A0A2K5X4V4_MACFA Loading...

Motile sperm domain-containing protein 1

Plays a role in differentiation and/or proliferation of mesenchymal stem cells. Proposed to be involved in epithelial-to-mesenchymal transition (EMT). However, another study suggests that it is not required for EMT or stem cell self-renewal and acts during later stages of differentiation.

AlphaFold DB , UniProt , Accession A0A2K5X4V4, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene n/a, Length 214 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	37.7	Very low	49.5	Very low	242 Å²	242	169 Å²	169	100%	1.192	80%	0.802	S	S	*	*				0	113.3	0	-72.1	-159.9	163.5	0	0	108.1	Q3	M1-Q3 PolarHBondContact O-N 2.84Å
2	H	40.5	Very low	50.8	Low	194 Å²	194	162.5 Å²	162.5	90%	0.898	77%	0.771	S	S	*	*			trans	-74.7	113.5	-178.5	-83.8	68.2	0	0	0	109.1	Q4	H2-Q4 PolarHBondContact O-N 3.02Å
3	Q	41.8	Very low	52.1	Low	195 Å²	195	152.8 Å²	152.8	91%	0.911	74%	0.741	S	S	*	*			trans	-75.2	92.3	178.6	-153.1	175.3	38.6	0	0	108	M1 K5	M1-Q3 PolarHBondContact O-N 2.84Å; Q3-K5 PolarHBondContact O-N 3.06Å
4	Q	45.8	Very low	54.2	Low	184 Å²	184	150.6 Å²	150.6	86%	0.86	73%	0.734	S	S	*	*			trans	-66.9	103.6	174.8	-164.3	150.4	-4.6	0	0	107.7	H2 R6	H2-Q4 PolarHBondContact O-N 3.02Å; Q4-R6 PolarHBondContact O-N 3.42Å
5	K	44.3	Very low	56.6	Low	195 Å²	195	141.3 Å²	141.3	85%	0.848	69%	0.689	S	S	*	*			trans	-51.6	106.4	170.6	-111.7	-179.3	177.2	-179.5	0	106.8	Q3 Q7	Q3-K5 PolarHBondContact O-N 3.06Å; K5-Q7 PolarHBondContact O-N 3.15Å
6	R	46.2	Very low	58.9	Low	245 Å²	245	136.9 Å²	136.9	93%	0.925	68%	0.675	S	S	*	*			trans	-61.7	101.6	170	-99.8	-172.1	-84	-174.4	-5.2	106.7	Q4	Q4-R6 PolarHBondContact O-N 3.42Å
7	Q	55.2	Low	61.1	Low	150 Å²	150	129.9 Å²	129.9	70%	0.701	64%	0.641	S	S	*	*			trans	-64.2	135.1	166.1	-71.9	-178.7	-9.5	0	0	107.1	K5 E9	K5-Q7 PolarHBondContact O-N 3.15Å; Q7-E9 PolarHBondContact O-N 2.94Å
8	P	55.4	Low	63.1	Low	108 Å²	108	128.2 Å²	128.2	70%	0.701	63%	0.63	S	S	*	*			trans	-58.7	127.8	176	23.6	-30.9	0	0	0	108.6	L10	P8-L10 PolarHBondContact O-N 3.31Å
9	E	56.6	Low	64.9	Low	186 Å²	186	122.5 Å²	122.5	87%	0.869	60%	0.603	S	S	*	*			trans	-62	105.6	174.4	-73.7	-179.2	172	0	0	108.3	Q7 V11	Q7-E9 PolarHBondContact O-N 2.94Å; E9-V11 PolarHBondContact O-N 3.26Å
10	L	59.4	Low	66.5	Low	64 Å²	64	123.9 Å²	123.9	34%	0.335	61%	0.606	S	S	.	*			trans	-67	105.7	176.4	-68.9	172.1	0	0	0	108.4	P8 L15 F46 L108	P8-L10 PolarHBondContact O-N 3.31Å; L10-L15 HydrophobicContact CD1-CD1 4.24Å; L10-L15 HydrophobicContact CD2-CD1 4Å; L10-F46 HydrophobicContact CD1-CE1 3.82Å; L10-F46 HydrophobicContact CD1-CE2 4.32Å; L10-F46 HydrophobicContact CD1-CZ 3.47Å; L10-F46 VanDerWaalsContact CD1-CZ 3.47Å; L10-L108 HydrophobicContact CB-CD1 4.39Å; L10-L108 HydrophobicContact CB-CD2 4.19Å; L10-L108 HydrophobicContact CD1-CD1 3.92Å
11	V	61.5	Low	68	Low	96 Å²	96	119.5 Å²	119.5	58%	0.582	59%	0.587	S	S	*	*			trans	-66.4	136.5	174.9	-177.7	0	0	0	0	109.2	E9 G13 N14	E9-V11 PolarHBondContact O-N 3.26Å; V11-G13 PolarHBondContact O-N 2.91Å; V11-N14 PolarHBondContact O-N 2.9Å
12	E	65.4	Low	70.7	Confident	91 Å²	91	112.5 Å²	112.5	43%	0.425	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-50.8	130.4	179.9	-171.2	175.8	-153.1	0	0	112.1	N14 K106 A107	E12-N14 VanDerWaalsContact C-N 3.32Å; E12-N14 PolarHBondContact O-N 3.01Å; E12-K106 HydrophobicContact CB-CD 4.5Å; E12-K106 HydrophobicContact CG-CD 4.47Å; E12-K106 HydrophobicContact CG-CG 4.09Å; E12-K106 VanDerWaalsContact OE1-CE 3.31Å; E12-K106 WeakPolarHBondContact OE1-CE 3.32Å; E12-K106 WeakPolarHBondContact OE1-CG 3.18Å; E12-K106 WeakPolarHBondContact OE2-CE 3.23Å; E12-K106 IonicContact OE2-NZ 3.06Å; E12-K106 PolarHBondContact OE2-NZ 2.66Å; E12-A107 WeakPolarHBondContact CG-O 3.37Å
13	G	67.6	Low	73.4	Confident	37 Å²	37	108 Å²	108	38%	0.381	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-6.9	174.9	0	0	0	0	0	116.3	V11 A107 L108	V11-G13 PolarHBondContact O-N 2.91Å; G13-A107 PolarHBondContact N-O 3.42Å; G13-L108 CarbonylContact C-O 3.55Å; G13-L108 VanDerWaalsContact C-O 3.25Å; G13-L108 VanDerWaalsContact CA-O 3.26Å; G13-L108 WeakPolarHBondContact CA-O 3.31Å; G13-L108 PolarHBondContact N-O 3.4Å
14	N	81.2	Confident	76.1	Confident	122 Å²	122	98.8 Å²	98.8	65%	0.652	49%	0.494	S	S	*	.			trans	-96.7	-3.5	-176.3	-71.1	-22.1	0	0	0	114.6	V11 E12 P16 L108	V11-N14 PolarHBondContact O-N 2.9Å; E12-N14 VanDerWaalsContact C-N 3.32Å; E12-N14 PolarHBondContact O-N 3.01Å; N14-P16 WeakPolarHBondContact O-CD 3.49Å; N14-L108 PolarHBondContact N-O 2.71Å
15	L	90.4	Very high	78.5	Confident	10 Å²	10	92 Å²	92	5%	0.052	46%	0.463	C	S	.	.	B	Isolated β-bridge	trans	-74.3	118.4	178.2	-169	71.3	0	0	0	109.8	L10 Y44 F46 L48 V99 L108 G109	L10-L15 HydrophobicContact CD1-CD1 4.24Å; L10-L15 HydrophobicContact CD2-CD1 4Å; L15-Y44 HydrophobicContact CD1-CD1 4.23Å; L15-Y44 HydrophobicContact CD1-CD2 4.34Å; L15-Y44 HydrophobicContact CD1-CE1 3.59Å; L15-Y44 HydrophobicContact CD1-CE2 3.73Å; L15-Y44 WeakPolarHBondContact CD1-OH 3.31Å; L15-Y44 HydrophobicContact CD2-CD2 4.32Å; L15-Y44 HydrophobicContact CD2-CE2 3.89Å; L15-Y44 HydrophobicContact CG-CE1 4.46Å; L15-Y44 HydrophobicContact CG-CE2 3.74Å; L15-F46 HydrophobicContact CD1-CZ 4.25Å; L15-F46 HydrophobicContact CD2-CE2 4.35Å; L15-F46 HydrophobicContact CD2-CZ 4.19Å; L15-L48 HydrophobicContact CD2-CD2 3.93Å; L15-V99 HydrophobicContact CD2-CG2 4.01Å; L15-L108 VanDerWaalsContact CB-C 3.49Å; L15-L108 HydrophobicContact CB-CB 3.92Å; L15-L108 WeakPolarHBondContact CB-O 3.24Å; L15-L108 HydrophobicContact CD2-CB 3.83Å; L15-L108 HydrophobicContact CD2-CD1 4.45Å; L15-L108 PolarHBondContact N-O 3.48Å; L15-G109 WeakPolarHBondContact O-CA 3.38Å
16	P	93.3	Very high	81	Confident	71 Å²	71	82.7 Å²	82.7	46%	0.461	42%	0.423	S	S	.	.			trans	-58.5	145.4	173.1	-24.8	35	0	0	0	112	N14 F18 Y44	N14-P16 WeakPolarHBondContact O-CD 3.49Å; P16-F18 HydrophobicContact CB-CE2 3.73Å; P16-F18 HydrophobicContact CB-CZ 3.77Å; P16-Y44 VanDerWaalsContact CD-OH 3.27Å; P16-Y44 WeakPolarHBondContact CD-OH 3.45Å; P16-Y44 PolarHBondContact O-OH 2.92Å
17	V	95.8	Very high	83.5	Confident	18 Å²	18	72.8 Å²	72.8	11%	0.109	39%	0.386	C	S	.	.			trans	-126.1	122.7	179.2	-178.9	0	0	0	0	108.4	V19 L40 V99 K111	V17-V19 HydrophobicContact CG1-CG1 4.1Å; V17-L40 HydrophobicContact CG1-CD1 3.68Å; V17-V99 HydrophobicContact CG1-CG1 4.04Å; V17-V99 HydrophobicContact CG2-CB 4.46Å; V17-V99 HydrophobicContact CG2-CG1 4.19Å; V17-V99 HydrophobicContact CG2-CG2 3.45Å; V17-V99 VanDerWaalsContact CG2-CG2 3.45Å; V17-K111 HydrophobicContact CB-CB 3.83Å; V17-K111 HydrophobicContact CG1-CB 3.87Å
18	F	97	Very high	85.4	Confident	100 Å²	100	66.5 Å²	66.5	44%	0.439	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.5	-172.1	-59.9	-87.8	0	0	0	109.8	P16 L40 Y41 P43	P16-F18 HydrophobicContact CB-CE2 3.73Å; P16-F18 HydrophobicContact CB-CZ 3.77Å; F18-L40 WeakPolarHBondContact O-CD1 3.39Å; F18-Y41 HydrophobicContact CB-CD1 4.32Å; F18-Y41 PolarHBondContact O-N 3.45Å; F18-P43 HydrophobicContact CD2-CG 3.6Å; F18-P43 HydrophobicContact CE2-CG 3.59Å
19	V	97.6	Very high	87.4	Confident	19 Å²	19	65.8 Å²	65.8	12%	0.115	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	149.6	-176.6	-55.2	0	0	0	0	110.2	V17 L38 T39 L40 L97 K111 V113	V17-V19 HydrophobicContact CG1-CG1 4.1Å; V19-L38 HydrophobicContact CB-CD1 4.18Å; V19-L38 HydrophobicContact CG2-CD1 4.45Å; V19-T39 CarbonylContact C-O 3.51Å; V19-T39 VanDerWaalsContact CA-O 3.22Å; V19-T39 WeakPolarHBondContact CA-O 3.41Å; V19-L40 HydrophobicContact CG1-CD1 4.05Å; V19-L97 HydrophobicContact CG1-CD2 3.79Å; V19-K111 HydrophobicContact CG1-CG 4.25Å; V19-K111 HydrophobicContact CG2-CD 4.41Å; V19-K111 HydrophobicContact CG2-CG 3.7Å; V19-V113 HydrophobicContact CG2-CG2 3.71Å
20	F	97.6	Very high	89.2	Confident	151 Å²	151	59.6 Å²	59.6	66%	0.662	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.4	136.7	173.3	178.7	-93.7	0	0	0	110.2	L38 T39	F20-L38 CarbonylContact O-C 3.53Å; F20-T39 PolarHBondContact N-O 3.32Å; F20-T39 PolarHBondContact O-N 3.32Å
21	P	97.6	Very high	90.9	Very high	32 Å²	32	63 Å²	63	21%	0.208	34%	0.337	C	S	.	.	S	Bend	cis	-69.6	167.9	-5.6	32.1	-37.7	0	0	0	112.7	E23 L24 V37 L38	P21-E23 VanDerWaalsContact C-N 3.27Å; P21-E23 WeakPolarHBondContact CB-O 2.71Å; P21-E23 VanDerWaalsContact CG-O 3.23Å; P21-E23 WeakPolarHBondContact CG-O 3.27Å; P21-L24 HydrophobicContact CG-CD2 3.64Å; P21-V37 VanDerWaalsContact CD-O 3.32Å; P21-V37 WeakPolarHBondContact CD-O 3.23Å; P21-L38 VanDerWaalsContact O-CD1 3.25Å; P21-L38 WeakPolarHBondContact O-CD1 3.46Å
22	T	95.1	Very high	92.5	Very high	95 Å²	95	62.5 Å²	62.5	58%	0.583	34%	0.338	S	S	*	.	S	Bend	trans	-77	-16.4	178.6	48.5	0	0	0	0	113.4
23	E	96.9	Very high	94	Very high	99 Å²	99	59.2 Å²	59.2	46%	0.463	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160	176.9	61.4	-176.8	-178	0	0	110.2	P21 V114	P21-E23 VanDerWaalsContact C-N 3.27Å; P21-E23 WeakPolarHBondContact CB-O 2.71Å; P21-E23 VanDerWaalsContact CG-O 3.23Å; P21-E23 WeakPolarHBondContact CG-O 3.27Å; E23-V114 WeakPolarHBondContact CA-O 3.33Å; E23-V114 HydrophobicContact CB-CG2 3.57Å
24	L	97.6	Very high	95.5	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.7	179.7	-58.9	170.2	0	0	0	109.5	P21 F26 Q36 I79 F95 V113 V114 A115 T116	P21-L24 HydrophobicContact CG-CD2 3.64Å; L24-F26 HydrophobicContact CB-CD2 4.5Å; L24-F26 HydrophobicContact CB-CE2 3.69Å; L24-F26 HydrophobicContact CB-CZ 4.18Å; L24-Q36 HydrophobicContact CD2-CB 3.99Å; L24-I79 HydrophobicContact CD1-CB 4.41Å; L24-I79 HydrophobicContact CD1-CD1 3.5Å; L24-I79 VanDerWaalsContact CD1-CD1 3.5Å; L24-I79 HydrophobicContact CD1-CG2 4.36Å; L24-F95 HydrophobicContact CD1-CD2 4.12Å; L24-F95 HydrophobicContact CD1-CE2 4.15Å; L24-V113 HydrophobicContact CD1-CG1 4.28Å; L24-V113 HydrophobicContact CG-CG1 4.09Å; L24-V114 PolarHBondContact N-O 3.12Å; L24-A115 HydrophobicContact CB-CB 4.08Å; L24-A115 CarbonylContact O-C 3.55Å; L24-A115 WeakPolarHBondContact O-CA 3.42Å; L24-T116 PolarHBondContact O-N 2.84Å
25	I	97.1	Very high	96.2	Very high	41 Å²	41	57.6 Å²	57.6	21%	0.21	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113.4	-178.2	-58.6	175.7	0	0	0	109.2	Y27 Q36 L118	I25-Y27 HydrophobicContact CG2-CE1 4.05Å; I25-Y27 HydrophobicContact CG2-CE2 3.96Å; I25-Q36 PolarHBondContact O-NE2 2.84Å; I25-L118 HydrophobicContact CG2-CD1 3.73Å; I25-L118 HydrophobicContact CG2-CG 4.45Å
26	F	97.5	Very high	96.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	146.1	178	-59.7	-89.9	0	0	0	109.4	L24 T33 Q36 Y60 I79 H81 A115 T116 L117 L118	L24-F26 HydrophobicContact CB-CD2 4.5Å; L24-F26 HydrophobicContact CB-CE2 3.69Å; L24-F26 HydrophobicContact CB-CZ 4.18Å; F26-T33 WeakPolarHBondContact CD1-O 3.26Å; F26-T33 VanDerWaalsContact CE1-O 3.28Å; F26-T33 WeakPolarHBondContact CE1-O 3.17Å; F26-Q36 HydrophobicContact CD1-CG 4.43Å; F26-Q36 HydrophobicContact CE1-CB 4.32Å; F26-Q36 HydrophobicContact CE1-CG 3.83Å; F26-Q36 HydrophobicContact CZ-CB 4.36Å; F26-Q36 HydrophobicContact CZ-CG 4.19Å; F26-Y60 HydrophobicContact CD2-CE1 4.24Å; F26-Y60 AromaticContact CE2-CE1 3.84Å; F26-Y60 HydrophobicContact CE2-CE1 3.84Å; F26-Y60 HydrophobicContact CZ-CE1 4.27Å; F26-I79 HydrophobicContact CZ-CG2 4.13Å; F26-H81 HydrophobicContact CD1-CB 3.64Å; F26-H81 AromaticContact CD2-CD2 3.94Å; F26-H81 HydrophobicContact CE1-CB 3.92Å; F26-H81 HydrophobicContact CG-CB 4.05Å; F26-H81 AromaticContact CG-CD2 3.85Å; F26-A115 HydrophobicContact CE2-CB 4.07Å; F26-T116 PolarHBondContact N-O 3.06Å; F26-L117 HydrophobicContact CB-CD1 3.78Å; F26-L117 CarbonylContact O-C 3.59Å; F26-L117 WeakPolarHBondContact O-CA 3.37Å; F26-L118 PolarHBondContact O-N 3.1Å
27	Y	97.6	Very high	96.8	Very high	38 Å²	38	58.2 Å²	58.2	15%	0.149	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.5	176	-63	-75.2	0	0	0	111	I25 D29 D30 T33 H34 L118 A121 Q124	I25-Y27 HydrophobicContact CG2-CE1 4.05Å; I25-Y27 HydrophobicContact CG2-CE2 3.96Å; Y27-D29 VanDerWaalsContact C-N 3.29Å; Y27-D29 PolarHBondContact O-N 3.38Å; Y27-D30 PolarHBondContact O-N 3.15Å; Y27-T33 HydrophobicContact CD2-CG2 3.66Å; Y27-T33 HydrophobicContact CE2-CG2 4.42Å; Y27-T33 PolarHBondContact N-OG1 2.77Å; Y27-T33 PolarHBondContact O-OG1 3.02Å; Y27-H34 PolarHBondContact O-CD2 2.88Å; Y27-H34 VanDerWaalsContact O-CD2 3.3Å; Y27-H34 PolarHBondContact O-NE2 2.89Å; Y27-L118 CarbonylContact C-O 3.49Å; Y27-L118 WeakPolarHBondContact CA-O 3.4Å; Y27-L118 HydrophobicContact CD1-CB 3.86Å; Y27-L118 HydrophobicContact CE1-CB 3.98Å; Y27-L118 HydrophobicContact CE1-CD1 4.33Å; Y27-A121 VanDerWaalsContact CD1-CA 3.44Å; Y27-A121 HydrophobicContact CD1-CB 3.94Å; Y27-A121 HydrophobicContact CD2-CB 3.78Å; Y27-A121 HydrophobicContact CE1-CB 3.97Å; Y27-A121 HydrophobicContact CE2-CB 3.84Å; Y27-A121 HydrophobicContact CG-CB 3.81Å; Y27-Q124 HydrophobicContact CE1-CB 4.4Å; Y27-Q124 VanDerWaalsContact CZ-OE1 3.29Å; Y27-Q124 PolarHBondContact OH-OE1 2.89Å
