A0A087Y4J3_POEFO Loading...

Ras homolog family member V

AlphaFold DB , UniProt , Accession A0A087Y4J3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 236 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.2	Very low	32	Very low	234 Å²	234	140.2 Å²	140.2	100%	1.153	69%	0.686	S	S	*	*				0	118.3	0	-83.5	171.7	155.2	0	0	107.1
2	P	29.1	Very low	31.8	Very low	121 Å²	121	136.6 Å²	136.6	79%	0.786	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-69.3	142.4	175.2	29.4	-31	0	0	0	109.3
3	P	30.7	Very low	31.5	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-62.6	135.3	179.1	23.8	-30.8	0	0	0	110.6	M5	P3-M5 PolarHBondContact O-N 3.08Å
4	Q	31.7	Very low	31.6	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.1	170.1	-80.3	175.3	-77.8	0	0	109
5	M	39.7	Very low	31.3	Very low	64 Å²	64	138.5 Å²	138.5	32%	0.315	70%	0.7	S	S	.	*			trans	-98.6	111.1	176.2	-143.2	175.3	176.9	0	0	106.7	P3 Y7 Q70 V71	P3-M5 PolarHBondContact O-N 3.08Å; M5-Y7 HydrophobicContact CB-CD2 4.5Å; M5-Y7 HydrophobicContact CB-CE2 3.98Å; M5-Y7 HydrophobicContact CE-CE1 4.29Å; M5-Y7 HydrophobicContact CG-CE1 4.37Å; M5-Y7 HydrophobicContact CG-CE2 4.43Å; M5-Y7 PolarHBondContact O-N 3.49Å; M5-Y7 HydrophobicContact SD-CE1 3.88Å; M5-Y7 HydrophobicContact SD-CE2 4.27Å; M5-Y7 VanDerWaalsContact SD-CZ 3.52Å; M5-Y7 PolarHBondContact SD-OH 3.48Å; M5-Q70 VanDerWaalsContact CE-O 3.3Å; M5-Q70 WeakPolarHBondContact CE-O 3.48Å; M5-V71 HydrophobicContact CE-CB 3.78Å; M5-V71 HydrophobicContact CE-CG1 3.12Å
6	D	32.6	Very low	31.4	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	71%	0.708	S	S	*	*			trans	-81.9	104.3	175.3	-71.5	-31.9	0	0	0	108.7
7	Y	43.8	Very low	31.4	Very low	87 Å²	87	134.5 Å²	134.5	34%	0.341	71%	0.71	S	S	.	*			trans	-86	119.8	176	-65	-78.1	0	0	0	110.4	M5 Y50 I51	M5-Y7 HydrophobicContact CB-CD2 4.5Å; M5-Y7 HydrophobicContact CB-CE2 3.98Å; M5-Y7 HydrophobicContact CE-CE1 4.29Å; M5-Y7 HydrophobicContact CG-CE1 4.37Å; M5-Y7 HydrophobicContact CG-CE2 4.43Å; M5-Y7 PolarHBondContact O-N 3.49Å; M5-Y7 HydrophobicContact SD-CE1 3.88Å; M5-Y7 HydrophobicContact SD-CE2 4.27Å; M5-Y7 VanDerWaalsContact SD-CZ 3.52Å; M5-Y7 PolarHBondContact SD-OH 3.48Å; Y7-Y50 PolarHBondContact OH-O 3.49Å; Y7-I51 HydrophobicContact CD1-CG2 4.33Å; Y7-I51 HydrophobicContact CE1-CG2 4.42Å; Y7-I51 WeakPolarHBondContact CE2-O 3.47Å
8	F	30.7	Very low	31.6	Very low	171 Å²	171	134.9 Å²	134.9	75%	0.75	72%	0.724	S	S	*	*			trans	-95	108.2	161.7	-74.8	-85.7	0	0	0	108.7	H10	F8-H10 PolarHBondContact O-N 3.07Å
