	*	*			trans	-90.8	113.2	169.2	-72.6	-176.4	133.7	0	0	109.6	S679	E677-S679 PolarHBondContact O-N 2.95Å
678	H	42	Very low	38.2	Very low	188 Å²	188	152.6 Å²	152.6	87%	0.87	84%	0.836	S	S	*	*			trans	-77	117	168.6	-99.9	-78.2	0	0	0	109.9
679	S	39.1	Very low	38.2	Very low	124 Å²	124	153.9 Å²	153.9	87%	0.867	84%	0.838	S	S	*	*			trans	-110.3	99.1	166	46.1	0	0	0	0	109.1	E677	E677-S679 PolarHBondContact O-N 2.95Å
680	G	40.1	Very low	38.5	Very low	74 Å²	74	159.1 Å²	159.1	76%	0.763	84%	0.841	S	S	*	*			trans	-161.7	104.4	-176.2	0	0	0	0	0	111.2
681	D	40	Very low	39.1	Very low	177 Å²	177	155.8 Å²	155.8	95%	0.947	85%	0.846	S	S	*	*			trans	-86.6	140.8	174.2	-176.1	15.7	0	0	0	109.9
682	G	36.2	Very low	39.8	Very low	58 Å²	58	153.8 Å²	153.8	60%	0.598	84%	0.836	S	S	*	*			trans	115.9	92.2	162.3	0	0	0	0	0	118.8
683	R	37.1	Very low	39.7	Very low	253 Å²	253	157.2 Å²	157.2	96%	0.955	86%	0.856	S	S	*	*			trans	77.4	134	148.3	-56.8	-178.9	-178.1	-173.3	-1	118.6
684	Q	33.8	Very low	39.8	Very low	272 Å²	272	155.1 Å²	155.1	100%	1.271	85%	0.847	S	S	*	*			trans	-63.8	0	169.7	-65.8	172.8	-41	0	0	111.9

Retrieved 684 of 684 residues in 442.4 ms (Link to these results)

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