28	A	96.3	Very high	96.9	Very high	18 Å²	18	57.3 Å²	57.3	15%	0.149	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-33	-177.1	0	0	0	0	0	112.6	Y89 L117 L118	A28-Y89 HydrophobicContact CB-CE1 3.48Å; A28-Y89 VanDerWaalsContact CB-CE1 3.48Å; A28-Y89 VanDerWaalsContact CB-CZ 3.49Å; A28-Y89 WeakPolarHBondContact CB-OH 3.46Å; A28-L117 HydrophobicContact CB-CD1 4.35Å; A28-L118 PolarHBondContact N-O 3.49Å
29	D	95.4	Very high	97	Very high	92 Å²	92	54.4 Å²	54.4	49%	0.492	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.3	178.2	70.6	-18.3	0	0	0	114.4	Y27 P119 S120 A121	Y27-D29 VanDerWaalsContact C-N 3.29Å; Y27-D29 PolarHBondContact O-N 3.38Å; D29-P119 PolarHBondContact N-O 2.85Å; D29-S120 WeakPolarHBondContact OD1-CA 3.39Å; D29-S120 WeakPolarHBondContact OD2-CA 3.4Å; D29-S120 WeakPolarHBondContact OD2-CB 3.28Å; D29-S120 PolarHBondContact OD2-OG 3.01Å; D29-A121 PolarHBondContact OD1-N 2.78Å
30	D	95.9	Very high	97	Very high	56 Å²	56	53.5 Å²	53.5	30%	0.299	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-121.4	97.3	179.8	-176.9	1.3	0	0	0	112.2	Y27 S32 T33 H34	Y27-D30 PolarHBondContact O-N 3.15Å; D30-S32 VanDerWaalsContact CG-OG 3.23Å; D30-S32 PolarHBondContact O-N 3.26Å; D30-S32 VanDerWaalsContact OD1-CB 3.24Å; D30-S32 WeakPolarHBondContact OD1-CB 3.3Å; D30-S32 PolarHBondContact OD1-N 3.37Å; D30-S32 PolarHBondContact OD1-OG 3.28Å; D30-S32 PolarHBondContact OD2-OG 3.03Å; D30-S32 VanDerWaalsContact OD2-OG 3.12Å; D30-T33 HydrophobicContact CB-CG2 4.13Å; D30-T33 PolarHBondContact O-N 2.81Å; D30-T33 VanDerWaalsContact O-N 3.12Å; D30-T33 PolarHBondContact O-OG1 2.75Å; D30-T33 WeakPolarHBondContact OD2-CG2 3.33Å; D30-H34 PolarHBondContact O-CD2 2.84Å; D30-H34 VanDerWaalsContact O-CD2 3.31Å; D30-H34 PolarHBondContact O-NE2 3.29Å
31	Q	95.2	Very high	97	Very high	136 Å²	136	51.3 Å²	51.3	64%	0.636	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-59.3	-25.5	177.5	-70.8	-73	-25.3	0	0	113.9	T33 H34	Q31-T33 PolarHBondContact O-N 2.89Å; Q31-H34 PolarHBondContact NE2-CE1 3.03Å; Q31-H34 VanDerWaalsContact NE2-CE1 3.27Å; Q31-H34 WeakPolarHBondContact O-CB 3.5Å; Q31-H34 PolarHBondContact O-N 3.18Å; Q31-H34 VanDerWaalsContact O-N 3.17Å; Q31-H34 PolarHBondContact OE1-CE1 2.96Å; Q31-H34 PolarHBondContact OE1-ND1 3.36Å
32	S	95.4	Very high	97	Very high	86 Å²	86	49.8 Å²	49.8	60%	0.601	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-64.2	-30	178.6	77.1	0	0	0	0	111.4	D30 H34	D30-S32 VanDerWaalsContact CG-OG 3.23Å; D30-S32 PolarHBondContact O-N 3.26Å; D30-S32 VanDerWaalsContact OD1-CB 3.24Å; D30-S32 WeakPolarHBondContact OD1-CB 3.3Å; D30-S32 PolarHBondContact OD1-N 3.37Å; D30-S32 PolarHBondContact OD1-OG 3.28Å; D30-S32 PolarHBondContact OD2-OG 3.03Å; D30-S32 VanDerWaalsContact OD2-OG 3.12Å; S32-H34 VanDerWaalsContact C-N 3.32Å; S32-H34 PolarHBondContact O-N 3.41Å
33	T	96.8	Very high	97	Very high	21 Å²	21	47 Å²	47	13%	0.129	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-78.9	-15.7	179.6	71.9	0	0	0	0	113	F26 Y27 D30 Q31 K35 Q36	F26-T33 WeakPolarHBondContact CD1-O 3.26Å; F26-T33 VanDerWaalsContact CE1-O 3.28Å; F26-T33 WeakPolarHBondContact CE1-O 3.17Å; Y27-T33 HydrophobicContact CD2-CG2 3.66Å; Y27-T33 HydrophobicContact CE2-CG2 4.42Å; Y27-T33 PolarHBondContact N-OG1 2.77Å; Y27-T33 PolarHBondContact O-OG1 3.02Å; D30-T33 HydrophobicContact CB-CG2 4.13Å; D30-T33 PolarHBondContact O-N 2.81Å; D30-T33 VanDerWaalsContact O-N 3.12Å; D30-T33 PolarHBondContact O-OG1 2.75Å; D30-T33 WeakPolarHBondContact OD2-CG2 3.33Å; Q31-T33 PolarHBondContact O-N 2.89Å; T33-K35 PolarHBondContact O-N 3.03Å; T33-K35 VanDerWaalsContact O-N 3.1Å; T33-Q36 VanDerWaalsContact O-CG 3.3Å; T33-Q36 WeakPolarHBondContact O-CG 3.13Å; T33-Q36 PolarHBondContact O-NE2 2.88Å
34	H	97.4	Very high	96.9	Very high	16 Å²	16	44.3 Å²	44.3	7%	0.074	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-67.3	-12.7	-177.8	-64.8	-175.1	0	0	0	112.7	Y27 D30 Q31 S32 R80 H81	Y27-H34 PolarHBondContact O-CD2 2.88Å; Y27-H34 VanDerWaalsContact O-CD2 3.3Å; Y27-H34 PolarHBondContact O-NE2 2.89Å; D30-H34 PolarHBondContact O-CD2 2.84Å; D30-H34 VanDerWaalsContact O-CD2 3.31Å; D30-H34 PolarHBondContact O-NE2 3.29Å; Q31-H34 PolarHBondContact NE2-CE1 3.03Å; Q31-H34 VanDerWaalsContact NE2-CE1 3.27Å; Q31-H34 WeakPolarHBondContact O-CB 3.5Å; Q31-H34 PolarHBondContact O-N 3.18Å; Q31-H34 VanDerWaalsContact O-N 3.17Å; Q31-H34 PolarHBondContact OE1-CE1 2.96Å; Q31-H34 PolarHBondContact OE1-ND1 3.36Å; S32-H34 VanDerWaalsContact C-N 3.32Å; S32-H34 PolarHBondContact O-N 3.41Å; H34-R80 CarbonylContact O-C 3.55Å; H34-R80 WeakPolarHBondContact O-CA 3.31Å; H34-H81 PolarHBondContact O-N 3.44Å
35	K	97.7	Very high	96.6	Very high	110 Å²	110	51.5 Å²	51.5	48%	0.478	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	114.8	170.6	179.7	-166	171.2	-164.6	0	108.5	T33 V78 R80	T33-K35 PolarHBondContact O-N 3.03Å; T33-K35 VanDerWaalsContact O-N 3.1Å; K35-V78 HydrophobicContact CD-CG1 4.23Å; K35-V78 HydrophobicContact CG-CG1 3.66Å; K35-R80 HydrophobicContact CB-CG 4.42Å; K35-R80 HydrophobicContact CG-CG 4.28Å
36	Q	97.8	Very high	96.4	Very high	34 Å²	34	51.7 Å²	51.7	16%	0.159	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	157.2	174.9	-63.6	-170.3	32.6	0	0	111.4	L24 I25 F26 T33 V78 I79	L24-Q36 HydrophobicContact CD2-CB 3.99Å; I25-Q36 PolarHBondContact O-NE2 2.84Å; F26-Q36 HydrophobicContact CD1-CG 4.43Å; F26-Q36 HydrophobicContact CE1-CB 4.32Å; F26-Q36 HydrophobicContact CE1-CG 3.83Å; F26-Q36 HydrophobicContact CZ-CB 4.36Å; F26-Q36 HydrophobicContact CZ-CG 4.19Å; T33-Q36 VanDerWaalsContact O-CG 3.3Å; T33-Q36 WeakPolarHBondContact O-CG 3.13Å; T33-Q36 PolarHBondContact O-NE2 2.88Å; Q36-V78 WeakPolarHBondContact O-CA 3.42Å; Q36-I79 PolarHBondContact N-O 2.84Å; Q36-I79 PolarHBondContact O-N 2.84Å
37	V	97.8	Very high	96.2	Very high	59 Å²	59	52.7 Å²	52.7	36%	0.358	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.3	177.8	179.7	0	0	0	0	108	P21 D76 V78	P21-V37 VanDerWaalsContact CD-O 3.32Å; P21-V37 WeakPolarHBondContact CD-O 3.23Å; V37-D76 HydrophobicContact CG1-CB 3.57Å; V37-V78 HydrophobicContact CG2-CG2 4.46Å
38	L	97.8	Very high	96.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.5	169.6	-176.9	72.4	0	0	0	108.3	V19 F20 P21 I77 I79 L97 V113	V19-L38 HydrophobicContact CB-CD1 4.18Å; V19-L38 HydrophobicContact CG2-CD1 4.45Å; F20-L38 CarbonylContact O-C 3.53Å; P21-L38 VanDerWaalsContact O-CD1 3.25Å; P21-L38 WeakPolarHBondContact O-CD1 3.46Å; L38-I77 HydrophobicContact CB-CB 4.44Å; L38-I77 PolarHBondContact N-O 2.83Å; L38-I77 WeakPolarHBondContact O-CB 3.4Å; L38-I77 PolarHBondContact O-N 3.31Å; L38-I79 HydrophobicContact CB-CD1 4.17Å; L38-I79 HydrophobicContact CD2-CD1 4.22Å; L38-L97 HydrophobicContact CD2-CD1 3.54Å; L38-L97 HydrophobicContact CD2-CD2 4.22Å; L38-V113 HydrophobicContact CD1-CG1 4.2Å; L38-V113 HydrophobicContact CD1-CG2 4.18Å; L38-V113 HydrophobicContact CD2-CG2 4.17Å
39	T	98.1	Very high	96.1	Very high	39 Å²	39	54.3 Å²	54.3	24%	0.239	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.9	178.6	-54.9	0	0	0	0	109.8	V19 F20 C74 V75 D76	V19-T39 CarbonylContact C-O 3.51Å; V19-T39 VanDerWaalsContact CA-O 3.22Å; V19-T39 WeakPolarHBondContact CA-O 3.41Å; F20-T39 PolarHBondContact N-O 3.32Å; F20-T39 PolarHBondContact O-N 3.32Å; T39-C74 HydrophobicContact CG2-CB 3.76Å; T39-V75 CarbonylContact C-O 3.53Å; T39-V75 WeakPolarHBondContact CA-O 3.19Å; T39-D76 WeakPolarHBondContact CB-OD1 3.46Å; T39-D76 WeakPolarHBondContact CG2-OD1 3.32Å; T39-D76 PolarHBondContact OG1-OD1 3.36Å
40	L	97.8	Very high	96.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124.2	170.2	168.4	66.4	0	0	0	109	V17 F18 V19 F50 V69 C74 V75 I77 L97 V99	V17-L40 HydrophobicContact CG1-CD1 3.68Å; F18-L40 WeakPolarHBondContact O-CD1 3.39Å; V19-L40 HydrophobicContact CG1-CD1 4.05Å; L40-F50 HydrophobicContact CD2-CB 3.64Å; L40-F50 HydrophobicContact CD2-CD1 3.99Å; L40-F50 HydrophobicContact CD2-CG 3.82Å; L40-V69 HydrophobicContact CD2-CG2 3.85Å; L40-V69 HydrophobicContact CG-CG2 4.32Å; L40-C74 CarbonylContact O-C 3.59Å; L40-C74 VanDerWaalsContact O-CA 3.23Å; L40-C74 WeakPolarHBondContact O-CA 3.19Å; L40-V75 HydrophobicContact CB-CG1 3.95Å; L40-V75 HydrophobicContact CD2-CG1 4.3Å; L40-V75 HydrophobicContact CG-CG1 4.49Å; L40-V75 PolarHBondContact N-O 2.81Å; L40-V75 PolarHBondContact O-N 3.23Å; L40-I77 HydrophobicContact CB-CD1 4.37Å; L40-L97 HydrophobicContact CB-CD2 4.3Å; L40-L97 HydrophobicContact CD1-CD2 4.3Å; L40-L97 HydrophobicContact CD2-CD2 4.4Å; L40-V99 HydrophobicContact CD1-CG1 4.43Å; L40-V99 HydrophobicContact CD2-CG1 4.26Å
41	Y	97.9	Very high	96.1	Very high	104 Å²	104	53.2 Å²	53.2	41%	0.408	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	177.4	179.6	-119.2	0	0	0	111.4	F18 P43	F18-Y41 HydrophobicContact CB-CD1 4.32Å; F18-Y41 PolarHBondContact O-N 3.45Å; Y41-P43 HydrophobicContact CD1-CB 4.11Å; Y41-P43 HydrophobicContact CD1-CG 4.36Å; Y41-P43 HydrophobicContact CE1-CB 3.57Å; Y41-P43 HydrophobicContact CE1-CG 4.3Å; Y41-P43 VanDerWaalsContact O-CD 3.26Å; Y41-P43 WeakPolarHBondContact O-CD 3.28Å
42	N	97	Very high	96.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	95.1	173.6	-177	12.2	0	0	0	110.7	Y44 F46 L48 V69 K70 Q72 C73	N42-Y44 PolarHBondContact O-N 3.09Å; N42-Y44 WeakPolarHBondContact OD1-CB 3.33Å; N42-Y44 VanDerWaalsContact OD1-CD2 3.26Å; N42-Y44 WeakPolarHBondContact OD1-CD2 3.3Å; N42-Y44 PolarHBondContact OD1-N 2.86Å; N42-F46 PolarHBondContact ND2-O 2.81Å; N42-L48 HydrophobicContact CB-CD1 3.87Å; N42-L48 HydrophobicContact CB-CG 4.34Å; N42-L48 WeakPolarHBondContact OD1-CD1 3.21Å; N42-V69 HydrophobicContact CB-CB 4.09Å; N42-V69 HydrophobicContact CB-CG1 3.65Å; N42-V69 PolarHBondContact ND2-O 3.36Å; N42-K70 WeakPolarHBondContact CB-O 3.19Å; N42-K70 VanDerWaalsContact ND2-C 3.29Å; N42-K70 PolarHBondContact ND2-O 2.83Å; N42-Q72 WeakPolarHBondContact O-CA 3.26Å; N42-Q72 PolarHBondContact O-N 2.8Å; N42-C73 WeakPolarHBondContact CB-O 3.27Å; N42-C73 PolarHBondContact N-O 2.83Å; N42-C73 PolarHBondContact O-N 2.92Å
43	P	95.8	Very high	96.2	Very high	37 Å²	37	46 Å²	46	24%	0.24	22%	0.221	C	C	.	.			trans	-77.9	-1.7	175.3	32.6	-36.3	0	0	0	113.6	F18 Y41 Q72	F18-P43 HydrophobicContact CD2-CG 3.6Å; F18-P43 HydrophobicContact CE2-CG 3.59Å; Y41-P43 HydrophobicContact CD1-CB 4.11Å; Y41-P43 HydrophobicContact CD1-CG 4.36Å; Y41-P43 HydrophobicContact CE1-CB 3.57Å; Y41-P43 HydrophobicContact CE1-CG 4.3Å; Y41-P43 VanDerWaalsContact O-CD 3.26Å; Y41-P43 WeakPolarHBondContact O-CD 3.28Å; P43-Q72 PolarHBondContact O-NE2 2.74Å
44	Y	94.2	Very high	96	Very high	43 Å²	43	46.7 Å²	46.7	17%	0.169	23%	0.227	C	C	.	.	S	Bend	trans	-89.9	160.8	-172	-53.9	-67.3	0	0	0	111.9	L15 P16 N42 F46 L48 P71 Q72	L15-Y44 HydrophobicContact CD1-CD1 4.23Å; L15-Y44 HydrophobicContact CD1-CD2 4.34Å; L15-Y44 HydrophobicContact CD1-CE1 3.59Å; L15-Y44 HydrophobicContact CD1-CE2 3.73Å; L15-Y44 WeakPolarHBondContact CD1-OH 3.31Å; L15-Y44 HydrophobicContact CD2-CD2 4.32Å; L15-Y44 HydrophobicContact CD2-CE2 3.89Å; L15-Y44 HydrophobicContact CG-CE1 4.46Å; L15-Y44 HydrophobicContact CG-CE2 3.74Å; P16-Y44 VanDerWaalsContact CD-OH 3.27Å; P16-Y44 WeakPolarHBondContact CD-OH 3.45Å; P16-Y44 PolarHBondContact O-OH 2.92Å; N42-Y44 PolarHBondContact O-N 3.09Å; N42-Y44 WeakPolarHBondContact OD1-CB 3.33Å; N42-Y44 VanDerWaalsContact OD1-CD2 3.26Å; N42-Y44 WeakPolarHBondContact OD1-CD2 3.3Å; N42-Y44 PolarHBondContact OD1-N 2.86Å; Y44-F46 HydrophobicContact CD1-CE1 4.24Å; Y44-F46 HydrophobicContact CD1-CZ 4.31Å; Y44-F46 HydrophobicContact CD2-CZ 4.17Å; Y44-F46 AromaticContact CG-CE1 3.95Å; Y44-F46 HydrophobicContact CG-CE1 3.95Å; Y44-F46 HydrophobicContact CG-CE2 4.48Å; Y44-F46 AromaticContact CG-CZ 3.83Å; Y44-F46 HydrophobicContact CG-CZ 3.83Å; Y44-F46 PolarHBondContact O-N 2.84Å; Y44-L48 HydrophobicContact CD2-CD1 4.04Å; Y44-L48 HydrophobicContact CD2-CD2 4.18Å; Y44-L48 HydrophobicContact CD2-CG 4.39Å; Y44-L48 HydrophobicContact CE2-CD1 4.38Å; Y44-P71 WeakPolarHBondContact O-CA 3.43Å; Y44-P71 VanDerWaalsContact O-CB 3.3Å; Y44-P71 WeakPolarHBondContact O-CB 3.36Å; Y44-Q72 PolarHBondContact O-N 2.91Å
45	E	93.1	Very high	95.6	Very high	152 Å²	152	50.2 Å²	50.2	71%	0.71	25%	0.249	S	C	*	.	S	Bend	trans	-81	6.5	176.8	-63.2	-59.9	125	0	0	113.4	Q72	E45-Q72 PolarHBondContact OE1-NE2 2.58Å