9	Y	31.1	Very low	31.3	Very low	169 Å²	169	130.9 Å²	130.9	66%	0.663	72%	0.718	S	S	*	*			trans	-72.3	105.4	168.7	-169.2	-101.1	0	0	0	108.4	E11	Y9-E11 HydrophobicContact CD1-CB 4Å; Y9-E11 HydrophobicContact CE1-CB 3.49Å; Y9-E11 VanDerWaalsContact CE1-CB 3.49Å; Y9-E11 HydrophobicContact CE1-CG 3.67Å
10	H	28.6	Very low	31.7	Very low	165 Å²	165	133.8 Å²	133.8	76%	0.764	73%	0.731	S	S	*	*			trans	-96.5	100.4	161.7	-97.3	-67.5	0	0	0	108.1	F8 S12	F8-H10 PolarHBondContact O-N 3.07Å; H10-S12 PolarHBondContact O-N 3.44Å
11	E	29.6	Very low	31.6	Very low	101 Å²	101	133.6 Å²	133.6	47%	0.472	74%	0.735	S	S	.	*			trans	-70.1	84.6	165.9	-150.8	-178.1	173.8	0	0	108.3	Y9 R13	Y9-E11 HydrophobicContact CD1-CB 4Å; Y9-E11 HydrophobicContact CE1-CB 3.49Å; Y9-E11 VanDerWaalsContact CE1-CB 3.49Å; Y9-E11 HydrophobicContact CE1-CG 3.67Å; E11-R13 HydrophobicContact CG-CG 4.09Å; E11-R13 PolarHBondContact O-N 3.42Å; E11-R13 IonicContact OE1-CZ 3.58Å; E11-R13 IonicContact OE1-NE 3.08Å; E11-R13 PolarHBondContact OE1-NE 3.34Å; E11-R13 IonicContact OE1-NH2 3.54Å; E11-R13 PolarHBondContact OE1-NH2 3.25Å; E11-R13 IonicContact OE2-NE 3.9Å; E11-R13 IonicContact OE2-NH2 2.96Å
12	S	29.4	Very low	32.1	Very low	97 Å²	97	134 Å²	134	68%	0.678	72%	0.723	S	S	*	*			trans	-77.3	77.4	162.4	45.4	0	0	0	0	108.1	H10 V14	H10-S12 PolarHBondContact O-N 3.44Å; S12-V14 PolarHBondContact O-N 3.47Å
13	R	28.1	Very low	32.6	Very low	189 Å²	189	137.5 Å²	137.5	71%	0.713	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-60.8	118.8	157.9	-74.8	-173.6	-166.6	172.2	9.7	106.6	E11 P15	E11-R13 HydrophobicContact CG-CG 4.09Å; E11-R13 PolarHBondContact O-N 3.42Å; E11-R13 IonicContact OE1-CZ 3.58Å; E11-R13 IonicContact OE1-NE 3.08Å; E11-R13 PolarHBondContact OE1-NE 3.34Å; E11-R13 IonicContact OE1-NH2 3.54Å; E11-R13 PolarHBondContact OE1-NH2 3.25Å; E11-R13 IonicContact OE2-NE 3.9Å; E11-R13 IonicContact OE2-NH2 2.96Å; R13-P15 VanDerWaalsContact O-CD 3.31Å; R13-P15 WeakPolarHBondContact O-CD 3.29Å
14	V	33.6	Very low	33	Very low	136 Å²	136	140 Å²	140	82%	0.824	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-53.8	120.6	172.7	-147.8	0	0	0	0	107.7	S12 S16	S12-V14 PolarHBondContact O-N 3.47Å; V14-S16 PolarHBondContact O-N 3Å
15	P	26.8	Very low	33.6	Very low	113 Å²	113	140.3 Å²	140.3	73%	0.734	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.4	122.5	171.7	-16.1	29.7	0	0	0	108	R13 A17	R13-P15 VanDerWaalsContact O-CD 3.31Å; R13-P15 WeakPolarHBondContact O-CD 3.29Å; P15-A17 PolarHBondContact O-N 3.49Å