46	F	92.3	Very high	95.4	Very high	45 Å²	45	46.5 Å²	46.5	20%	0.197	24%	0.236	C	C	.	.	S	Bend	trans	-130.2	155	179.6	57.5	-94.3	0	0	0	111.1	L10 L15 N42 Y44 L48 E101	L10-F46 HydrophobicContact CD1-CE1 3.82Å; L10-F46 HydrophobicContact CD1-CE2 4.32Å; L10-F46 HydrophobicContact CD1-CZ 3.47Å; L10-F46 VanDerWaalsContact CD1-CZ 3.47Å; L15-F46 HydrophobicContact CD1-CZ 4.25Å; L15-F46 HydrophobicContact CD2-CE2 4.35Å; L15-F46 HydrophobicContact CD2-CZ 4.19Å; N42-F46 PolarHBondContact ND2-O 2.81Å; Y44-F46 HydrophobicContact CD1-CE1 4.24Å; Y44-F46 HydrophobicContact CD1-CZ 4.31Å; Y44-F46 HydrophobicContact CD2-CZ 4.17Å; Y44-F46 AromaticContact CG-CE1 3.95Å; Y44-F46 HydrophobicContact CG-CE1 3.95Å; Y44-F46 HydrophobicContact CG-CE2 4.48Å; Y44-F46 AromaticContact CG-CZ 3.83Å; Y44-F46 HydrophobicContact CG-CZ 3.83Å; Y44-F46 PolarHBondContact O-N 2.84Å; F46-L48 HydrophobicContact CD2-CD2 4.05Å; F46-L48 HydrophobicContact CE2-CD2 3.49Å; F46-L48 VanDerWaalsContact CE2-CD2 3.49Å; F46-L48 HydrophobicContact CZ-CD2 4.4Å; F46-E101 HydrophobicContact CD2-CB 4.12Å; F46-E101 HydrophobicContact CD2-CG 3.77Å; F46-E101 HydrophobicContact CE2-CB 4.18Å; F46-E101 HydrophobicContact CE2-CG 4.28Å; F46-E101 HydrophobicContact CG-CG 4.34Å
47	A	93.7	Very high	95.1	Very high	20 Å²	20	49 Å²	49	17%	0.165	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-73.2	132.3	179.9	0	0	0	0	0	111.1	V69 Q102	A47-V69 CarbonylContact C-O 3.57Å; A47-V69 VanDerWaalsContact CA-O 3.3Å; A47-V69 WeakPolarHBondContact CA-O 3.23Å; A47-Q102 HydrophobicContact CB-CB 4.12Å; A47-Q102 PolarHBondContact O-N 3.48Å
48	L	95	Very high	94.9	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.5	173.8	-64.5	179.2	0	0	0	110.2	L15 N42 Y44 F46 A68 V69 V99 S100	L15-L48 HydrophobicContact CD2-CD2 3.93Å; N42-L48 HydrophobicContact CB-CD1 3.87Å; N42-L48 HydrophobicContact CB-CG 4.34Å; N42-L48 WeakPolarHBondContact OD1-CD1 3.21Å; Y44-L48 HydrophobicContact CD2-CD1 4.04Å; Y44-L48 HydrophobicContact CD2-CD2 4.18Å; Y44-L48 HydrophobicContact CD2-CG 4.39Å; Y44-L48 HydrophobicContact CE2-CD1 4.38Å; F46-L48 HydrophobicContact CD2-CD2 4.05Å; F46-L48 HydrophobicContact CE2-CD2 3.49Å; F46-L48 VanDerWaalsContact CE2-CD2 3.49Å; F46-L48 HydrophobicContact CZ-CD2 4.4Å; L48-A68 CarbonylContact O-C 3.47Å; L48-A68 WeakPolarHBondContact O-CA 3.48Å; L48-V69 PolarHBondContact N-O 3Å; L48-V69 PolarHBondContact O-N 2.87Å; L48-V99 HydrophobicContact CD1-CG1 4.49Å; L48-V99 HydrophobicContact CD2-CB 4.46Å; L48-S100 CarbonylContact C-O 3.59Å; L48-S100 WeakPolarHBondContact CA-O 3.12Å
49	K	95.6	Very high	94.8	Very high	87 Å²	87	54.1 Å²	54.1	38%	0.378	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.2	158	-80.7	175.5	174.1	151.9	0	108.7	G67 A68 V99 S100 Q102	K49-G67 WeakPolarHBondContact CA-O 3.36Å; K49-A68 HydrophobicContact CG-CB 4.44Å; K49-V99 CarbonylContact O-C 3.52Å; K49-V99 VanDerWaalsContact O-CA 3.28Å; K49-V99 WeakPolarHBondContact O-CA 3.22Å; K49-S100 WeakPolarHBondContact CB-OG 3.48Å; K49-S100 PolarHBondContact N-O 2.89Å; K49-S100 PolarHBondContact O-N 2.82Å; K49-S100 PolarHBondContact O-OG 3.34Å; K49-Q102 HydrophobicContact CG-CB 4.45Å; K49-Q102 PolarHBondContact NZ-O 2.82Å
50	F	95.7	Very high	94.8	Very high	13 Å²	13	52.6 Å²	52.6	6%	0.057	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.5	178.5	73.2	-90	0	0	0	112.3	L40 V52 A66 G67 V69 V75 I77 Q98 V99	L40-F50 HydrophobicContact CD2-CB 3.64Å; L40-F50 HydrophobicContact CD2-CD1 3.99Å; L40-F50 HydrophobicContact CD2-CG 3.82Å; F50-V52 HydrophobicContact CD2-CG2 4.19Å; F50-V52 HydrophobicContact CE2-CG2 4.34Å; F50-A66 VanDerWaalsContact O-CA 3.27Å; F50-A66 WeakPolarHBondContact O-CA 3.3Å; F50-G67 WeakPolarHBondContact CD1-O 3.48Å; F50-G67 PolarHBondContact N-O 2.91Å; F50-G67 PolarHBondContact O-N 3.36Å; F50-G67 VanDerWaalsContact O-N 3.1Å; F50-V69 HydrophobicContact CD1-CG2 3.83Å; F50-V69 HydrophobicContact CE1-CG2 4.1Å; F50-V75 HydrophobicContact CD1-CG1 4.26Å; F50-V75 HydrophobicContact CE1-CG1 3.7Å; F50-V75 HydrophobicContact CE1-CG2 4.37Å; F50-V75 HydrophobicContact CZ-CG1 4.07Å; F50-V75 HydrophobicContact CZ-CG2 4.47Å; F50-I77 HydrophobicContact CD2-CD1 4.02Å; F50-I77 HydrophobicContact CE2-CD1 3.74Å; F50-I77 HydrophobicContact CE2-CG1 3.95Å; F50-I77 HydrophobicContact CZ-CD1 4.36Å; F50-I77 HydrophobicContact CZ-CG1 4.24Å; F50-Q98 CarbonylContact C-O 3.57Å; F50-Q98 VanDerWaalsContact CA-O 3.23Å; F50-Q98 WeakPolarHBondContact CA-O 3.37Å; F50-V99 HydrophobicContact CB-CG1 4.21Å
51	K	95.8	Very high	94.7	Very high	113 Å²	113	54.7 Å²	54.7	49%	0.491	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	134.6	168.7	-172.6	176.8	-176.4	-179.2	0	109.6	L53 A65 A66 Q98	K51-L53 HydrophobicContact CD-CD2 4.15Å; K51-L53 HydrophobicContact CG-CD2 4.28Å; K51-A65 CarbonylContact C-O 3.55Å; K51-A65 WeakPolarHBondContact CA-O 3.35Å; K51-A66 HydrophobicContact CG-CB 4.44Å; K51-Q98 PolarHBondContact N-O 2.77Å; K51-Q98 PolarHBondContact O-N 2.79Å
52	V	97.1	Very high	94.7	Very high	9 Å²	9	51.1 Å²	51.1	6%	0.055	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.1	176.3	-170.3	0	0	0	0	108.5	F50 V62 A65 I77 F95 L97	F50-V52 HydrophobicContact CD2-CG2 4.19Å; F50-V52 HydrophobicContact CE2-CG2 4.34Å; V52-V62 HydrophobicContact CB-CG1 4.12Å; V52-V62 HydrophobicContact CG1-CG1 4.1Å; V52-V62 HydrophobicContact CG1-CG2 4.34Å; V52-V62 HydrophobicContact CG2-CG1 4.31Å; V52-A65 PolarHBondContact N-O 3.4Å; V52-I77 HydrophobicContact CG2-CD1 3.93Å; V52-I77 HydrophobicContact CG2-CG2 4.16Å; V52-F95 HydrophobicContact CG1-CB 4.47Å; V52-F95 HydrophobicContact CG1-CD1 4.16Å; V52-L97 HydrophobicContact CG1-CD1 4.23Å; V52-L97 HydrophobicContact CG2-CD1 4.39Å; V52-L97 HydrophobicContact CG2-CG 4.19Å
53	L	95.4	Very high	94.6	Very high	60 Å²	60	53.7 Å²	53.7	31%	0.314	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	147.5	172	-54.4	174	0	0	0	108.7	K51 F95 R96 Q98	K51-L53 HydrophobicContact CD-CD2 4.15Å; K51-L53 HydrophobicContact CG-CD2 4.28Å; L53-F95 CarbonylContact O-C 3.48Å; L53-F95 VanDerWaalsContact O-CA 3.28Å; L53-F95 WeakPolarHBondContact O-CA 3.23Å; L53-R96 HydrophobicContact CB-CB 4.28Å; L53-R96 PolarHBondContact N-O 3.3Å; L53-R96 PolarHBondContact O-N 2.8Å; L53-Q98 HydrophobicContact CD1-CG 4.47Å
54	C	93.1	Very high	94.3	Very high	37 Å²	37	58 Å²	58	25%	0.25	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.3	178.9	-178.3	0	0	0	0	109.3	T56 F95	C54-T56 PolarHBondContact O-N 3.49Å; C54-T56 PolarHBondContact SG-N 2.87Å; C54-T56 VanDerWaalsContact SG-N 3.36Å; C54-F95 HydrophobicContact CB-CD1 3.87Å; C54-F95 HydrophobicContact CB-CE1 3.77Å; C54-F95 WeakPolarHBondContact SG-CE1 3.42Å
55	T	89.9	Confident	94.3	Very high	89 Å²	89	57.8 Å²	57.8	55%	0.546	31%	0.314	S	S	.	.	S	Bend	trans	-69.6	-22.7	174.8	49.4	0	0	0	0	113.1	K94	T55-K94 HydrophobicContact CG2-CB 3.92Å; T55-K94 PolarHBondContact N-O 2.8Å; T55-K94 VanDerWaalsContact N-O 3.09Å; T55-K94 PolarHBondContact OG1-N 2.87Å; T55-K94 VanDerWaalsContact OG1-N 3.07Å; T55-K94 PolarHBondContact OG1-O 3Å
56	T	92.3	Very high	94.5	Very high	33 Å²	33	53.6 Å²	53.6	20%	0.202	31%	0.306	C	S	.	.			trans	-139.4	62.3	-163.7	-14.3	0	0	0	0	111	C54 N58 K59 D93	C54-T56 PolarHBondContact O-N 3.49Å; C54-T56 PolarHBondContact SG-N 2.87Å; C54-T56 VanDerWaalsContact SG-N 3.36Å; T56-N58 PolarHBondContact O-N 3.4Å; T56-K59 HydrophobicContact CG2-CD 3.73Å; T56-K59 VanDerWaalsContact CG2-CE 3.48Å; T56-K59 HydrophobicContact CG2-CG 4.05Å; T56-K59 PolarHBondContact O-N 3.07Å; T56-D93 WeakPolarHBondContact CB-OD1 3.43Å; T56-D93 VanDerWaalsContact OG1-CG 3.27Å; T56-D93 PolarHBondContact OG1-OD1 3.48Å
57	P	91.3	Very high	94.6	Very high	87 Å²	87	52.9 Å²	52.9	57%	0.565	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-14.9	-170.7	27.7	-36.9	0	0	0	114.5
58	N	93.7	Very high	94.7	Very high	148 Å²	148	54.7 Å²	54.7	79%	0.791	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-28	175.3	-63.2	-23.2	0	0	0	112.5	T56	T56-N58 PolarHBondContact O-N 3.4Å
59	K	95.9	Very high	94.8	Very high	18 Å²	18	54.8 Å²	54.8	8%	0.078	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-26.5	-178.7	-60.9	178.9	-171.3	170.2	0	112.6	T56 R82 D83 D93	T56-K59 HydrophobicContact CG2-CD 3.73Å; T56-K59 VanDerWaalsContact CG2-CE 3.48Å; T56-K59 HydrophobicContact CG2-CG 4.05Å; T56-K59 PolarHBondContact O-N 3.07Å; K59-R82 PolarHBondContact O-N 3.26Å; K59-D83 HydrophobicContact CB-CB 4.42Å; K59-D83 HydrophobicContact CG-CB 4.4Å; K59-D93 VanDerWaalsContact CD-OD2 3.3Å; K59-D93 WeakPolarHBondContact CD-OD2 3.46Å; K59-D93 VanDerWaalsContact NZ-CG 3.28Å; K59-D93 IonicContact NZ-OD1 3.53Å; K59-D93 PolarHBondContact NZ-OD1 3.41Å; K59-D93 IonicContact NZ-OD2 3.9Å; K59-D93 PolarHBondContact NZ-OD2 2.7Å
60	Y	97.5	Very high	94.8	Very high	7 Å²	7	58 Å²	58	3%	0.027	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	149.9	-169.3	-59.6	-83	0	0	0	112.8	F26 I79 R80 H81 D93 F95 A115	F26-Y60 HydrophobicContact CD2-CE1 4.24Å; F26-Y60 AromaticContact CE2-CE1 3.84Å; F26-Y60 HydrophobicContact CE2-CE1 3.84Å; F26-Y60 HydrophobicContact CZ-CE1 4.27Å; Y60-I79 HydrophobicContact CD1-CG2 4.18Å; Y60-R80 CarbonylContact C-O 3.42Å; Y60-R80 VanDerWaalsContact CA-O 3.22Å; Y60-R80 WeakPolarHBondContact CA-O 3.21Å; Y60-H81 HydrophobicContact CD1-CB 4.31Å; Y60-H81 HydrophobicContact CE1-CB 4.22Å; Y60-H81 AromaticContact CE1-CD2 3.21Å; Y60-H81 WeakPolarHBondContact CE1-CD2 3.25Å; Y60-H81 AromaticContact CE1-CG 3.83Å; Y60-H81 AromaticContact CE1-NE2 3.74Å; Y60-H81 AromaticContact CZ-CD2 3.62Å; Y60-H81 AromaticContact CZ-NE2 3.64Å; Y60-H81 PolarHBondContact OH-NE2 2.72Å; Y60-D93 HydrophobicContact CE2-CB 3.65Å; Y60-D93 WeakPolarHBondContact CE2-OD2 3.36Å; Y60-D93 PolarHBondContact OH-OD2 3.5Å; Y60-D93 VanDerWaalsContact OH-OD2 3.1Å; Y60-F95 HydrophobicContact CD1-CE2 4.29Å; Y60-F95 AromaticContact CD1-CZ 3.67Å; Y60-F95 HydrophobicContact CD1-CZ 3.67Å; Y60-F95 AromaticContact CD2-CZ 3.92Å; Y60-F95 HydrophobicContact CD2-CZ 3.92Å; Y60-F95 HydrophobicContact CE1-CE2 4.31Å; Y60-F95 HydrophobicContact CE1-CZ 4.13Å; Y60-F95 HydrophobicContact CE2-CZ 4.38Å; Y60-F95 HydrophobicContact CG-CE1 4.32Å; Y60-F95 HydrophobicContact CG-CE2 4.44Å; Y60-F95 AromaticContact CG-CZ 3.55Å; Y60-F95 HydrophobicContact CG-CZ 3.55Å; Y60-A115 HydrophobicContact CE1-CB 4.42Å
61	V	96.9	Very high	94.9	Very high	43 Å²	43	59.8 Å²	59.8	26%	0.261	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.1	164.1	167.6	0	0	0	0	110.2	R80 R82	V61-R80 PolarHBondContact N-O 2.67Å; V61-R80 PolarHBondContact O-N 3.21Å; V61-R82 HydrophobicContact CG2-CG 4.49Å
62	V	97.2	Very high	94.9	Very high	29 Å²	29	58.7 Å²	58.7	18%	0.176	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114.2	174	-172.5	0	0	0	0	107.4	V52 A65 I77 I79 F95	V52-V62 HydrophobicContact CB-CG1 4.12Å; V52-V62 HydrophobicContact CG1-CG1 4.1Å; V52-V62 HydrophobicContact CG1-CG2 4.34Å; V52-V62 HydrophobicContact CG2-CG1 4.31Å; V62-A65 HydrophobicContact CB-CB 4.12Å; V62-A65 HydrophobicContact CG1-CB 4Å; V62-I77 HydrophobicContact CG1-CG2 3.63Å; V62-I79 HydrophobicContact CG1-CG1 4.37Å; V62-I79 HydrophobicContact CG2-CG1 4.35Å; V62-F95 HydrophobicContact CG2-CD1 4.18Å; V62-F95 HydrophobicContact CG2-CE1 3.74Å
63	V	95.4	Very high	95	Very high	54 Å²	54	60.8 Å²	60.8	33%	0.327	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	129.5	173.1	-174.6	0	0	0	0	107.5	V78	V63-V78 HydrophobicContact CB-CB 4Å; V63-V78 HydrophobicContact CG2-CB 3.93Å; V63-V78 HydrophobicContact CG2-CG1 4.18Å; V63-V78 PolarHBondContact N-O 2.87Å
64	D	89.7	Confident	95.1	Very high	129 Å²	129	61.9 Å²	61.9	69%	0.69	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	60	-178.4	-57.5	-40.4	0	0	0	112.8	A66	D64-A66 PolarHBondContact O-N 3.01Å
65	A	94.6	Very high	95.3	Very high	37 Å²	37	61.9 Å²	61.9	31%	0.306	38%	0.376	S	S	.	.	S	Bend	trans	-60.3	-5.2	-179	0	0	0	0	0	114.7	K51 V52 V62	K51-A65 CarbonylContact C-O 3.55Å; K51-A65 WeakPolarHBondContact CA-O 3.35Å; V52-A65 PolarHBondContact N-O 3.4Å; V62-A65 HydrophobicContact CB-CB 4.12Å; V62-A65 HydrophobicContact CG1-CB 4Å
66	A	95.7	Very high	95.7	Very high	64 Å²	64	62.5 Å²	62.5	53%	0.529	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.8	170.9	0	0	0	0	0	110.4	F50 K51 D64	F50-A66 VanDerWaalsContact O-CA 3.27Å; F50-A66 WeakPolarHBondContact O-CA 3.3Å; K51-A66 HydrophobicContact CG-CB 4.44Å; D64-A66 PolarHBondContact O-N 3.01Å
67	G	95.5	Very high	95.9	Very high	31 Å²	31	61 Å²	61	32%	0.32	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	-162.6	-178.8	0	0	0	0	0	112.4	K49 F50	K49-G67 WeakPolarHBondContact CA-O 3.36Å; F50-G67 WeakPolarHBondContact CD1-O 3.48Å; F50-G67 PolarHBondContact N-O 2.91Å; F50-G67 PolarHBondContact O-N 3.36Å; F50-G67 VanDerWaalsContact O-N 3.1Å
68	A	95.5	Very high	96.2	Very high	58 Å²	58	58.3 Å²	58.3	48%	0.479	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.1	176	0	0	0	0	0	111.7	L48 K49	L48-A68 CarbonylContact O-C 3.47Å; L48-A68 WeakPolarHBondContact O-CA 3.48Å; K49-A68 HydrophobicContact CG-CB 4.44Å
69	V	96.4	Very high	96.5	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.024	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.6	177.2	-165.2	0	0	0	0	108.1	L40 N42 A47 L48 F50 C73 V75	L40-V69 HydrophobicContact CD2-CG2 3.85Å; L40-V69 HydrophobicContact CG-CG2 4.32Å; N42-V69 HydrophobicContact CB-CB 4.09Å; N42-V69 HydrophobicContact CB-CG1 3.65Å; N42-V69 PolarHBondContact ND2-O 3.36Å; A47-V69 CarbonylContact C-O 3.57Å; A47-V69 VanDerWaalsContact CA-O 3.3Å; A47-V69 WeakPolarHBondContact CA-O 3.23Å; L48-V69 PolarHBondContact N-O 3Å; L48-V69 PolarHBondContact O-N 2.87Å; F50-V69 HydrophobicContact CD1-CG2 3.83Å; F50-V69 HydrophobicContact CE1-CG2 4.1Å; V69-C73 HydrophobicContact CG1-CB 4.21Å; V69-C73 WeakPolarHBondContact CG1-O 3.47Å; V69-V75 HydrophobicContact CG2-CB 3.89Å; V69-V75 HydrophobicContact CG2-CG1 3.33Å
70	K	96.8	Very high	96.5	Very high	155 Å²	155	55.7 Å²	55.7	67%	0.674	33%	0.326	S	S	*	.			trans	-66.2	160.3	176.3	-69.7	-179.7	-177	176.5	0	111	N42 C73	N42-K70 WeakPolarHBondContact CB-O 3.19Å; N42-K70 VanDerWaalsContact ND2-C 3.29Å; N42-K70 PolarHBondContact ND2-O 2.83Å; K70-C73 HydrophobicContact CB-CB 4.04Å; K70-C73 WeakPolarHBondContact O-CB 3.26Å; K70-C73 PolarHBondContact O-N 3.39Å
71	P	96.6	Very high	96.5	Very high	50 Å²	50	55.8 Å²	55.8	33%	0.325	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	142.7	168.2	-24.8	32.9	0	0	0	111.7	Y44 C73	Y44-P71 WeakPolarHBondContact O-CA 3.43Å; Y44-P71 VanDerWaalsContact O-CB 3.3Å; Y44-P71 WeakPolarHBondContact O-CB 3.36Å; P71-C73 PolarHBondContact O-N 3.07Å; P71-C73 VanDerWaalsContact O-N 3.07Å; P71-C73 PolarHBondContact O-SG 2.84Å
72	Q	97.1	Very high	96.5	Very high	91 Å²	91	62 Å²	62	43%	0.425	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	29.5	176.9	-54.3	-57.4	-23.2	0	0	114.6	N42 P43 Y44 E45	N42-Q72 WeakPolarHBondContact O-CA 3.26Å; N42-Q72 PolarHBondContact O-N 2.8Å; P43-Q72 PolarHBondContact O-NE2 2.74Å; Y44-Q72 PolarHBondContact O-N 2.91Å; E45-Q72 PolarHBondContact OE1-NE2 2.58Å
73	C	97.9	Very high	96.4	Very high	52 Å²	52	62.2 Å²	62.2	35%	0.351	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	169.6	-177.9	-69.1	0	0	0	0	111.4	N42 V69 K70 P71	N42-C73 WeakPolarHBondContact CB-O 3.27Å; N42-C73 PolarHBondContact N-O 2.83Å; N42-C73 PolarHBondContact O-N 2.92Å; V69-C73 HydrophobicContact CG1-CB 4.21Å; V69-C73 WeakPolarHBondContact CG1-O 3.47Å; K70-C73 HydrophobicContact CB-CB 4.04Å; K70-C73 WeakPolarHBondContact O-CB 3.26Å; K70-C73 PolarHBondContact O-N 3.39Å; P71-C73 PolarHBondContact O-N 3.07Å; P71-C73 VanDerWaalsContact O-N 3.07Å; P71-C73 PolarHBondContact O-SG 2.84Å
74	C	97.6	Very high	96.4	Very high	83 Å²	83	61.7 Å²	61.7	56%	0.561	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	161.4	171.4	53.7	0	0	0	0	111.7	T39 L40	T39-C74 HydrophobicContact CG2-CB 3.76Å; L40-C74 CarbonylContact O-C 3.59Å; L40-C74 VanDerWaalsContact O-CA 3.23Å; L40-C74 WeakPolarHBondContact O-CA 3.19Å
75	V	97.8	Very high	96.7	Very high	38 Å²	38	62.3 Å²	62.3	23%	0.23	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142	167.2	70.5	0	0	0	0	109.4	T39 L40 F50 V69 I77	T39-V75 CarbonylContact C-O 3.53Å; T39-V75 WeakPolarHBondContact CA-O 3.19Å; L40-V75 HydrophobicContact CB-CG1 3.95Å; L40-V75 HydrophobicContact CD2-CG1 4.3Å; L40-V75 HydrophobicContact CG-CG1 4.49Å; L40-V75 PolarHBondContact N-O 2.81Å; L40-V75 PolarHBondContact O-N 3.23Å; F50-V75 HydrophobicContact CD1-CG1 4.26Å; F50-V75 HydrophobicContact CE1-CG1 3.7Å; F50-V75 HydrophobicContact CE1-CG2 4.37Å; F50-V75 HydrophobicContact CZ-CG1 4.07Å; F50-V75 HydrophobicContact CZ-CG2 4.47Å; V69-V75 HydrophobicContact CG2-CB 3.89Å; V69-V75 HydrophobicContact CG2-CG1 3.33Å; V75-I77 HydrophobicContact CG1-CG1 4.48Å
76	D	97.7	Very high	96.7	Very high	101 Å²	101	64.9 Å²	64.9	54%	0.54	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.8	176.2	-73.9	-17.3	0	0	0	110.4	V37 T39	V37-D76 HydrophobicContact CG1-CB 3.57Å; T39-D76 WeakPolarHBondContact CB-OD1 3.46Å; T39-D76 WeakPolarHBondContact CG2-OD1 3.32Å; T39-D76 PolarHBondContact OG1-OD1 3.36Å
77	I	97.7	Very high	96.7	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.2	178.9	-58.1	163.4	0	0	0	107.4	L38 L40 F50 V52 V62 V75 I79 L97	L38-I77 HydrophobicContact CB-CB 4.44Å; L38-I77 PolarHBondContact N-O 2.83Å; L38-I77 WeakPolarHBondContact O-CB 3.4Å; L38-I77 PolarHBondContact O-N 3.31Å; L40-I77 HydrophobicContact CB-CD1 4.37Å; F50-I77 HydrophobicContact CD2-CD1 4.02Å; F50-I77 HydrophobicContact CE2-CD1 3.74Å; F50-I77 HydrophobicContact CE2-CG1 3.95Å; F50-I77 HydrophobicContact CZ-CD1 4.36Å; F50-I77 HydrophobicContact CZ-CG1 4.24Å; V52-I77 HydrophobicContact CG2-CD1 3.93Å; V52-I77 HydrophobicContact CG2-CG2 4.16Å; V62-I77 HydrophobicContact CG1-CG2 3.63Å; V75-I77 HydrophobicContact CG1-CG1 4.48Å; I77-I79 HydrophobicContact CG2-CG1 4.43Å; I77-L97 HydrophobicContact CD1-CD2 3.95Å
78	V	97.9	Very high	96.6	Very high	30 Å²	30	65.4 Å²	65.4	18%	0.182	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.8	-178.6	-177.1	0	0	0	0	109.9	K35 Q36 V37 V63 R80	K35-V78 HydrophobicContact CD-CG1 4.23Å; K35-V78 HydrophobicContact CG-CG1 3.66Å; Q36-V78 WeakPolarHBondContact O-CA 3.42Å; V37-V78 HydrophobicContact CG2-CG2 4.46Å; V63-V78 HydrophobicContact CB-CB 4Å; V63-V78 HydrophobicContact CG2-CB 3.93Å; V63-V78 HydrophobicContact CG2-CG1 4.18Å; V63-V78 PolarHBondContact N-O 2.87Å; V78-R80 HydrophobicContact CG1-CG 4.31Å
79	I	98.1	Very high	96.6	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.9	176.7	-63	171.2	0	0	0	108.6	L24 F26 Q36 L38 Y60 V62 I77 F95	L24-I79 HydrophobicContact CD1-CB 4.41Å; L24-I79 HydrophobicContact CD1-CD1 3.5Å; L24-I79 VanDerWaalsContact CD1-CD1 3.5Å; L24-I79 HydrophobicContact CD1-CG2 4.36Å; F26-I79 HydrophobicContact CZ-CG2 4.13Å; Q36-I79 PolarHBondContact N-O 2.84Å; Q36-I79 PolarHBondContact O-N 2.84Å; L38-I79 HydrophobicContact CB-CD1 4.17Å; L38-I79 HydrophobicContact CD2-CD1 4.22Å; Y60-I79 HydrophobicContact CD1-CG2 4.18Å; V62-I79 HydrophobicContact CG1-CG1 4.37Å; V62-I79 HydrophobicContact CG2-CG1 4.35Å; I77-I79 HydrophobicContact CG2-CG1 4.43Å; I79-F95 HydrophobicContact CD1-CD1 4.22Å; I79-F95 HydrophobicContact CD1-CD2 4.32Å; I79-F95 HydrophobicContact CD1-CE1 4.29Å; I79-F95 HydrophobicContact CD1-CE2 4.38Å; I79-F95 HydrophobicContact CD1-CG 4.23Å; I79-F95 HydrophobicContact CD1-CZ 4.36Å; I79-F95 HydrophobicContact CG2-CE1 4.04Å; I79-F95 HydrophobicContact CG2-CE2 4.01Å; I79-F95 HydrophobicContact CG2-CZ 3.49Å; I79-F95 VanDerWaalsContact CG2-CZ 3.49Å
80	R	97.7	Very high	96.5	Very high	111 Å²	111	68.8 Å²	68.8	42%	0.419	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.3	180	-65.4	177.9	-179.5	-109.4	7.6	111	H34 K35 Y60 V61 V78	H34-R80 CarbonylContact O-C 3.55Å; H34-R80 WeakPolarHBondContact O-CA 3.31Å; K35-R80 HydrophobicContact CB-CG 4.42Å; K35-R80 HydrophobicContact CG-CG 4.28Å; Y60-R80 CarbonylContact C-O 3.42Å; Y60-R80 VanDerWaalsContact CA-O 3.22Å; Y60-R80 WeakPolarHBondContact CA-O 3.21Å; V61-R80 PolarHBondContact N-O 2.67Å; V61-R80 PolarHBondContact O-N 3.21Å; V78-R80 HydrophobicContact CG1-CG 4.31Å
81	H	97.4	Very high	96.4	Very high	9 Å²	9	64.1 Å²	64.1	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.5	167.6	-155.9	-52.7	0	0	0	109.3	F26 H34 Y60 D83	F26-H81 HydrophobicContact CD1-CB 3.64Å; F26-H81 AromaticContact CD2-CD2 3.94Å; F26-H81 HydrophobicContact CE1-CB 3.92Å; F26-H81 HydrophobicContact CG-CB 4.05Å; F26-H81 AromaticContact CG-CD2 3.85Å; H34-H81 PolarHBondContact O-N 3.44Å; Y60-H81 HydrophobicContact CD1-CB 4.31Å; Y60-H81 HydrophobicContact CE1-CB 4.22Å; Y60-H81 AromaticContact CE1-CD2 3.21Å; Y60-H81 WeakPolarHBondContact CE1-CD2 3.25Å; Y60-H81 AromaticContact CE1-CG 3.83Å; Y60-H81 AromaticContact CE1-NE2 3.74Å; Y60-H81 AromaticContact CZ-CD2 3.62Å; Y60-H81 AromaticContact CZ-NE2 3.64Å; Y60-H81 PolarHBondContact OH-NE2 2.72Å; H81-D83 PolarHBondContact CE1-O 3.13Å; H81-D83 PolarHBondContact ND1-N 3.17Å
82	R	95.9	Very high	96.4	Very high	174 Å²	174	67.2 Å²	67.2	66%	0.657	36%	0.355	S	S	*	.			trans	-111.6	-25.5	-178.6	-68.2	-168.5	172.9	-179.1	-1.3	113.8	K59 V61	K59-R82 PolarHBondContact O-N 3.26Å; V61-R82 HydrophobicContact CG2-CG 4.49Å
83	D	95.7	Very high	96.4	Very high	33 Å²	33	63.3 Å²	63.3	18%	0.176	34%	0.336	C	S	.	.			trans	-114.7	78.7	-171.5	-168.7	-14.2	0	0	0	112.7	K59 H81 R85 H88	K59-D83 HydrophobicContact CB-CB 4.42Å; K59-D83 HydrophobicContact CG-CB 4.4Å; H81-D83 PolarHBondContact CE1-O 3.13Å; H81-D83 PolarHBondContact ND1-N 3.17Å; D83-R85 PolarHBondContact O-N 3.1Å; D83-R85 VanDerWaalsContact O-N 3.17Å; D83-R85 VanDerWaalsContact OD1-CG 3.31Å; D83-R85 WeakPolarHBondContact OD1-CG 3.22Å; D83-R85 IonicContact OD1-CZ 3.58Å; D83-R85 IonicContact OD1-NE 3.4Å; D83-R85 PolarHBondContact OD1-NE 3.13Å; D83-R85 IonicContact OD1-NH2 3.6Å; D83-R85 IonicContact OD2-CZ 3.45Å; D83-R85 IonicContact OD2-NE 3.44Å; D83-R85 PolarHBondContact OD2-NE 3.11Å; D83-R85 IonicContact OD2-NH2 2.7Å; D83-R85 PolarHBondContact OD2-NH2 2.76Å; D83-H88 PolarHBondContact O-ND1 3.44Å; D83-H88 VanDerWaalsContact O-ND1 3.13Å; D83-H88 IonicContact OD1-CE1 3.21Å; D83-H88 PolarHBondContact OD1-CE1 3Å; D83-H88 IonicContact OD1-ND1 2.68Å; D83-H88 IonicContact OD2-CE1 3.23Å; D83-H88 PolarHBondContact OD2-CE1 3.46Å; D83-H88 IonicContact OD2-ND1 2.72Å
84	V	94.8	Very high	96.4	Very high	43 Å²	43	65.1 Å²	65.1	26%	0.261	34%	0.338	S	S	.	.			trans	-87.3	30.9	-172	-62.4	0	0	0	0	114.7	L117	V84-L117 HydrophobicContact CB-CD2 4.28Å; V84-L117 HydrophobicContact CG1-CD1 4.18Å; V84-L117 HydrophobicContact CG1-CD2 4.45Å
85	R	95.9	Very high	96.4	Very high	143 Å²	143	61.1 Å²	61.1	54%	0.54	31%	0.312	S	S	.	.			trans	-70.4	149.1	177.5	-68	-179.4	-68.8	162.6	-1.1	111.8	D83 C87 H88	D83-R85 PolarHBondContact O-N 3.1Å; D83-R85 VanDerWaalsContact O-N 3.17Å; D83-R85 VanDerWaalsContact OD1-CG 3.31Å; D83-R85 WeakPolarHBondContact OD1-CG 3.22Å; D83-R85 IonicContact OD1-CZ 3.58Å; D83-R85 IonicContact OD1-NE 3.4Å; D83-R85 PolarHBondContact OD1-NE 3.13Å; D83-R85 IonicContact OD1-NH2 3.6Å; D83-R85 IonicContact OD2-CZ 3.45Å; D83-R85 IonicContact OD2-NE 3.44Å; D83-R85 PolarHBondContact OD2-NE 3.11Å; D83-R85 IonicContact OD2-NH2 2.7Å; D83-R85 PolarHBondContact OD2-NH2 2.76Å; R85-C87 PolarHBondContact O-N 2.75Å; R85-C87 VanDerWaalsContact O-N 3.14Å; R85-H88 PolarHBondContact NH2-CE1 2.84Å; R85-H88 PolarHBondContact O-N 2.94Å
86	S	95.2	Very high	96.3	Very high	90 Å²	90	64.1 Å²	64.1	63%	0.629	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-59.5	-25	179.1	54.9	0	0	0	0	114.7	H88 Y89	S86-H88 PolarHBondContact O-N 2.88Å; S86-H88 VanDerWaalsContact O-N 3.13Å; S86-Y89 PolarHBondContact O-N 2.84Å
87	C	94.6	Very high	96.2	Very high	80 Å²	80	59.3 Å²	59.3	54%	0.541	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-65.9	-10	174.6	61.8	0	0	0	0	114.1	R85	R85-C87 PolarHBondContact O-N 2.75Å; R85-C87 VanDerWaalsContact O-N 3.14Å
88	H	94.8	Very high	96.1	Very high	27 Å²	27	61.4 Å²	61.4	13%	0.125	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-105.5	0.8	177.8	-56.6	139.7	0	0	0	113.5	D83 R85 S86 G90 V91 L117	D83-H88 PolarHBondContact O-ND1 3.44Å; D83-H88 VanDerWaalsContact O-ND1 3.13Å; D83-H88 IonicContact OD1-CE1 3.21Å; D83-H88 PolarHBondContact OD1-CE1 3Å; D83-H88 IonicContact OD1-ND1 2.68Å; D83-H88 IonicContact OD2-CE1 3.23Å; D83-H88 PolarHBondContact OD2-CE1 3.46Å; D83-H88 IonicContact OD2-ND1 2.72Å; R85-H88 PolarHBondContact NH2-CE1 2.84Å; R85-H88 PolarHBondContact O-N 2.94Å; S86-H88 PolarHBondContact O-N 2.88Å; S86-H88 VanDerWaalsContact O-N 3.13Å; H88-G90 PolarHBondContact O-N 3.17Å; H88-V91 WeakPolarHBondContact O-CB 3.22Å; H88-V91 PolarHBondContact O-N 3.27Å; H88-L117 HydrophobicContact CB-CD2 4.09Å
89	Y	95.8	Very high	96	Very high	86 Å²	86	60 Å²	60	34%	0.337	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-66.4	135.1	-179.1	-63.7	-6.2	0	0	0	111.1	A28 S86 V91 L117 P119	A28-Y89 HydrophobicContact CB-CE1 3.48Å; A28-Y89 VanDerWaalsContact CB-CE1 3.48Å; A28-Y89 VanDerWaalsContact CB-CZ 3.49Å; A28-Y89 WeakPolarHBondContact CB-OH 3.46Å; S86-Y89 PolarHBondContact O-N 2.84Å; Y89-V91 PolarHBondContact O-N 3.3Å; Y89-V91 VanDerWaalsContact O-N 3.14Å; Y89-L117 CarbonylContact C-O 3.52Å; Y89-L117 VanDerWaalsContact CA-O 3.31Å; Y89-L117 WeakPolarHBondContact CA-O 3.18Å; Y89-L117 HydrophobicContact CD1-CD2 3.7Å; Y89-L117 HydrophobicContact CD1-CG 3.85Å; Y89-L117 HydrophobicContact CE1-CD2 3.77Å; Y89-L117 HydrophobicContact CE1-CG 4.09Å; Y89-P119 HydrophobicContact CD2-CB 3.77Å; Y89-P119 HydrophobicContact CD2-CG 4.4Å; Y89-P119 HydrophobicContact CE2-CB 3.72Å
90	G	93.5	Very high	95.7	Very high	47 Å²	47	61 Å²	61	49%	0.485	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	1.3	-179	0	0	0	0	0	114.8	H88 L117	H88-G90 PolarHBondContact O-N 3.17Å; G90-L117 PolarHBondContact N-O 2.57Å
91	V	95.6	Very high	95.2	Very high	57 Å²	57	57.1 Å²	57.1	35%	0.345	29%	0.288	S	S	.	.			trans	-75.8	128.2	175.4	179.2	0	0	0	0	109.2	H88 Y89	H88-V91 WeakPolarHBondContact O-CB 3.22Å; H88-V91 PolarHBondContact O-N 3.27Å; Y89-V91 PolarHBondContact O-N 3.3Å; Y89-V91 VanDerWaalsContact O-N 3.14Å
92	I	96.4	Very high	94.2	Very high	115 Å²	115	61.7 Å²	61.7	59%	0.59	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	107.9	178	-56.6	173.8	0	0	0	109	V114	I92-V114 HydrophobicContact CG2-CB 4.11Å; I92-V114 HydrophobicContact CG2-CG1 4.1Å