16	S	33.4	Very low	34.5	Very low	120 Å²	120	141.8 Å²	141.8	84%	0.839	75%	0.746	S	S	*	*	S	Bend	trans	-62.9	101.1	165	57.1	0	0	0	0	108.9	V14	V14-S16 PolarHBondContact O-N 3Å
17	A	31.2	Very low	36	Very low	89 Å²	89	138.4 Å²	138.4	74%	0.736	73%	0.728	S	S	*	*	S	Bend	trans	167.4	138.9	146.6	0	0	0	0	0	110.2	P15 G19	P15-A17 PolarHBondContact O-N 3.49Å; A17-G19 PolarHBondContact O-N 3.1Å
18	C	34.9	Very low	36.9	Very low	143 Å²	143	138.9 Å²	138.9	97%	0.966	74%	0.742	S	S	*	*			trans	-32.3	117.1	167.9	-72.6	0	0	0	0	113.8
19	G	25.3	Very low	39.2	Very low	59 Å²	59	136.5 Å²	136.5	61%	0.608	74%	0.737	S	S	*	*			trans	-164.8	85	171	0	0	0	0	0	109.2	A17 T21	A17-G19 PolarHBondContact O-N 3.1Å; G19-T21 PolarHBondContact O-N 3.42Å
20	L	38.9	Very low	42	Very low	188 Å²	188	129.9 Å²	129.9	98%	0.984	71%	0.714	S	S	*	*			trans	-55.4	103.4	168.1	-80.2	155.5	0	0	0	108.6
21	T	30.2	Very low	45	Very low	130 Å²	130	122.3 Å²	122.3	80%	0.798	68%	0.679	S	S	*	*			trans	-116.6	113.7	162.9	48.3	0	0	0	0	108.1	G19	G19-T21 PolarHBondContact O-N 3.42Å
22	R	34.3	Very low	48.1	Very low	243 Å²	243	117.8 Å²	117.8	92%	0.917	66%	0.658	S	S	*	*			trans	23.3	110.6	153.5	-66.4	176.8	139.5	137.7	-3.5	116.5	D24	R22-D24 PolarHBondContact O-N 3.25Å
23	E	40.7	Very low	51.2	Low	194 Å²	194	113.1 Å²	113.1	91%	0.907	63%	0.626	S	S	*	*			trans	-1.8	110.6	162.7	-63.4	178.5	161.3	0	0	115	E25	E23-E25 PolarHBondContact O-N 3.31Å
24	D	39.3	Very low	54.4	Low	163 Å²	163	104.1 Å²	104.1	87%	0.872	59%	0.592	S	S	*	*			trans	-48.5	99.4	170.6	-67.7	-57.1	0	0	0	111	R22 L26	R22-D24 PolarHBondContact O-N 3.25Å; D24-L26 VanDerWaalsContact C-N 3.3Å; D24-L26 PolarHBondContact O-N 3.41Å
25	E	43.7	Very low	57.5	Low	194 Å²	194	97.7 Å²	97.7	91%	0.907	55%	0.553	S	S	*	*			trans	-71.2	93.3	165.7	-136	178.4	-173.2	0	0	106.7	E23 D27	E23-E25 PolarHBondContact O-N 3.31Å; E25-D27 PolarHBondContact O-N 3.02Å
26	L	57.5	Low	60.8	Low	95 Å²	95	92.3 Å²	92.3	50%	0.497	52%	0.518	S	S	.	.			trans	-53.2	110.3	175.7	-146.7	86.6	0	0	0	108.3	D24 P28 H101	D24-L26 VanDerWaalsContact C-N 3.3Å; D24-L26 PolarHBondContact O-N 3.41Å; L26-P28 VanDerWaalsContact O-CD 3.24Å; L26-P28 WeakPolarHBondContact O-CD 3.48Å; L26-H101 HydrophobicContact CD1-CB 4.33Å
27	D	64.6	Low	63.8	Low	61 Å²	61	86.6 Å²	86.6	33%	0.326	48%	0.478	S	S	.	.			trans	-58	111	179.3	-179.4	-7	0	0	0	107.9	E25 D29 V30 K79	E25-D27 PolarHBondContact O-N 3.02Å; D27-D29 PolarHBondContact O-N 3.29Å; D27-D29 PolarHBondContact OD1-N 2.98Å; D27-V30 HydrophobicContact CB-CB 4.47Å; D27-V30 HydrophobicContact CB-CG2 3.73Å; D27-V30 PolarHBondContact O-N 3.41Å; D27-K79 IonicContact OD2-NZ 2.76Å; D27-K79 PolarHBondContact OD2-NZ 3.37Å