93	D	96.9	Very high	93.2	Very high	8 Å²	8	57.8 Å²	57.8	4%	0.043	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	158.4	170.5	-66.1	-57	0	0	0	110.1	T56 K59 Y60 V114 A115	T56-D93 WeakPolarHBondContact CB-OD1 3.43Å; T56-D93 VanDerWaalsContact OG1-CG 3.27Å; T56-D93 PolarHBondContact OG1-OD1 3.48Å; K59-D93 VanDerWaalsContact CD-OD2 3.3Å; K59-D93 WeakPolarHBondContact CD-OD2 3.46Å; K59-D93 VanDerWaalsContact NZ-CG 3.28Å; K59-D93 IonicContact NZ-OD1 3.53Å; K59-D93 PolarHBondContact NZ-OD1 3.41Å; K59-D93 IonicContact NZ-OD2 3.9Å; K59-D93 PolarHBondContact NZ-OD2 2.7Å; Y60-D93 HydrophobicContact CE2-CB 3.65Å; Y60-D93 WeakPolarHBondContact CE2-OD2 3.36Å; Y60-D93 PolarHBondContact OH-OD2 3.5Å; Y60-D93 VanDerWaalsContact OH-OD2 3.1Å; D93-V114 WeakPolarHBondContact O-CA 3.08Å; D93-A115 PolarHBondContact N-O 2.86Å; D93-A115 PolarHBondContact O-N 3.3Å
94	K	97.2	Very high	92.1	Very high	90 Å²	90	60.3 Å²	60.3	39%	0.391	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.5	-176.2	-63.7	-175.3	174.1	-165	0	112.7	T55 E112	T55-K94 HydrophobicContact CG2-CB 3.92Å; T55-K94 PolarHBondContact N-O 2.8Å; T55-K94 VanDerWaalsContact N-O 3.09Å; T55-K94 PolarHBondContact OG1-N 2.87Å; T55-K94 VanDerWaalsContact OG1-N 3.07Å; T55-K94 PolarHBondContact OG1-O 3Å; K94-E112 IonicContact NZ-OE2 2.76Å; K94-E112 PolarHBondContact NZ-OE2 2.91Å
95	F	97.8	Very high	90.7	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.7	165.6	-64.1	-82.8	0	0	0	109.7	L24 V52 L53 C54 Y60 V62 I79 E112 V113 A115	L24-F95 HydrophobicContact CD1-CD2 4.12Å; L24-F95 HydrophobicContact CD1-CE2 4.15Å; V52-F95 HydrophobicContact CG1-CB 4.47Å; V52-F95 HydrophobicContact CG1-CD1 4.16Å; L53-F95 CarbonylContact O-C 3.48Å; L53-F95 VanDerWaalsContact O-CA 3.28Å; L53-F95 WeakPolarHBondContact O-CA 3.23Å; C54-F95 HydrophobicContact CB-CD1 3.87Å; C54-F95 HydrophobicContact CB-CE1 3.77Å; C54-F95 WeakPolarHBondContact SG-CE1 3.42Å; Y60-F95 HydrophobicContact CD1-CE2 4.29Å; Y60-F95 AromaticContact CD1-CZ 3.67Å; Y60-F95 HydrophobicContact CD1-CZ 3.67Å; Y60-F95 AromaticContact CD2-CZ 3.92Å; Y60-F95 HydrophobicContact CD2-CZ 3.92Å; Y60-F95 HydrophobicContact CE1-CE2 4.31Å; Y60-F95 HydrophobicContact CE1-CZ 4.13Å; Y60-F95 HydrophobicContact CE2-CZ 4.38Å; Y60-F95 HydrophobicContact CG-CE1 4.32Å; Y60-F95 HydrophobicContact CG-CE2 4.44Å; Y60-F95 AromaticContact CG-CZ 3.55Å; Y60-F95 HydrophobicContact CG-CZ 3.55Å; V62-F95 HydrophobicContact CG2-CD1 4.18Å; V62-F95 HydrophobicContact CG2-CE1 3.74Å; I79-F95 HydrophobicContact CD1-CD1 4.22Å; I79-F95 HydrophobicContact CD1-CD2 4.32Å; I79-F95 HydrophobicContact CD1-CE1 4.29Å; I79-F95 HydrophobicContact CD1-CE2 4.38Å; I79-F95 HydrophobicContact CD1-CG 4.23Å; I79-F95 HydrophobicContact CD1-CZ 4.36Å; I79-F95 HydrophobicContact CG2-CE1 4.04Å; I79-F95 HydrophobicContact CG2-CE2 4.01Å; I79-F95 HydrophobicContact CG2-CZ 3.49Å; I79-F95 VanDerWaalsContact CG2-CZ 3.49Å; F95-E112 CarbonylContact O-C 3.52Å; F95-E112 WeakPolarHBondContact O-CA 3.5Å; F95-V113 HydrophobicContact CB-CB 4.42Å; F95-V113 PolarHBondContact N-O 2.73Å; F95-V113 PolarHBondContact O-N 3.31Å; F95-A115 HydrophobicContact CD2-CB 3.92Å; F95-A115 HydrophobicContact CE2-CB 3.5Å; F95-A115 VanDerWaalsContact CE2-CB 3.5Å
96	R	96.2	Very high	89.6	Confident	100 Å²	100	68.7 Å²	68.7	38%	0.377	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	111.1	176.1	179	-179.7	-67.3	166.7	-0.6	109.4	L53 Q98 K111 E112	L53-R96 HydrophobicContact CB-CB 4.28Å; L53-R96 PolarHBondContact N-O 3.3Å; L53-R96 PolarHBondContact O-N 2.8Å; R96-Q98 HydrophobicContact CG-CG 4.24Å; R96-K111 CarbonylContact C-O 3.54Å; R96-K111 WeakPolarHBondContact CA-O 3.3Å; R96-E112 IonicContact CZ-OE1 3.52Å; R96-E112 IonicContact NE-OE1 3.34Å; R96-E112 PolarHBondContact NE-OE1 3.1Å; R96-E112 IonicContact NH2-OE1 2.82Å; R96-E112 PolarHBondContact NH2-OE1 3.17Å
97	L	95.9	Very high	88.6	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123.9	169.2	-86.1	77.9	0	0	0	109	V19 L38 L40 V52 I77 R110 K111	V19-L97 HydrophobicContact CG1-CD2 3.79Å; L38-L97 HydrophobicContact CD2-CD1 3.54Å; L38-L97 HydrophobicContact CD2-CD2 4.22Å; L40-L97 HydrophobicContact CB-CD2 4.3Å; L40-L97 HydrophobicContact CD1-CD2 4.3Å; L40-L97 HydrophobicContact CD2-CD2 4.4Å; V52-L97 HydrophobicContact CG1-CD1 4.23Å; V52-L97 HydrophobicContact CG2-CD1 4.39Å; V52-L97 HydrophobicContact CG2-CG 4.19Å; I77-L97 HydrophobicContact CD1-CD2 3.95Å; L97-R110 CarbonylContact O-C 3.25Å; L97-R110 VanDerWaalsContact O-CA 3.23Å; L97-R110 WeakPolarHBondContact O-CA 2.96Å; L97-K111 PolarHBondContact N-O 3.14Å; L97-K111 PolarHBondContact O-N 3.01Å
98	Q	94.9	Very high	88.1	Confident	46 Å²	46	61.5 Å²	61.5	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.5	170.8	-62.9	-174.2	-31.3	0	0	108.4	F50 K51 L53 R96 R110	F50-Q98 CarbonylContact C-O 3.57Å; F50-Q98 VanDerWaalsContact CA-O 3.23Å; F50-Q98 WeakPolarHBondContact CA-O 3.37Å; K51-Q98 PolarHBondContact N-O 2.77Å; K51-Q98 PolarHBondContact O-N 2.79Å; L53-Q98 HydrophobicContact CD1-CG 4.47Å; R96-Q98 HydrophobicContact CG-CG 4.24Å; Q98-R110 HydrophobicContact CG-CG 4.34Å
99	V	94.8	Very high	88	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	148.5	174.6	-56.7	0	0	0	0	110.8	L15 V17 L40 L48 K49 F50 A107 L108 G109	L15-V99 HydrophobicContact CD2-CG2 4.01Å; V17-V99 HydrophobicContact CG1-CG1 4.04Å; V17-V99 HydrophobicContact CG2-CB 4.46Å; V17-V99 HydrophobicContact CG2-CG1 4.19Å; V17-V99 HydrophobicContact CG2-CG2 3.45Å; V17-V99 VanDerWaalsContact CG2-CG2 3.45Å; L40-V99 HydrophobicContact CD1-CG1 4.43Å; L40-V99 HydrophobicContact CD2-CG1 4.26Å; L48-V99 HydrophobicContact CD1-CG1 4.49Å; L48-V99 HydrophobicContact CD2-CB 4.46Å; K49-V99 CarbonylContact O-C 3.52Å; K49-V99 VanDerWaalsContact O-CA 3.28Å; K49-V99 WeakPolarHBondContact O-CA 3.22Å; F50-V99 HydrophobicContact CB-CG1 4.21Å; V99-A107 CarbonylContact O-C 3.52Å; V99-L108 PolarHBondContact O-N 2.87Å; V99-G109 PolarHBondContact N-O 2.68Å; V99-G109 PolarHBondContact O-N 3.2Å; V99-G109 VanDerWaalsContact O-N 3.15Å
100	S	91.9	Very high	87.9	Confident	21 Å²	21	62.3 Å²	62.3	15%	0.147	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.1	176.2	51.1	0	0	0	0	108.8	L48 K49 K106	L48-S100 CarbonylContact C-O 3.59Å; L48-S100 WeakPolarHBondContact CA-O 3.12Å; K49-S100 WeakPolarHBondContact CB-OG 3.48Å; K49-S100 PolarHBondContact N-O 2.89Å; K49-S100 PolarHBondContact O-N 2.82Å; K49-S100 PolarHBondContact O-OG 3.34Å; S100-K106 WeakPolarHBondContact CB-O 3.43Å
101	E	89	Confident	88	Confident	29 Å²	29	63.7 Å²	63.7	14%	0.136	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	140.9	170.5	-178	-175.7	-168.9	0	0	109.5	F46 S103 Q104 L108	F46-E101 HydrophobicContact CD2-CB 4.12Å; F46-E101 HydrophobicContact CD2-CG 3.77Å; F46-E101 HydrophobicContact CE2-CB 4.18Å; F46-E101 HydrophobicContact CE2-CG 4.28Å; F46-E101 HydrophobicContact CG-CG 4.34Å; E101-S103 WeakPolarHBondContact CG-OG 3.28Å; E101-S103 PolarHBondContact O-N 3.14Å; E101-S103 PolarHBondContact OE1-OG 3.29Å; E101-S103 PolarHBondContact OE2-OG 2.98Å; E101-Q104 HydrophobicContact CB-CB 4.42Å; E101-Q104 CarbonylContact O-C 3.58Å; E101-Q104 PolarHBondContact O-N 2.9Å; E101-Q104 PolarHBondContact OE2-NE2 2.83Å; E101-L108 HydrophobicContact CB-CD1 3.5Å; E101-L108 VanDerWaalsContact CB-CD1 3.5Å
102	Q	76.1	Confident	88	Confident	106 Å²	106	64.8 Å²	64.8	50%	0.495	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-33.7	-176.3	179.8	169.7	17.3	0	0	114.5	A47 K49	A47-Q102 HydrophobicContact CB-CB 4.12Å; A47-Q102 PolarHBondContact O-N 3.48Å; K49-Q102 HydrophobicContact CG-CB 4.45Å; K49-Q102 PolarHBondContact NZ-O 2.82Å
103	S	74.3	Confident	88.1	Confident	92 Å²	92	59.3 Å²	59.3	64%	0.643	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-21.8	179.1	56.6	0	0	0	0	113.4	E101	E101-S103 WeakPolarHBondContact CG-OG 3.28Å; E101-S103 PolarHBondContact O-N 3.14Å; E101-S103 PolarHBondContact OE1-OG 3.29Å; E101-S103 PolarHBondContact OE2-OG 2.98Å
104	Q	72	Confident	88.2	Confident	85 Å²	85	61.2 Å²	61.2	40%	0.397	28%	0.28	S	S	.	.			trans	-116.1	135.6	-175.2	-57.4	-167.9	35.1	0	0	111.4	E101 K106	E101-Q104 HydrophobicContact CB-CB 4.42Å; E101-Q104 CarbonylContact O-C 3.58Å; E101-Q104 PolarHBondContact O-N 2.9Å; E101-Q104 PolarHBondContact OE2-NE2 2.83Å; Q104-K106 PolarHBondContact O-N 3.2Å
105	R	65.4	Low	88.2	Confident	254 Å²	254	56.9 Å²	56.9	96%	0.958	26%	0.261	S	S	*	.			trans	-81.4	-2.9	175	-76.6	-173.2	175.4	-175.1	-0.4	114
106	K	73.4	Confident	88.2	Confident	108 Å²	108	58.1 Å²	58.1	47%	0.47	27%	0.269	S	S	.	.	S	Bend	trans	-85.9	133.3	-173.2	-157.6	167.7	177.8	-173.2	0	110	E12 S100 Q104 L108	E12-K106 HydrophobicContact CB-CD 4.5Å; E12-K106 HydrophobicContact CG-CD 4.47Å; E12-K106 HydrophobicContact CG-CG 4.09Å; E12-K106 VanDerWaalsContact OE1-CE 3.31Å; E12-K106 WeakPolarHBondContact OE1-CE 3.32Å; E12-K106 WeakPolarHBondContact OE1-CG 3.18Å; E12-K106 WeakPolarHBondContact OE2-CE 3.23Å; E12-K106 IonicContact OE2-NZ 3.06Å; E12-K106 PolarHBondContact OE2-NZ 2.66Å; S100-K106 WeakPolarHBondContact CB-O 3.43Å; Q104-K106 PolarHBondContact O-N 3.2Å; K106-L108 PolarHBondContact O-N 3.12Å; K106-L108 VanDerWaalsContact O-N 3.15Å
107	A	73.8	Confident	88.2	Confident	18 Å²	18	53.4 Å²	53.4	15%	0.149	25%	0.251	C	S	.	.			trans	-73.1	107.2	-176.8	0	0	0	0	0	110.3	E12 G13 V99	E12-A107 WeakPolarHBondContact CG-O 3.37Å; G13-A107 PolarHBondContact N-O 3.42Å; V99-A107 CarbonylContact O-C 3.52Å
108	L	84.7	Confident	88.3	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	26%	0.26	C	S	.	.			trans	-80.6	-32	-175.6	-61.2	-178.3	0	0	0	112.4	L10 G13 N14 L15 V99 E101 K106	L10-L108 HydrophobicContact CB-CD1 4.39Å; L10-L108 HydrophobicContact CB-CD2 4.19Å; L10-L108 HydrophobicContact CD1-CD1 3.92Å; G13-L108 CarbonylContact C-O 3.55Å; G13-L108 VanDerWaalsContact C-O 3.25Å; G13-L108 VanDerWaalsContact CA-O 3.26Å; G13-L108 WeakPolarHBondContact CA-O 3.31Å; G13-L108 PolarHBondContact N-O 3.4Å; N14-L108 PolarHBondContact N-O 2.71Å; L15-L108 VanDerWaalsContact CB-C 3.49Å; L15-L108 HydrophobicContact CB-CB 3.92Å; L15-L108 WeakPolarHBondContact CB-O 3.24Å; L15-L108 HydrophobicContact CD2-CB 3.83Å; L15-L108 HydrophobicContact CD2-CD1 4.45Å; L15-L108 PolarHBondContact N-O 3.48Å; V99-L108 PolarHBondContact O-N 2.87Å; E101-L108 HydrophobicContact CB-CD1 3.5Å; E101-L108 VanDerWaalsContact CB-CD1 3.5Å; K106-L108 PolarHBondContact O-N 3.12Å; K106-L108 VanDerWaalsContact O-N 3.15Å
109	G	92.3	Very high	88.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.7	-175.6	0	0	0	0	0	113.1	L15 V99	L15-G109 WeakPolarHBondContact O-CA 3.38Å; V99-G109 PolarHBondContact N-O 2.68Å; V99-G109 PolarHBondContact O-N 3.2Å; V99-G109 VanDerWaalsContact O-N 3.15Å
110	R	93.8	Very high	88.2	Confident	131 Å²	131	56 Å²	56	49%	0.494	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.1	178.5	-55.8	-179.4	-171.1	178.4	4.6	111.1	L97 Q98	L97-R110 CarbonylContact O-C 3.25Å; L97-R110 VanDerWaalsContact O-CA 3.23Å; L97-R110 WeakPolarHBondContact O-CA 2.96Å; Q98-R110 HydrophobicContact CG-CG 4.34Å
111	K	95.4	Very high	87.9	Confident	76 Å²	76	56.1 Å²	56.1	33%	0.33	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.5	170.5	178.6	68.3	175.5	-176.3	0	110.3	V17 V19 R96 L97 V113	V17-K111 HydrophobicContact CB-CB 3.83Å; V17-K111 HydrophobicContact CG1-CB 3.87Å; V19-K111 HydrophobicContact CG1-CG 4.25Å; V19-K111 HydrophobicContact CG2-CD 4.41Å; V19-K111 HydrophobicContact CG2-CG 3.7Å; R96-K111 CarbonylContact C-O 3.54Å; R96-K111 WeakPolarHBondContact CA-O 3.3Å; L97-K111 PolarHBondContact N-O 3.14Å; L97-K111 PolarHBondContact O-N 3.01Å; K111-V113 HydrophobicContact CG-CG2 4.32Å
112	E	96.8	Very high	87.5	Confident	80 Å²	80	62.7 Å²	62.7	37%	0.374	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	136	167.9	-59	-162.6	160.7	0	0	109.4	K94 F95 R96	K94-E112 IonicContact NZ-OE2 2.76Å; K94-E112 PolarHBondContact NZ-OE2 2.91Å; F95-E112 CarbonylContact O-C 3.52Å; F95-E112 WeakPolarHBondContact O-CA 3.5Å; R96-E112 IonicContact CZ-OE1 3.52Å; R96-E112 IonicContact NE-OE1 3.34Å; R96-E112 PolarHBondContact NE-OE1 3.1Å; R96-E112 IonicContact NH2-OE1 2.82Å; R96-E112 PolarHBondContact NH2-OE1 3.17Å
113	V	97.8	Very high	87.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.8	172.8	178.9	0	0	0	0	106.5	V19 L24 L38 F95 K111	V19-V113 HydrophobicContact CG2-CG2 3.71Å; L24-V113 HydrophobicContact CD1-CG1 4.28Å; L24-V113 HydrophobicContact CG-CG1 4.09Å; L38-V113 HydrophobicContact CD1-CG1 4.2Å; L38-V113 HydrophobicContact CD1-CG2 4.18Å; L38-V113 HydrophobicContact CD2-CG2 4.17Å; F95-V113 HydrophobicContact CB-CB 4.42Å; F95-V113 PolarHBondContact N-O 2.73Å; F95-V113 PolarHBondContact O-N 3.31Å; K111-V113 HydrophobicContact CG-CG2 4.32Å