28	P	63.2	Low	66.9	Low	96 Å²	96	83.4 Å²	83.4	62%	0.623	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.1	-171.8	25.3	-34.2	0	0	0	112.6	L26 K207	L26-P28 VanDerWaalsContact O-CD 3.24Å; L26-P28 WeakPolarHBondContact O-CD 3.48Å; P28-K207 PolarHBondContact O-NZ 2.96Å
29	D	78.7	Confident	69.6	Low	122 Å²	122	78.1 Å²	78.1	65%	0.652	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.7	-178.5	-62.7	-27.9	0	0	0	113.2	D27	D27-D29 PolarHBondContact O-N 3.29Å; D27-D29 PolarHBondContact OD1-N 2.98Å
30	V	89.6	Confident	72.7	Confident	29 Å²	29	78.5 Å²	78.5	18%	0.176	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136.1	172.6	-178.1	0	0	0	0	109.9	D27 K79 Q81 K207	D27-V30 HydrophobicContact CB-CB 4.47Å; D27-V30 HydrophobicContact CB-CG2 3.73Å; D27-V30 PolarHBondContact O-N 3.41Å; V30-K79 HydrophobicContact CB-CB 4.43Å; V30-K79 HydrophobicContact CG1-CB 4.48Å; V30-K79 HydrophobicContact CG2-CB 3.87Å; V30-K79 HydrophobicContact CG2-CD 3.88Å; V30-Q81 HydrophobicContact CG1-CB 3.94Å; V30-K207 PolarHBondContact O-NZ 3.49Å
31	I	92.4	Very high	75.4	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.036	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.8	172.3	-62.9	179.8	0	0	0	109.6	V78 K79 I80 Q81 D103 I200 A203 I204	I31-V78 HydrophobicContact CD1-CG1 3.57Å; I31-V78 HydrophobicContact CG1-CG1 4.05Å; I31-K79 PolarHBondContact N-O 3.13Å; I31-I80 HydrophobicContact CB-CG2 4.3Å; I31-I80 CarbonylContact O-C 3.4Å; I31-I80 WeakPolarHBondContact O-CA 3.26Å; I31-Q81 PolarHBondContact O-N 3.05Å; I31-D103 WeakPolarHBondContact CA-OD2 3.41Å; I31-D103 HydrophobicContact CG2-CB 4.24Å; I31-I200 HydrophobicContact CD1-CG2 4.22Å; I31-A203 HydrophobicContact CD1-CB 4.43Å; I31-A203 HydrophobicContact CG2-CB 3.49Å; I31-A203 VanDerWaalsContact CG2-CB 3.49Å; I31-I204 HydrophobicContact CD1-CD1 3.99Å; I31-I204 HydrophobicContact CD1-CG1 3.37Å
32	S	93.9	Very high	78.4	Confident	5 Å²	5	63.8 Å²	63.8	4%	0.035	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	109.2	177.3	-60.5	0	0	0	0	111.1	Q81 D103 V104	S32-Q81 CarbonylContact C-O 3.47Å; S32-Q81 WeakPolarHBondContact CA-O 3.35Å; S32-Q81 PolarHBondContact OG-OE1 3.16Å; S32-D103 PolarHBondContact N-OD2 3.38Å; S32-D103 PolarHBondContact O-N 3.19Å; S32-V104 PolarHBondContact O-N 2.94Å
33	C	95.5	Very high	81.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	117.5	175.1	-60.7	0	0	0	0	109.6	Q81 L82 L83 V104	C33-Q81 PolarHBondContact N-O 3.41Å; C33-L82 HydrophobicContact CB-CD2 3.73Å; C33-L82 WeakPolarHBondContact O-CA 3.45Å; C33-L83 PolarHBondContact O-N 3.29Å; C33-V104 HydrophobicContact CB-CG1 3.97Å; C33-V104 WeakPolarHBondContact SG-CG1 3.19Å