114	V	97.9	Very high	87.4	Confident	47 Å²	47	60.3 Å²	60.3	29%	0.285	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	150.3	178.4	-62.9	0	0	0	0	110.3	E23 L24 I92 D93	E23-V114 WeakPolarHBondContact CA-O 3.33Å; E23-V114 HydrophobicContact CB-CG2 3.57Å; L24-V114 PolarHBondContact N-O 3.12Å; I92-V114 HydrophobicContact CG2-CB 4.11Å; I92-V114 HydrophobicContact CG2-CG1 4.1Å; D93-V114 WeakPolarHBondContact O-CA 3.08Å
115	A	97.8	Very high	87.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	135.7	174	0	0	0	0	0	110.7	L24 F26 Y60 D93 F95	L24-A115 HydrophobicContact CB-CB 4.08Å; L24-A115 CarbonylContact O-C 3.55Å; L24-A115 WeakPolarHBondContact O-CA 3.42Å; F26-A115 HydrophobicContact CE2-CB 4.07Å; Y60-A115 HydrophobicContact CE1-CB 4.42Å; D93-A115 PolarHBondContact N-O 2.86Å; D93-A115 PolarHBondContact O-N 3.3Å; F95-A115 HydrophobicContact CD2-CB 3.92Å; F95-A115 HydrophobicContact CE2-CB 3.5Å; F95-A115 VanDerWaalsContact CE2-CB 3.5Å
116	T	97.3	Very high	87.7	Confident	26 Å²	26	58 Å²	58	16%	0.16	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.9	-178.2	-50.5	0	0	0	0	109.6	L24 F26 L118	L24-T116 PolarHBondContact O-N 2.84Å; F26-T116 PolarHBondContact N-O 3.06Å; T116-L118 HydrophobicContact CG2-CD2 3.86Å; T116-L118 HydrophobicContact CG2-CG 4.05Å
117	L	97.4	Very high	87.8	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.7	167.4	179.8	68	0	0	0	109.1	F26 A28 V84 H88 Y89 G90	F26-L117 HydrophobicContact CB-CD1 3.78Å; F26-L117 CarbonylContact O-C 3.59Å; F26-L117 WeakPolarHBondContact O-CA 3.37Å; A28-L117 HydrophobicContact CB-CD1 4.35Å; V84-L117 HydrophobicContact CB-CD2 4.28Å; V84-L117 HydrophobicContact CG1-CD1 4.18Å; V84-L117 HydrophobicContact CG1-CD2 4.45Å; H88-L117 HydrophobicContact CB-CD2 4.09Å; Y89-L117 CarbonylContact C-O 3.52Å; Y89-L117 VanDerWaalsContact CA-O 3.31Å; Y89-L117 WeakPolarHBondContact CA-O 3.18Å; Y89-L117 HydrophobicContact CD1-CD2 3.7Å; Y89-L117 HydrophobicContact CD1-CG 3.85Å; Y89-L117 HydrophobicContact CE1-CD2 3.77Å; Y89-L117 HydrophobicContact CE1-CG 4.09Å; G90-L117 PolarHBondContact N-O 2.57Å
118	L	96.9	Very high	88	Confident	35 Å²	35	63.1 Å²	63.1	18%	0.183	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.2	179.7	-65.6	175.4	0	0	0	110.4	I25 F26 Y27 A28 T116 Q124	I25-L118 HydrophobicContact CG2-CD1 3.73Å; I25-L118 HydrophobicContact CG2-CG 4.45Å; F26-L118 PolarHBondContact O-N 3.1Å; Y27-L118 CarbonylContact C-O 3.49Å; Y27-L118 WeakPolarHBondContact CA-O 3.4Å; Y27-L118 HydrophobicContact CD1-CB 3.86Å; Y27-L118 HydrophobicContact CE1-CB 3.98Å; Y27-L118 HydrophobicContact CE1-CD1 4.33Å; A28-L118 PolarHBondContact N-O 3.49Å; T116-L118 HydrophobicContact CG2-CD2 3.86Å; T116-L118 HydrophobicContact CG2-CG 4.05Å; L118-Q124 VanDerWaalsContact CD1-CD 3.41Å
119	P	94.8	Very high	87.5	Confident	49 Å²	49	69.1 Å²	69.1	32%	0.318	33%	0.328	S	S	.	.	S	Bend	trans	-65.4	-47.7	-175.2	22.3	-31.9	0	0	0	112.5	D29 Y89 E123	D29-P119 PolarHBondContact N-O 2.85Å; Y89-P119 HydrophobicContact CD2-CB 3.77Å; Y89-P119 HydrophobicContact CD2-CG 4.4Å; Y89-P119 HydrophobicContact CE2-CB 3.72Å; P119-E123 WeakPolarHBondContact CG-OE2 3.34Å
120	S	93.6	Very high	86.7	Confident	17 Å²	17	73.7 Å²	73.7	12%	0.119	35%	0.349	C	S	.	.			trans	-147.2	140.2	-176.6	-176.5	0	0	0	0	113.9	D29 K122	D29-S120 WeakPolarHBondContact OD1-CA 3.39Å; D29-S120 WeakPolarHBondContact OD2-CA 3.4Å; D29-S120 WeakPolarHBondContact OD2-CB 3.28Å; D29-S120 PolarHBondContact OD2-OG 3.01Å; S120-K122 PolarHBondContact O-N 3.38Å; S120-K122 PolarHBondContact OG-N 3.29Å
121	A	85.8	Confident	85.9	Confident	24 Å²	24	73.1 Å²	73.1	20%	0.198	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-28.6	173.3	0	0	0	0	0	113.5	Y27 D29	Y27-A121 VanDerWaalsContact CD1-CA 3.44Å; Y27-A121 HydrophobicContact CD1-CB 3.94Å; Y27-A121 HydrophobicContact CD2-CB 3.78Å; Y27-A121 HydrophobicContact CE1-CB 3.97Å; Y27-A121 HydrophobicContact CE2-CB 3.84Å; Y27-A121 HydrophobicContact CG-CB 3.81Å; D29-A121 PolarHBondContact OD1-N 2.78Å
122	K	79.9	Confident	85.2	Confident	166 Å²	166	78.8 Å²	78.8	72%	0.722	37%	0.369	S	S	*	.	H	α-helix	trans	-77.5	-32.3	-176.7	-65.1	-178	-179.8	179.2	0	112.8	S120 Q124 K126	S120-K122 PolarHBondContact O-N 3.38Å; S120-K122 PolarHBondContact OG-N 3.29Å; K122-Q124 VanDerWaalsContact C-N 3.34Å; K122-K126 PolarHBondContact O-N 3.02Å
123	E	74.9	Confident	84.3	Confident	116 Å²	116	79.9 Å²	79.9	54%	0.542	38%	0.376	S	S	.	.	H	α-helix	trans	-67.7	-38.5	179	-69.7	178.2	173.7	0	0	111.1	P119 K126 E127	P119-E123 WeakPolarHBondContact CG-OE2 3.34Å; E123-K126 PolarHBondContact O-N 2.99Å; E123-E127 PolarHBondContact O-N 2.9Å
124	Q	73.3	Confident	83.2	Confident	33 Å²	33	85.4 Å²	85.4	15%	0.154	40%	0.4	C	S	.	.	H	α-helix	trans	-70.8	-37.4	-178.6	-160.3	168.7	-11.1	0	0	113.1	Y27 L118 K122 K126 E127 E128	Y27-Q124 HydrophobicContact CE1-CB 4.4Å; Y27-Q124 VanDerWaalsContact CZ-OE1 3.29Å; Y27-Q124 PolarHBondContact OH-OE1 2.89Å; L118-Q124 VanDerWaalsContact CD1-CD 3.41Å; K122-Q124 VanDerWaalsContact C-N 3.34Å; Q124-K126 VanDerWaalsContact C-N 3.29Å; Q124-K126 PolarHBondContact O-N 3.43Å; Q124-E127 PolarHBondContact O-N 3.3Å; Q124-E128 WeakPolarHBondContact O-CB 3.48Å; Q124-E128 PolarHBondContact O-N 3.31Å
125	Q	71.6	Confident	82	Confident	137 Å²	137	89.3 Å²	89.3	64%	0.64	42%	0.416	S	S	*	.	H	α-helix	trans	-60.2	-41.3	172.4	-73.1	-178.4	-15.6	0	0	111.8	E129	Q125-E129 WeakPolarHBondContact O-CB 3.32Å; Q125-E129 PolarHBondContact O-N 3.41Å
126	K	73.3	Confident	80.6	Confident	152 Å²	152	95.7 Å²	95.7	66%	0.661	45%	0.445	S	S	*	.	H	α-helix	trans	-67.2	-39.7	178.3	-170.4	-179.9	178.8	-174	0	111.8	K122 E123 Q124 E130	K122-K126 PolarHBondContact O-N 3.02Å; E123-K126 PolarHBondContact O-N 2.99Å; Q124-K126 VanDerWaalsContact C-N 3.29Å; Q124-K126 PolarHBondContact O-N 3.43Å; K126-E130 WeakPolarHBondContact O-CB 3.37Å; K126-E130 PolarHBondContact O-N 2.94Å
127	E	75.8	Confident	79.3	Confident	114 Å²	114	99.3 Å²	99.3	53%	0.533	46%	0.463	S	S	.	.	H	α-helix	trans	-72.3	-37.5	179.7	-156.5	177.8	-167.4	0	0	112.4	E123 Q124 E130 K131	E123-E127 PolarHBondContact O-N 2.9Å; Q124-E127 PolarHBondContact O-N 3.3Å; E127-E130 PolarHBondContact O-N 3.47Å; E127-K131 WeakPolarHBondContact O-CB 3.43Å; E127-K131 WeakPolarHBondContact O-CG 3.37Å; E127-K131 PolarHBondContact O-N 2.98Å
128	E	76.5	Confident	77.8	Confident	121 Å²	121	102.3 Å²	102.3	57%	0.565	48%	0.482	S	S	*	.	H	α-helix	trans	-65.8	-41.8	171.6	-79.7	-176.9	175.5	0	0	112.2	Q124 E130 K131 R132	Q124-E128 WeakPolarHBondContact O-CB 3.48Å; Q124-E128 PolarHBondContact O-N 3.31Å; E128-E130 VanDerWaalsContact C-N 3.35Å; E128-K131 PolarHBondContact O-N 2.91Å; E128-R132 WeakPolarHBondContact O-CB 3.49Å; E128-R132 PolarHBondContact O-N 3.34Å
129	E	75.1	Confident	76	Confident	127 Å²	127	107.3 Å²	107.3	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-62	-43.7	175	-170.2	177.2	-174.4	0	0	111	Q125 R132 I133	Q125-E129 WeakPolarHBondContact O-CB 3.32Å; Q125-E129 PolarHBondContact O-N 3.41Å; E129-R132 PolarHBondContact O-N 2.68Å; E129-I133 HydrophobicContact CG-CD1 4.07Å; E129-I133 WeakPolarHBondContact O-CD1 3.39Å; E129-I133 WeakPolarHBondContact O-CG1 3.45Å; E129-I133 PolarHBondContact O-N 3.19Å
130	E	75.4	Confident	74.2	Confident	95 Å²	95	107.5 Å²	107.5	44%	0.444	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.9	-167.2	-174.6	145.6	0	0	112.4	K126 E127 E128 I133 K134	K126-E130 WeakPolarHBondContact O-CB 3.37Å; K126-E130 PolarHBondContact O-N 2.94Å; E127-E130 PolarHBondContact O-N 3.47Å; E128-E130 VanDerWaalsContact C-N 3.35Å; E130-I133 PolarHBondContact O-N 2.91Å; E130-K134 HydrophobicContact CG-CD 4.43Å; E130-K134 WeakPolarHBondContact O-CB 3.42Å; E130-K134 WeakPolarHBondContact O-CG 3.44Å; E130-K134 PolarHBondContact O-N 3.39Å; E130-K134 WeakPolarHBondContact OE1-CE 3.35Å; E130-K134 IonicContact OE1-NZ 2.92Å; E130-K134 PolarHBondContact OE1-NZ 3.05Å
131	K	77.8	Confident	72.6	Confident	119 Å²	119	111.6 Å²	111.6	52%	0.517	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-44.7	174.4	-79.1	177.3	-177.4	173	0	111.3	E127 E128 I133 K134 E135	E127-K131 WeakPolarHBondContact O-CB 3.43Å; E127-K131 WeakPolarHBondContact O-CG 3.37Å; E127-K131 PolarHBondContact O-N 2.98Å; E128-K131 PolarHBondContact O-N 2.91Å; K131-I133 VanDerWaalsContact C-N 3.33Å; K131-I133 PolarHBondContact O-N 3.44Å; K131-K134 PolarHBondContact O-N 2.82Å; K131-E135 WeakPolarHBondContact O-CB 3.47Å; K131-E135 WeakPolarHBondContact O-CG 3.47Å; K131-E135 PolarHBondContact O-N 2.93Å
132	R	78.9	Confident	71	Confident	195 Å²	195	117.2 Å²	117.2	74%	0.736	55%	0.547	S	S	*	.	H	α-helix	trans	-63.9	-39.1	178.8	-159.6	178.4	-168.4	-123.1	1	112.1	E128 E129 H136	E128-R132 WeakPolarHBondContact O-CB 3.49Å; E128-R132 PolarHBondContact O-N 3.34Å; E129-R132 PolarHBondContact O-N 2.68Å; R132-H136 WeakPolarHBondContact O-CB 3.27Å; R132-H136 PolarHBondContact O-N 3.31Å
133	I	77.9	Confident	69.5	Low	103 Å²	103	117.3 Å²	117.3	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-64.9	-44.2	174.1	-68.2	164.2	0	0	0	110.5	E129 E130 K131 H136 L137	E129-I133 HydrophobicContact CG-CD1 4.07Å; E129-I133 WeakPolarHBondContact O-CD1 3.39Å; E129-I133 WeakPolarHBondContact O-CG1 3.45Å; E129-I133 PolarHBondContact O-N 3.19Å; E130-I133 PolarHBondContact O-N 2.91Å; K131-I133 VanDerWaalsContact C-N 3.33Å; K131-I133 PolarHBondContact O-N 3.44Å; I133-H136 PolarHBondContact O-N 2.91Å; I133-L137 WeakPolarHBondContact O-CB 3.21Å; I133-L137 PolarHBondContact O-N 3.44Å
134	K	74.6	Confident	68.2	Low	116 Å²	116	118.5 Å²	118.5	50%	0.504	55%	0.553	S	S	.	*	H	α-helix	trans	-64.6	-40.7	177.3	-81.7	174	169.8	163.3	0	112.7	E130 K131 L137 T138	E130-K134 HydrophobicContact CG-CD 4.43Å; E130-K134 WeakPolarHBondContact O-CB 3.42Å; E130-K134 WeakPolarHBondContact O-CG 3.44Å; E130-K134 PolarHBondContact O-N 3.39Å; E130-K134 WeakPolarHBondContact OE1-CE 3.35Å; E130-K134 IonicContact OE1-NZ 2.92Å; E130-K134 PolarHBondContact OE1-NZ 3.05Å; K131-K134 PolarHBondContact O-N 2.82Å; K134-L137 PolarHBondContact O-N 3.18Å; K134-T138 VanDerWaalsContact O-CB 3.27Å; K134-T138 WeakPolarHBondContact O-CB 3.44Å; K134-T138 PolarHBondContact O-N 2.97Å; K134-T138 PolarHBondContact O-OG1 3.19Å
135	E	73.9	Confident	66.7	Low	130 Å²	130	124.3 Å²	124.3	61%	0.607	58%	0.58	S	S	*	*	H	α-helix	trans	-62.7	-47	175.8	-75.9	172.5	179.3	0	0	110.9	K131 L137 T138 E139	K131-E135 WeakPolarHBondContact O-CB 3.47Å; K131-E135 WeakPolarHBondContact O-CG 3.47Å; K131-E135 PolarHBondContact O-N 2.93Å; E135-L137 VanDerWaalsContact C-N 3.35Å; E135-L137 PolarHBondContact O-N 3.39Å; E135-T138 WeakPolarHBondContact O-CB 3.43Å; E135-T138 PolarHBondContact O-N 3.37Å; E135-E139 WeakPolarHBondContact O-CB 3.43Å; E135-E139 PolarHBondContact O-N 3.43Å
136	H	68.2	Low	65.2	Low	134 Å²	134	122.4 Å²	122.4	62%	0.62	58%	0.582	S	S	*	*	H	α-helix	trans	-64.1	-38.3	176.4	-168.7	-84.9	0	0	0	112.4	R132 I133 T138 S140	R132-H136 WeakPolarHBondContact O-CB 3.27Å; R132-H136 PolarHBondContact O-N 3.31Å; I133-H136 PolarHBondContact O-N 2.91Å; H136-T138 VanDerWaalsContact C-N 3.34Å; H136-S140 WeakPolarHBondContact O-CB 3.43Å; H136-S140 PolarHBondContact O-N 2.7Å; H136-S140 PolarHBondContact O-OG 2.86Å
137	L	69.7	Low	63.5	Low	102 Å²	102	123.4 Å²	123.4	53%	0.534	59%	0.586	S	S	.	*	H	α-helix	trans	-64.2	-42	174.3	-156.9	88.1	0	0	0	110.9	I133 K134 E135 S140 L141	I133-L137 WeakPolarHBondContact O-CB 3.21Å; I133-L137 PolarHBondContact O-N 3.44Å; K134-L137 PolarHBondContact O-N 3.18Å; E135-L137 VanDerWaalsContact C-N 3.35Å; E135-L137 PolarHBondContact O-N 3.39Å; L137-S140 WeakPolarHBondContact CA-OG 3.42Å; L137-S140 PolarHBondContact O-N 3.44Å; L137-S140 PolarHBondContact O-OG 2.83Å; L137-L141 HydrophobicContact CD2-CD1 4.35Å; L137-L141 HydrophobicContact CG-CD1 4.35Å; L137-L141 WeakPolarHBondContact O-CB 3.49Å; L137-L141 WeakPolarHBondContact O-CD1 3.31Å; L137-L141 WeakPolarHBondContact O-CG 3.12Å; L137-L141 PolarHBondContact O-N 3.29Å
138	T	65.6	Low	61.7	Low	64 Å²	64	125.3 Å²	125.3	39%	0.393	60%	0.595	S	S	.	*	H	α-helix	trans	-65.6	-44.7	178.6	-58.7	0	0	0	0	110.7	K134 E135 H136 S140 L141 F142	K134-T138 VanDerWaalsContact O-CB 3.27Å; K134-T138 WeakPolarHBondContact O-CB 3.44Å; K134-T138 PolarHBondContact O-N 2.97Å; K134-T138 PolarHBondContact O-OG1 3.19Å; E135-T138 WeakPolarHBondContact O-CB 3.43Å; E135-T138 PolarHBondContact O-N 3.37Å; H136-T138 VanDerWaalsContact C-N 3.34Å; T138-S140 VanDerWaalsContact C-N 3.33Å; T138-S140 PolarHBondContact O-N 2.89Å; T138-L141 PolarHBondContact O-N 3.01Å; T138-F142 HydrophobicContact CG2-CD2 3.6Å; T138-F142 HydrophobicContact CG2-CE2 3.39Å; T138-F142 WeakPolarHBondContact O-CD2 3.32Å; T138-F142 PolarHBondContact O-N 3.32Å
139	E	58.8	Low	59.8	Low	140 Å²	140	125.5 Å²	125.5	65%	0.654	61%	0.607	S	S	*	*	H	α-helix	trans	-62.7	-38.5	176.1	-157.5	173	-159.7	0	0	111.9	E135 F142 F143	E135-E139 WeakPolarHBondContact O-CB 3.43Å; E135-E139 PolarHBondContact O-N 3.43Å; E139-F142 PolarHBondContact O-N 3.49Å; E139-F143 PolarHBondContact O-N 3.5Å