34	M	95.9	Very high	83.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.2	-178	-168.9	172.4	-173.4	0	0	111.6	V36 L83 T85 R95 Y99 A102 V104 F105 L106	M34-V36 HydrophobicContact CE-CG1 4.39Å; M34-V36 HydrophobicContact CG-CG1 4.1Å; M34-V36 HydrophobicContact SD-CG1 4.47Å; M34-L83 HydrophobicContact CB-CB 4.25Å; M34-L83 HydrophobicContact CG-CB 3.98Å; M34-T85 HydrophobicContact CE-CG2 3.24Å; M34-T85 HydrophobicContact CG-CG2 4.31Å; M34-R95 HydrophobicContact CE-CG 3.67Å; M34-Y99 HydrophobicContact CE-CD1 3.6Å; M34-Y99 HydrophobicContact CE-CE1 3.53Å; M34-Y99 HydrophobicContact SD-CD1 3.5Å; M34-Y99 WeakPolarHBondContact SD-CD1 3.48Å; M34-Y99 HydrophobicContact SD-CE1 3.79Å; M34-A102 HydrophobicContact CB-CB 3.87Å; M34-A102 HydrophobicContact SD-CB 4.19Å; M34-V104 PolarHBondContact N-O 3.44Å; M34-F105 HydrophobicContact CB-CD1 4.01Å; M34-F105 HydrophobicContact CB-CE1 4.19Å; M34-F105 HydrophobicContact CG-CD1 4.42Å; M34-F105 HydrophobicContact CG-CE1 4.4Å; M34-F105 CarbonylContact O-C 3.55Å; M34-F105 WeakPolarHBondContact O-CA 3.3Å; M34-F105 HydrophobicContact SD-CD1 4.41Å; M34-F105 HydrophobicContact SD-CE1 3.83Å; M34-L106 PolarHBondContact O-N 3.46Å
35	L	96.6	Very high	86.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.4	174.9	-73.1	76.2	0	0	0	109.7	K43 M46 I47 L83 T85 L106 F196	L35-K43 HydrophobicContact CB-CB 4.15Å; L35-K43 HydrophobicContact CB-CD 4.27Å; L35-K43 HydrophobicContact CB-CG 4.41Å; L35-K43 HydrophobicContact CD2-CB 4.11Å; L35-K43 WeakPolarHBondContact CD2-O 3.33Å; L35-M46 HydrophobicContact CD2-CB 4.31Å; L35-I47 HydrophobicContact CB-CD1 4.44Å; L35-I47 HydrophobicContact CD1-CD1 3.75Å; L35-I47 HydrophobicContact CD1-CG1 3.84Å; L35-I47 HydrophobicContact CD2-CD1 3.77Å; L35-I47 HydrophobicContact CD2-CG1 3.54Å; L35-I47 HydrophobicContact CG-CD1 4.16Å; L35-I47 HydrophobicContact CG-CG1 4.26Å; L35-L83 PolarHBondContact N-O 3.18Å; L35-T85 PolarHBondContact O-OG1 3.06Å; L35-L106 WeakPolarHBondContact CA-O 3.32Å; L35-L106 HydrophobicContact CD1-CB 4.47Å; L35-L106 HydrophobicContact CD1-CD1 3.75Å; L35-L106 HydrophobicContact CG-CB 3.92Å; L35-L106 HydrophobicContact CG-CD1 3.98Å; L35-F196 HydrophobicContact CD1-CE1 4.23Å; L35-F196 HydrophobicContact CD2-CZ 4.46Å