140	S	58.6	Low	58.1	Low	52 Å²	52	122.3 Å²	122.3	36%	0.364	61%	0.608	S	S	.	*	H	α-helix	trans	-67	-36.7	173.7	70.2	0	0	0	0	113.4	H136 L137 T138 F143 E144	H136-S140 WeakPolarHBondContact O-CB 3.43Å; H136-S140 PolarHBondContact O-N 2.7Å; H136-S140 PolarHBondContact O-OG 2.86Å; L137-S140 WeakPolarHBondContact CA-OG 3.42Å; L137-S140 PolarHBondContact O-N 3.44Å; L137-S140 PolarHBondContact O-OG 2.83Å; T138-S140 VanDerWaalsContact C-N 3.33Å; T138-S140 PolarHBondContact O-N 2.89Å; S140-F143 PolarHBondContact O-N 3.14Å; S140-E144 PolarHBondContact O-N 2.97Å; S140-E144 VanDerWaalsContact O-N 3.13Å
141	L	58.5	Low	56.1	Low	104 Å²	104	127.5 Å²	127.5	55%	0.545	63%	0.629	S	S	.	*	H	α-helix	trans	-69.7	-36.6	174.3	-75.2	159.8	0	0	0	111.8	L137 T138 E144 Q145	L137-L141 HydrophobicContact CD2-CD1 4.35Å; L137-L141 HydrophobicContact CG-CD1 4.35Å; L137-L141 WeakPolarHBondContact O-CB 3.49Å; L137-L141 WeakPolarHBondContact O-CD1 3.31Å; L137-L141 WeakPolarHBondContact O-CG 3.12Å; L137-L141 PolarHBondContact O-N 3.29Å; T138-L141 PolarHBondContact O-N 3.01Å; L141-E144 PolarHBondContact O-N 3.25Å; L141-Q145 WeakPolarHBondContact O-CB 3.5Å; L141-Q145 PolarHBondContact O-N 3.45Å; L141-Q145 VanDerWaalsContact O-N 3.07Å
142	F	52.4	Low	54.4	Low	142 Å²	142	129 Å²	129	62%	0.623	64%	0.643	S	S	*	*	H	α-helix	trans	-68.2	-33.4	174.5	-85.6	-71.7	0	0	0	112.5	T138 E139 Q145	T138-F142 HydrophobicContact CG2-CD2 3.6Å; T138-F142 HydrophobicContact CG2-CE2 3.39Å; T138-F142 WeakPolarHBondContact O-CD2 3.32Å; T138-F142 PolarHBondContact O-N 3.32Å; E139-F142 PolarHBondContact O-N 3.49Å; F142-Q145 PolarHBondContact O-N 2.94Å
143	F	47.8	Very low	52.2	Low	168 Å²	168	131.3 Å²	131.3	74%	0.737	65%	0.652	S	S	*	*	H	α-helix	trans	-71.1	-37.1	174.6	-168.4	-99.8	0	0	0	112.4	E139 S140	E139-F143 PolarHBondContact O-N 3.5Å; S140-F143 PolarHBondContact O-N 3.14Å
144	E	49	Very low	50.1	Low	141 Å²	141	130.5 Å²	130.5	66%	0.659	66%	0.661	S	S	*	*	H	α-helix	trans	-69.6	-27.5	173.7	-91.6	-99	108.4	0	0	113.4	S140 L141	S140-E144 PolarHBondContact O-N 2.97Å; S140-E144 VanDerWaalsContact O-N 3.13Å; L141-E144 PolarHBondContact O-N 3.25Å
145	Q	42	Very low	48.4	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.724	68%	0.676	S	S	*	*	H	α-helix	trans	-81.9	-14.1	-175.2	-163.8	169.7	-18.1	0	0	114	L141 F142	L141-Q145 WeakPolarHBondContact O-CB 3.5Å; L141-Q145 PolarHBondContact O-N 3.45Å; L141-Q145 VanDerWaalsContact O-N 3.07Å; F142-Q145 PolarHBondContact O-N 2.94Å
146	S	39.7	Very low	46.6	Very low	96 Å²	96	130.3 Å²	130.3	67%	0.671	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-0.5	-177.4	-148.1	0	0	0	0	115.1
147	F	38	Very low	45.8	Very low	173 Å²	173	130.4 Å²	130.4	76%	0.759	70%	0.698	S	S	*	*			trans	-133.8	72.2	173	-78.2	-83.1	0	0	0	111.6
148	Q	36.7	Very low	44.9	Very low	155 Å²	155	128.3 Å²	128.3	72%	0.724	70%	0.701	S	S	*	*			trans	-128.8	108.5	157	-69.9	-146.2	12.5	0	0	111.5
149	P	38.2	Very low	44.2	Very low	125 Å²	125	130.5 Å²	130.5	81%	0.812	72%	0.716	S	S	*	*			trans	-88.5	115.4	135.4	31.5	-19.2	0	0	0	107.4
150	G	38.6	Very low	44.4	Very low	60 Å²	60	126.5 Å²	126.5	62%	0.619	70%	0.703	S	S	*	*			trans	-59.7	138.9	177.4	0	0	0	0	0	112.5
151	K	34.1	Very low	44.4	Very low	204 Å²	204	130.4 Å²	130.4	89%	0.887	72%	0.72	S	S	*	*			trans	-173.1	133.6	132.3	-112.2	150.9	177	165.3	0	111.6
152	N	41.8	Very low	44.4	Very low	150 Å²	150	132 Å²	132	80%	0.802	73%	0.728	S	S	*	*			trans	-38.6	131.5	165.9	-52.1	-34.5	0	0	0	113.6
153	R	32.6	Very low	44.9	Very low	243 Å²	243	127.6 Å²	127.6	92%	0.917	71%	0.713	S	S	*	*				158.3	127.9	119.7	-88.6	178.1	174.6	173.2	-0.7	111.6
154	A	34.2	Very low	45.8	Very low	87 Å²	87	123.5 Å²	123.5	72%	0.719	70%	0.701	S	S	*	*			trans	26.4	123.8	137.7	0	0	0	0	0	120.6
155	V	38	Very low	46.8	Very low	138 Å²	138	123.6 Å²	123.6	84%	0.836	70%	0.7	S	S	*	*			trans	82.4	139.5	130.9	174.5	0	0	0	0	118.8
156	S	35.3	Very low	48	Very low	103 Å²	103	120.6 Å²	120.6	72%	0.72	69%	0.688	S	S	*	*			trans	82.5	97.3	160.1	73	0	0	0	0	120
157	S	52.1	Low	49.3	Very low	136 Å²	136	116.6 Å²	116.6	95%	0.951	66%	0.662	S	S	*	*				19.2	107.7	120.5	-145.4	0	0	0	0	117.5
158	G	51.8	Low	50.8	Low	58 Å²	58	112.5 Å²	112.5	60%	0.598	65%	0.651	S	S	*	*	S	Bend	trans	150.7	139	165.9	0	0	0	0	0	112.1	S160	G158-S160 PolarHBondContact O-N 2.85Å; G158-S160 VanDerWaalsContact O-N 3.16Å
159	P	50.3	Low	52.1	Low	110 Å²	110	109.4 Å²	109.4	71%	0.714	64%	0.642	S	S	*	*			trans	-63.2	119.5	175.7	25.5	-31.5	0	0	0	109.1
160	S	62.2	Low	53.1	Low	56 Å²	56	104.2 Å²	104.2	39%	0.392	61%	0.609	S	S	.	*			trans	-61.6	142.1	-171.5	83.6	0	0	0	0	111.5	G158 L162 T163 V164	G158-S160 PolarHBondContact O-N 2.85Å; G158-S160 VanDerWaalsContact O-N 3.16Å; S160-L162 PolarHBondContact O-N 2.95Å; S160-T163 WeakPolarHBondContact O-CB 3.42Å; S160-T163 PolarHBondContact O-N 2.96Å; S160-T163 PolarHBondContact OG-OG1 3.36Å; S160-V164 PolarHBondContact O-N 2.7Å
161	L	59.7	Low	54.3	Low	134 Å²	134	105.4 Å²	105.4	70%	0.702	60%	0.6	S	S	*	*	H	α-helix	trans	-48.9	-26.3	172.5	-95.7	160.1	0	0	0	113.3	V164 F165	L161-V164 PolarHBondContact O-N 3.43Å; L161-F165 WeakPolarHBondContact O-CB 3.3Å; L161-F165 PolarHBondContact O-N 3.04Å
162	L	58.5	Low	55.6	Low	138 Å²	138	98 Å²	98	72%	0.723	58%	0.578	S	S	*	*	H	α-helix	trans	-67.1	-39.9	177.1	-62.1	173.5	0	0	0	112.3	S160 V164 F165 L166	S160-L162 PolarHBondContact O-N 2.95Å; L162-V164 VanDerWaalsContact C-N 3.32Å; L162-F165 PolarHBondContact O-N 2.89Å; L162-L166 WeakPolarHBondContact O-CB 3.41Å; L162-L166 PolarHBondContact O-N 3.13Å
163	T	63.3	Low	56.4	Low	49 Å²	49	93 Å²	93	30%	0.301	56%	0.557	S	S	.	*	H	α-helix	trans	-65.6	-40	176.4	-47.3	0	0	0	0	110.5	S160 L166 G167 I207 I211	S160-T163 WeakPolarHBondContact O-CB 3.42Å; S160-T163 PolarHBondContact O-N 2.96Å; S160-T163 PolarHBondContact OG-OG1 3.36Å; T163-L166 PolarHBondContact O-N 3.07Å; T163-G167 PolarHBondContact O-N 3.41Å; T163-I207 HydrophobicContact CG2-CG2 3.95Å; T163-I211 HydrophobicContact CG2-CD1 4.02Å; T163-I211 HydrophobicContact CG2-CG1 4.48Å
164	V	65.1	Low	57.5	Low	82 Å²	82	85.2 Å²	85.2	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-65.9	-45.9	175.5	-178.4	0	0	0	0	110.7	S160 L161 L162 L166 G167 V168	S160-V164 PolarHBondContact O-N 2.7Å; L161-V164 PolarHBondContact O-N 3.43Å; L162-V164 VanDerWaalsContact C-N 3.32Å; V164-L166 VanDerWaalsContact C-N 3.34Å; V164-L166 PolarHBondContact O-N 3.44Å; V164-G167 PolarHBondContact O-N 2.96Å; V164-V168 VanDerWaalsContact O-CG2 3.3Å; V164-V168 WeakPolarHBondContact O-CG2 3.3Å; V164-V168 PolarHBondContact O-N 3.48Å
165	F	70.2	Confident	58.4	Low	144 Å²	144	88.4 Å²	88.4	63%	0.632	54%	0.535	S	S	*	.	H	α-helix	trans	-59.3	-44.1	176.3	-113.4	-88.1	0	0	0	112.1	L161 L162 V168 V169	L161-F165 WeakPolarHBondContact O-CB 3.3Å; L161-F165 PolarHBondContact O-N 3.04Å; L162-F165 PolarHBondContact O-N 2.89Å; F165-V168 PolarHBondContact O-N 2.91Å; F165-V169 VanDerWaalsContact O-CG2 3.3Å; F165-V169 WeakPolarHBondContact O-CG2 3.34Å; F165-V169 PolarHBondContact O-N 3.43Å
166	L	68.5	Low	59	Low	92 Å²	92	87.4 Å²	87.4	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-64.7	-41.6	178.7	-171	62.4	0	0	0	111.6	L162 T163 V164 V169 C170 I207	L162-L166 WeakPolarHBondContact O-CB 3.41Å; L162-L166 PolarHBondContact O-N 3.13Å; T163-L166 PolarHBondContact O-N 3.07Å; V164-L166 VanDerWaalsContact C-N 3.34Å; V164-L166 PolarHBondContact O-N 3.44Å; L166-V169 PolarHBondContact O-N 2.98Å; L166-C170 PolarHBondContact O-N 3.34Å; L166-C170 PolarHBondContact O-SG 2.95Å; L166-C170 VanDerWaalsContact O-SG 3.34Å; L166-I207 HydrophobicContact CD2-CD1 3.81Å; L166-I207 HydrophobicContact CG-CD1 4.11Å
167	G	65.6	Low	59.4	Low	12 Å²	12	88.2 Å²	88.2	12%	0.124	53%	0.527	C	S	.	.	H	α-helix	trans	-60.5	-43.2	172.9	0	0	0	0	0	112.8	T163 V164 C170 I171	T163-G167 PolarHBondContact O-N 3.41Å; V164-G167 PolarHBondContact O-N 2.96Å; G167-C170 PolarHBondContact O-N 2.99Å; G167-I171 VanDerWaalsContact O-CG1 3.28Å; G167-I171 WeakPolarHBondContact O-CG1 3.43Å; G167-I171 PolarHBondContact O-N 3.41Å
168	V	69.3	Low	59	Low	87 Å²	87	86.9 Å²	86.9	53%	0.527	51%	0.513	S	S	.	.	H	α-helix	trans	-64.4	-41.7	177.1	172.1	0	0	0	0	111.5	V164 F165 C170 I171 A172	V164-V168 VanDerWaalsContact O-CG2 3.3Å; V164-V168 WeakPolarHBondContact O-CG2 3.3Å; V164-V168 PolarHBondContact O-N 3.48Å; F165-V168 PolarHBondContact O-N 2.91Å; V168-C170 VanDerWaalsContact C-N 3.34Å; V168-C170 PolarHBondContact O-N 3.27Å; V168-I171 PolarHBondContact O-N 3.46Å; V168-A172 WeakPolarHBondContact O-CB 3.33Å; V168-A172 PolarHBondContact O-N 3.02Å
169	V	65.1	Low	58.4	Low	89 Å²	89	92.7 Å²	92.7	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-40.8	175.7	171.1	0	0	0	0	111.1	F165 L166 A172 A173	F165-V169 VanDerWaalsContact O-CG2 3.3Å; F165-V169 WeakPolarHBondContact O-CG2 3.34Å; F165-V169 PolarHBondContact O-N 3.43Å; L166-V169 PolarHBondContact O-N 2.98Å; V169-A172 PolarHBondContact O-N 3.46Å; V169-A173 PolarHBondContact O-N 2.92Å
170	C	58.6	Low	58.2	Low	16 Å²	16	90.9 Å²	90.9	11%	0.108	53%	0.528	C	S	.	.	H	α-helix	trans	-66.1	-40.1	175.2	-72.3	0	0	0	0	112.7	L166 G167 V168 A173 L174 L204	L166-C170 PolarHBondContact O-N 3.34Å; L166-C170 PolarHBondContact O-SG 2.95Å; L166-C170 VanDerWaalsContact O-SG 3.34Å; G167-C170 PolarHBondContact O-N 2.99Å; V168-C170 VanDerWaalsContact C-N 3.34Å; V168-C170 PolarHBondContact O-N 3.27Å; C170-A173 PolarHBondContact O-N 3.13Å; C170-L174 WeakPolarHBondContact O-CG 3.4Å; C170-L174 PolarHBondContact O-N 3.45Å; C170-L174 VanDerWaalsContact O-N 3.15Å; C170-L204 HydrophobicContact CB-CD1 3.96Å
171	I	63.7	Low	56.9	Low	85 Å²	85	95.3 Å²	95.3	44%	0.436	55%	0.548	S	S	.	.	H	α-helix	trans	-65.8	-42.7	175.5	-68.7	166.8	0	0	0	110.5	G167 V168 A173 L174 M175	G167-I171 VanDerWaalsContact O-CG1 3.28Å; G167-I171 WeakPolarHBondContact O-CG1 3.43Å; G167-I171 PolarHBondContact O-N 3.41Å; V168-I171 PolarHBondContact O-N 3.46Å; I171-A173 VanDerWaalsContact C-N 3.31Å; I171-A173 PolarHBondContact O-N 3.5Å; I171-L174 PolarHBondContact O-N 3.34Å; I171-L174 VanDerWaalsContact O-N 3.1Å; I171-M175 HydrophobicContact CG2-CG 4.32Å; I171-M175 WeakPolarHBondContact O-CG 3.49Å; I171-M175 PolarHBondContact O-N 3.16Å
172	A	61.8	Low	56.2	Low	50 Å²	50	94.8 Å²	94.8	41%	0.413	55%	0.55	S	S	.	.	H	α-helix	trans	-60.9	-39.6	176.5	0	0	0	0	0	112	V168 V169 L174 M175 L176	V168-A172 WeakPolarHBondContact O-CB 3.33Å; V168-A172 PolarHBondContact O-N 3.02Å; V169-A172 PolarHBondContact O-N 3.46Å; A172-L174 VanDerWaalsContact C-N 3.3Å; A172-L174 PolarHBondContact O-N 3.43Å; A172-M175 PolarHBondContact O-N 3.21Å; A172-L176 VanDerWaalsContact O-CD1 3.29Å; A172-L176 WeakPolarHBondContact O-CD1 3.42Å; A172-L176 PolarHBondContact O-N 3.29Å
173	A	58.3	Low	55.4	Low	45 Å²	45	97 Å²	97	37%	0.372	56%	0.557	S	S	.	*	H	α-helix	trans	-66.1	-29.6	174.7	0	0	0	0	0	113.4	V169 C170 I171	V169-A173 PolarHBondContact O-N 2.92Å; C170-A173 PolarHBondContact O-N 3.13Å; I171-A173 VanDerWaalsContact C-N 3.31Å; I171-A173 PolarHBondContact O-N 3.5Å
174	L	57.1	Low	54.3	Low	78 Å²	78	99.7 Å²	99.7	41%	0.408	58%	0.577	S	S	.	*	H	α-helix	trans	-79.9	-27.1	174.9	-70.1	172	0	0	0	112.9	C170 I171 A172 L176 L204	C170-L174 WeakPolarHBondContact O-CG 3.4Å; C170-L174 PolarHBondContact O-N 3.45Å; C170-L174 VanDerWaalsContact O-N 3.15Å; I171-L174 PolarHBondContact O-N 3.34Å; I171-L174 VanDerWaalsContact O-N 3.1Å; A172-L174 VanDerWaalsContact C-N 3.3Å; A172-L174 PolarHBondContact O-N 3.43Å; L174-L176 VanDerWaalsContact C-N 3.3Å; L174-L204 HydrophobicContact CD1-CD2 3.73Å
175	M	52.4	Low	53.6	Low	154 Å²	154	103.3 Å²	103.3	76%	0.759	59%	0.593	S	S	*	*	S	Bend	trans	-80.5	-6.4	175.6	-69.4	-67.7	-156.6	0	0	113.5	I171 A172	I171-M175 HydrophobicContact CG2-CG 4.32Å; I171-M175 WeakPolarHBondContact O-CG 3.49Å; I171-M175 PolarHBondContact O-N 3.16Å; A172-M175 PolarHBondContact O-N 3.21Å
176	L	51.2	Low	52.5	Low	118 Å²	118	103.1 Å²	103.1	62%	0.618	60%	0.603	S	S	*	*	S	Bend	trans	-72.6	124.6	175.6	-109.4	76.4	0	0	0	110.9	A172 L174 T178	A172-L176 VanDerWaalsContact O-CD1 3.29Å; A172-L176 WeakPolarHBondContact O-CD1 3.42Å; A172-L176 PolarHBondContact O-N 3.29Å; L174-L176 VanDerWaalsContact C-N 3.3Å; L176-T178 PolarHBondContact O-N 2.99Å
177	P	42	Very low	51.4	Low	120 Å²	120	104.4 Å²	104.4	78%	0.779	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-62	133.1	-173.7	22.1	-31	0	0	0	112.3
178	T	44.2	Very low	50.5	Low	107 Å²	107	112.6 Å²	112.6	66%	0.656	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.3	169.5	35.3	0	0	0	0	110.8	L176 G180	L176-T178 PolarHBondContact O-N 2.99Å; T178-G180 PolarHBondContact O-N 3.5Å; T178-G180 VanDerWaalsContact O-N 3.16Å
179	M	39.4	Very low	49.4	Very low	180 Å²	180	119.2 Å²	119.2	89%	0.887	67%	0.674	S	S	*	*	S	Bend	trans	-40.1	115.7	173.1	-75.5	-83.1	98.2	0	0	112.6
180	G	46.9	Very low	48.6	Very low	72 Å²	72	122.1 Å²	122.1	74%	0.742	69%	0.686	S	S	*	*			trans	173.1	34.4	179	0	0	0	0	0	112.4	T178	T178-G180 PolarHBondContact O-N 3.5Å; T178-G180 VanDerWaalsContact O-N 3.16Å
181	D	34	Very low	47.9	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	72%	0.722	S	S	*	*	S	Bend	trans	-152.6	143.9	154	-142.5	-11.5	0	0	0	110.6
182	V	46	Very low	47.2	Very low	123 Å²	123	130.3 Å²	130.3	75%	0.745	72%	0.723	S	S	*	*			trans	-70.6	150.3	-171.3	-87.9	0	0	0	0	111.8
183	E	40.7	Very low	47	Very low	185 Å²	185	130.4 Å²	130.4	86%	0.864	72%	0.72	S	S	*	*			trans	104.3	97.7	165.6	-51.9	-155.9	156.8	0	0	118.8
184	S	40.9	Very low	46.9	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	74%	0.735	S	S	*	*			trans	78	121.1	130.4	-98	0	0	0	0	123.1
185	L	49.6	Very low	46.7	Very low	158 Å²	158	135 Å²	135	83%	0.827	74%	0.743	S	S	*	*			trans	80.7	58.8	134.5	-65.5	164.1	0	0	0	120
186	V	46.4	Very low	46.9	Very low	141 Å²	141	132.3 Å²	132.3	86%	0.855	73%	0.729	S	S	*	*			trans	-144.3	140.5	149.3	-171	0	0	0	0	110.4
187	P	45.7	Very low	47.2	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	71%	0.713	S	S	*	*			trans	-76	155.9	-156.8	-13.5	28.7	0	0	0	117.9	Y189	P187-Y189 PolarHBondContact O-N 3.05Å
188	L	47.3	Very low	48.2	Very low	184 Å²	184	129.4 Å²	129.4	96%	0.963	70%	0.703	S	S	*	*	S	Bend	trans	-52.8	56.3	-177.8	-107.8	93.7	0	0	0	118.6
189	Y	46.9	Very low	49.4	Very low	225 Å²	225	128.3 Å²	128.3	88%	0.882	70%	0.696	S	S	*	*	S	Bend	trans	-136.6	6.6	170	-140.1	-97.3	0	0	0	116.2	P187	P187-Y189 PolarHBondContact O-N 3.05Å
190	L	46.7	Very low	50.6	Low	151 Å²	151	120.9 Å²	120.9	79%	0.791	66%	0.664	S	S	*	*			trans	-124.2	47.9	-177.2	-102.1	158.8	0	0	0	112.1	L192	L190-L192 HydrophobicContact CD2-CD1 4.09Å; L190-L192 PolarHBondContact O-N 3.46Å
191	H	45.2	Very low	51.7	Low	184 Å²	184	119.7 Å²	119.7	85%	0.852	65%	0.647	S	S	*	*			trans	-79.2	77.9	171.4	-144.8	-95.5	0	0	0	109.3	S193	H191-S193 PolarHBondContact O-N 3.03Å
192	L	48.3	Very low	53.7	Low	89 Å²	89	120 Å²	120	47%	0.466	64%	0.638	S	S	.	*			trans	-70.4	99.3	-174.9	-146.6	80.1	0	0	0	109.8	L190 Q196	L190-L192 HydrophobicContact CD2-CD1 4.09Å; L190-L192 PolarHBondContact O-N 3.46Å; L192-Q196 VanDerWaalsContact CA-OE1 3.31Å; L192-Q196 HydrophobicContact CD1-CB 4.4Å; L192-Q196 HydrophobicContact CG-CB 4Å; L192-Q196 VanDerWaalsContact CG-OE1 3.28Å
193	S	56.9	Low	55.1	Low	51 Å²	51	117.5 Å²	117.5	36%	0.357	62%	0.62	S	S	.	*			trans	-66.7	153.9	-176.6	80.1	0	0	0	0	111.6	H191 N195 Q196	H191-S193 PolarHBondContact O-N 3.03Å; S193-N195 PolarHBondContact O-N 2.74Å; S193-Q196 PolarHBondContact O-N 3.28Å
194	V	57.2	Low	56.6	Low	111 Å²	111	110.5 Å²	110.5	67%	0.673	59%	0.588	S	S	*	*	H	α-helix	trans	-47.7	-31.2	176.6	179.6	0	0	0	0	112.3	Q196 K197 L198	V194-Q196 PolarHBondContact O-N 3.39Å; V194-K197 PolarHBondContact O-N 3.4Å; V194-L198 HydrophobicContact CG1-CD1 4.49Å; V194-L198 PolarHBondContact O-N 2.96Å; V194-L198 VanDerWaalsContact O-N 3.14Å
195	N	52.8	Low	58.2	Low	109 Å²	109	107.4 Å²	107.4	58%	0.583	57%	0.573	S	S	*	*	H	α-helix	trans	-64.5	-34.8	177.1	-60.9	-44	0	0	0	113.6	S193 K197 L198 V199	S193-N195 PolarHBondContact O-N 2.74Å; N195-K197 VanDerWaalsContact C-N 3.32Å; N195-K197 PolarHBondContact O-N 3.38Å; N195-L198 PolarHBondContact O-N 3.44Å; N195-V199 VanDerWaalsContact O-CG2 3.31Å; N195-V199 WeakPolarHBondContact O-CG2 3.43Å; N195-V199 PolarHBondContact O-N 2.94Å
196	Q	57.2	Low	59.5	Low	98 Å²	98	104.1 Å²	104.1	46%	0.458	56%	0.556	S	S	.	*	H	α-helix	trans	-70.4	-30.7	176.5	-81.2	171.1	-48.9	0	0	112.1	L192 S193 V194 V199 A200	L192-Q196 VanDerWaalsContact CA-OE1 3.31Å; L192-Q196 HydrophobicContact CD1-CB 4.4Å; L192-Q196 HydrophobicContact CG-CB 4Å; L192-Q196 VanDerWaalsContact CG-OE1 3.28Å; S193-Q196 PolarHBondContact O-N 3.28Å; V194-Q196 PolarHBondContact O-N 3.39Å; Q196-V199 PolarHBondContact O-N 3.43Å; Q196-A200 WeakPolarHBondContact O-CB 3.46Å; Q196-A200 PolarHBondContact O-N 3.44Å
197	K	56.2	Low	60.6	Low	64 Å²	64	98.8 Å²	98.8	28%	0.278	52%	0.522	S	S	.	.	H	α-helix	trans	-68.6	-39.4	172.1	-72.2	-174.3	169.8	-173.9	0	111.9	V194 N195 A200 A201	V194-K197 PolarHBondContact O-N 3.4Å; N195-K197 VanDerWaalsContact C-N 3.32Å; N195-K197 PolarHBondContact O-N 3.38Å; K197-A200 PolarHBondContact O-N 2.88Å; K197-A201 WeakPolarHBondContact O-CB 3.31Å; K197-A201 PolarHBondContact O-N 3.01Å
198	L	62.8	Low	61.7	Low	112 Å²	112	96.6 Å²	96.6	59%	0.586	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-43.1	173.7	-74.9	166.6	0	0	0	111.9	V194 N195 A201 Y202	V194-L198 HydrophobicContact CG1-CD1 4.49Å; V194-L198 PolarHBondContact O-N 2.96Å; V194-L198 VanDerWaalsContact O-N 3.14Å; N195-L198 PolarHBondContact O-N 3.44Å; L198-A201 PolarHBondContact O-N 2.99Å; L198-Y202 VanDerWaalsContact O-CB 3.3Å; L198-Y202 WeakPolarHBondContact O-CB 3.41Å; L198-Y202 PolarHBondContact O-N 3.36Å
199	V	70.6	Confident	62.8	Low	84 Å²	84	93 Å²	93	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-43.8	176.1	173.2	0	0	0	0	111.1	N195 Q196 Y202 I203	N195-V199 VanDerWaalsContact O-CG2 3.31Å; N195-V199 WeakPolarHBondContact O-CG2 3.43Å; N195-V199 PolarHBondContact O-N 2.94Å; Q196-V199 PolarHBondContact O-N 3.43Å; V199-Y202 PolarHBondContact O-N 3.48Å; V199-I203 HydrophobicContact CG1-CD1 3.85Å; V199-I203 HydrophobicContact CG1-CG1 4.5Å; V199-I203 VanDerWaalsContact O-CG1 3.3Å; V199-I203 WeakPolarHBondContact O-CG1 3.29Å; V199-I203 PolarHBondContact O-N 2.9Å
200	A	63.9	Low	63.6	Low	24 Å²	24	85.3 Å²	85.3	20%	0.198	47%	0.469	C	S	.	.	H	α-helix	trans	-64.2	-43.1	177.5	0	0	0	0	0	112.5	Q196 K197 Y202 I203 L204	Q196-A200 WeakPolarHBondContact O-CB 3.46Å; Q196-A200 PolarHBondContact O-N 3.44Å; K197-A200 PolarHBondContact O-N 2.88Å; A200-Y202 VanDerWaalsContact C-N 3.34Å; A200-Y202 PolarHBondContact O-N 2.91Å; A200-I203 PolarHBondContact O-N 3.4Å; A200-L204 WeakPolarHBondContact O-CB 3.36Å; A200-L204 PolarHBondContact O-N 3.49Å
201	A	71.3	Confident	64.3	Low	48 Å²	48	82.1 Å²	82.1	40%	0.397	45%	0.452	S	S	.	.	H	α-helix	trans	-63.9	-39.1	175.8	0	0	0	0	0	112.1	K197 L198 L204 G205	K197-A201 WeakPolarHBondContact O-CB 3.31Å; K197-A201 PolarHBondContact O-N 3.01Å; L198-A201 PolarHBondContact O-N 2.99Å; A201-L204 PolarHBondContact O-N 3.31Å; A201-G205 PolarHBondContact O-N 3.3Å
202	Y	75.7	Confident	65.2	Low	155 Å²	155	80 Å²	80	61%	0.608	45%	0.446	S	S	*	.	H	α-helix	trans	-63.9	-48	176.1	177.4	-105.3	0	0	0	112.1	L198 V199 A200 L204 G205 L206	L198-Y202 VanDerWaalsContact O-CB 3.3Å; L198-Y202 WeakPolarHBondContact O-CB 3.41Å; L198-Y202 PolarHBondContact O-N 3.36Å; V199-Y202 PolarHBondContact O-N 3.48Å; A200-Y202 VanDerWaalsContact C-N 3.34Å; A200-Y202 PolarHBondContact O-N 2.91Å; Y202-L204 VanDerWaalsContact C-N 3.31Å; Y202-L204 PolarHBondContact O-N 3.15Å; Y202-G205 PolarHBondContact O-N 3.04Å; Y202-G205 VanDerWaalsContact O-N 3.13Å; Y202-L206 HydrophobicContact CD1-CD1 4.08Å; Y202-L206 HydrophobicContact CE1-CD1 3.46Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.46Å; Y202-L206 HydrophobicContact CE1-CG 4.12Å; Y202-L206 HydrophobicContact CE2-CD2 4.41Å; Y202-L206 HydrophobicContact CE2-CG 4.41Å; Y202-L206 PolarHBondContact O-N 2.95Å
203	I	76	Confident	65.2	Low	71 Å²	71	85.6 Å²	85.6	36%	0.364	46%	0.461	S	S	.	.	H	α-helix	trans	-60.6	-42.5	177.5	-67.7	169.2	0	0	0	110.6	V199 A200 G205 L206 I207	V199-I203 HydrophobicContact CG1-CD1 3.85Å; V199-I203 HydrophobicContact CG1-CG1 4.5Å; V199-I203 VanDerWaalsContact O-CG1 3.3Å; V199-I203 WeakPolarHBondContact O-CG1 3.29Å; V199-I203 PolarHBondContact O-N 2.9Å; A200-I203 PolarHBondContact O-N 3.4Å; I203-G205 VanDerWaalsContact C-N 3.32Å; I203-G205 PolarHBondContact O-N 2.93Å; I203-L206 PolarHBondContact O-N 3.29Å; I203-I207 HydrophobicContact CG2-CD1 3.87Å; I203-I207 WeakPolarHBondContact O-CG1 3.36Å; I203-I207 PolarHBondContact O-N 3.43Å
204	L	70.6	Confident	64.8	Low	38 Å²	38	91.2 Å²	91.2	20%	0.199	49%	0.493	C	S	.	.	H	α-helix	trans	-62.2	-40.4	175.8	-171.6	68.9	0	0	0	111.9	C170 L174 A200 A201 Y202 I207 T208	C170-L204 HydrophobicContact CB-CD1 3.96Å; L174-L204 HydrophobicContact CD1-CD2 3.73Å; A200-L204 WeakPolarHBondContact O-CB 3.36Å; A200-L204 PolarHBondContact O-N 3.49Å; A201-L204 PolarHBondContact O-N 3.31Å; Y202-L204 VanDerWaalsContact C-N 3.31Å; Y202-L204 PolarHBondContact O-N 3.15Å; L204-I207 PolarHBondContact O-N 3.4Å; L204-T208 WeakPolarHBondContact O-CB 3.28Å; L204-T208 PolarHBondContact O-N 3.37Å; L204-T208 PolarHBondContact O-OG1 3.16Å
205	G	75.8	Confident	65.2	Low	40 Å²	40	90.2 Å²	90.2	41%	0.412	48%	0.484	S	S	.	.	H	α-helix	trans	-59.4	-44.9	174	0	0	0	0	0	112.8	A201 Y202 I203 T208 M209	A201-G205 PolarHBondContact O-N 3.3Å; Y202-G205 PolarHBondContact O-N 3.04Å; Y202-G205 VanDerWaalsContact O-N 3.13Å; I203-G205 VanDerWaalsContact C-N 3.32Å; I203-G205 PolarHBondContact O-N 2.93Å; G205-T208 PolarHBondContact O-N 3.04Å; G205-M209 WeakPolarHBondContact O-CB 3.43Å; G205-M209 PolarHBondContact O-N 3.27Å
206	L	75.7	Confident	65.8	Low	89 Å²	89	89.2 Å²	89.2	47%	0.466	48%	0.479	S	S	.	.	H	α-helix	trans	-63.4	-43.7	176.8	-68	-179	0	0	0	112.3	Y202 I203 M209 A210	Y202-L206 HydrophobicContact CD1-CD1 4.08Å; Y202-L206 HydrophobicContact CE1-CD1 3.46Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.46Å; Y202-L206 HydrophobicContact CE1-CG 4.12Å; Y202-L206 HydrophobicContact CE2-CD2 4.41Å; Y202-L206 HydrophobicContact CE2-CG 4.41Å; Y202-L206 PolarHBondContact O-N 2.95Å; I203-L206 PolarHBondContact O-N 3.29Å; L206-M209 PolarHBondContact O-N 3.1Å; L206-A210 WeakPolarHBondContact O-CB 3.3Å; L206-A210 PolarHBondContact O-N 3.47Å
207	I	69.9	Low	66.3	Low	29 Å²	29	88.7 Å²	88.7	15%	0.149	48%	0.48	C	S	.	.	H	α-helix	trans	-63.9	-44.9	178.7	-67.1	167.8	0	0	0	110.5	T163 L166 I203 L204 M209 A210 I211	T163-I207 HydrophobicContact CG2-CG2 3.95Å; L166-I207 HydrophobicContact CD2-CD1 3.81Å; L166-I207 HydrophobicContact CG-CD1 4.11Å; I203-I207 HydrophobicContact CG2-CD1 3.87Å; I203-I207 WeakPolarHBondContact O-CG1 3.36Å; I203-I207 PolarHBondContact O-N 3.43Å; L204-I207 PolarHBondContact O-N 3.4Å; I207-M209 VanDerWaalsContact C-N 3.34Å; I207-M209 PolarHBondContact O-N 3.32Å; I207-A210 PolarHBondContact O-N 2.92Å; I207-I211 HydrophobicContact CG2-CD1 3.8Å; I207-I211 VanDerWaalsContact O-CG1 3.31Å; I207-I211 WeakPolarHBondContact O-CG1 3.42Å; I207-I211 PolarHBondContact O-N 3.45Å
208	T	69.6	Low	66.9	Low	72 Å²	72	90.2 Å²	90.2	44%	0.442	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-41.5	179.5	-50.8	0	0	0	0	111	L204 G205 A210 I211 L212	L204-T208 WeakPolarHBondContact O-CB 3.28Å; L204-T208 PolarHBondContact O-N 3.37Å; L204-T208 PolarHBondContact O-OG1 3.16Å; G205-T208 PolarHBondContact O-N 3.04Å; T208-A210 PolarHBondContact O-N 3.38Å; T208-I211 PolarHBondContact O-N 2.86Å; T208-L212 HydrophobicContact CG2-CD1 4.05Å; T208-L212 PolarHBondContact O-N 2.96Å
209	M	69.3	Low	67.1	Low	110 Å²	110	88.8 Å²	88.8	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-66.2	-37.9	177.9	-156.8	-161.1	172.7	0	0	112	G205 L206 I207 R213	G205-M209 WeakPolarHBondContact O-CB 3.43Å; G205-M209 PolarHBondContact O-N 3.27Å; L206-M209 PolarHBondContact O-N 3.1Å; I207-M209 VanDerWaalsContact C-N 3.34Å; I207-M209 PolarHBondContact O-N 3.32Å; M209-R213 WeakPolarHBondContact O-CB 3.3Å; M209-R213 PolarHBondContact O-N 3.42Å
210	A	63.4	Low	66.9	Low	63 Å²	63	89.1 Å²	89.1	52%	0.521	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-39.4	176.5	0	0	0	0	0	112.4	L206 I207 T208 R213	L206-A210 WeakPolarHBondContact O-CB 3.3Å; L206-A210 PolarHBondContact O-N 3.47Å; I207-A210 PolarHBondContact O-N 2.92Å; T208-A210 PolarHBondContact O-N 3.38Å; A210-R213 PolarHBondContact O-N 2.88Å
211	I	62.9	Low	67.1	Low	83 Å²	83	93.8 Å²	93.8	43%	0.426	51%	0.505	S	S	.	.	H	α-helix	trans	-70.4	-36.2	177.9	-65.4	167.6	0	0	0	111.8	T163 I207 T208 R213 T214	T163-I211 HydrophobicContact CG2-CD1 4.02Å; T163-I211 HydrophobicContact CG2-CG1 4.48Å; I207-I211 HydrophobicContact CG2-CD1 3.8Å; I207-I211 VanDerWaalsContact O-CG1 3.31Å; I207-I211 WeakPolarHBondContact O-CG1 3.42Å; I207-I211 PolarHBondContact O-N 3.45Å; T208-I211 PolarHBondContact O-N 2.86Å; I211-R213 VanDerWaalsContact C-N 3.26Å; I211-R213 PolarHBondContact O-N 3.28Å; I211-T214 PolarHBondContact O-OG1 2.94Å
212	L	62.8	Low	66.8	Low	141 Å²	141	97.3 Å²	97.3	74%	0.738	51%	0.514	S	S	*	.	H	α-helix	trans	-72.1	-18.7	175.8	-91.9	153.3	0	0	0	113.6	T208	T208-L212 HydrophobicContact CG2-CD1 4.05Å; T208-L212 PolarHBondContact O-N 2.96Å
213	R	49.4	Very low	66.1	Low	205 Å²	205	92.5 Å²	92.5	77%	0.774	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-14.4	-179.6	-124.6	-177.7	-179.7	154	-0.6	113.8	M209 A210 I211	M209-R213 WeakPolarHBondContact O-CB 3.3Å; M209-R213 PolarHBondContact O-N 3.42Å; A210-R213 PolarHBondContact O-N 2.88Å; I211-R213 VanDerWaalsContact C-N 3.26Å; I211-R213 PolarHBondContact O-N 3.28Å
214	T	47.6	Very low	65.2	Low	169 Å²	169	94.5 Å²	94.5	100%	1.037	52%	0.519	S	S	*	.			trans	-90.6	0	168.9	40.9	0	0	0	0	110.9	I211	I211-T214 PolarHBondContact O-OG1 2.94Å

Retrieved 214 of 214 residues in 54.5 ms (Link to these results)

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