36	V	96.5	Very high	88.7	Confident	0 Å²	0	28 Å²	28	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.8	-177.1	-67.3	0	0	0	0	110.3	M34 Y99 F105 L106 L107 C108 W124 I128	M34-V36 HydrophobicContact CE-CG1 4.39Å; M34-V36 HydrophobicContact CG-CG1 4.1Å; M34-V36 HydrophobicContact SD-CG1 4.47Å; V36-Y99 HydrophobicContact CG1-CE1 3.72Å; V36-F105 HydrophobicContact CG1-CD1 4.3Å; V36-F105 HydrophobicContact CG2-CB 4.44Å; V36-F105 HydrophobicContact CG2-CD1 4.2Å; V36-L106 PolarHBondContact N-O 2.81Å; V36-L107 HydrophobicContact CG2-CB 4.36Å; V36-L107 HydrophobicContact CG2-CD1 3.97Å; V36-C108 PolarHBondContact O-N 3.22Å; V36-W124 HydrophobicContact CB-CE3 4.16Å; V36-W124 HydrophobicContact CB-CZ3 4.26Å; V36-I128 HydrophobicContact CG2-CD1 3.71Å; V36-I128 HydrophobicContact CG2-CG1 4.37Å
37	G	96.8	Very high	90.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.153	C	C	.	.			trans	141.3	171.4	-172.8	0	0	0	0	0	111.5	K43 G87 C108 W124	G37-K43 PolarHBondContact O-NZ 3.35Å; G37-G87 WeakPolarHBondContact O-CA 3.43Å; G37-C108 WeakPolarHBondContact CA-O 3.38Å; G37-W124 VanDerWaalsContact C-CE2 3.41Å; G37-W124 VanDerWaalsContact CA-CE2 3.47Å; G37-W124 WeakPolarHBondContact O-CH2 3.24Å; G37-W124 WeakPolarHBondContact O-CZ2 3.44Å
38	D	95.7	Very high	91.5	Very high	22 Å²	22	23 Å²	23	12%	0.118	15%	0.15	C	C	.	.	S	Bend	trans	-57.6	163.7	-174.7	-77.1	10.4	0	0	0	113.4	V41 K43 S116 N119 W124	D38-V41 HydrophobicContact CB-CG1 3.76Å; D38-V41 VanDerWaalsContact O-CG2 3.29Å; D38-V41 WeakPolarHBondContact O-CG2 3.37Å; D38-K43 PolarHBondContact O-NZ 3.39Å; D38-S116 VanDerWaalsContact OD2-CA 3.28Å; D38-S116 WeakPolarHBondContact OD2-CA 3.39Å; D38-N119 PolarHBondContact OD2-ND2 3.35Å; D38-W124 PolarHBondContact OD1-NE1 2.96Å
39	G	91.4	Very high	92.8	Very high	33 Å²	33	18.5 Å²	18.5	34%	0.34	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	148.1	169.2	0	0	0	0	0	111.5	V41	G39-V41 PolarHBondContact O-N 3.33Å
40	A	91.7	Very high	93.2	Very high	67 Å²	67	13.5 Å²	13.5	55%	0.554	9%	0.093	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	7.6	174.7	0	0	0	0	0	117.5	G42 Q143	A40-G42 PolarHBondContact O-N 3.47Å; A40-Q143 PolarHBondContact O-NE2 3.43Å
41	V	95.7	Very high	93	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.094	C	C	.	.	S	Bend	trans	-72	-8.4	173.6	-54.6	0	0	0	0	113.2	D38 G39 K43 C108 T142	D38-V41 HydrophobicContact CB-CG1 3.76Å; D38-V41 VanDerWaalsContact O-CG2 3.29Å; D38-V41 WeakPolarHBondContact O-CG2 3.37Å; G39-V41 PolarHBondContact O-N 3.33Å; V41-K43 HydrophobicContact CG2-CD 4.4Å; V41-K43 HydrophobicContact CG2-CG 3.8Å; V41-C108 HydrophobicContact CG2-CB 3.93Å; V41-T142 VanDerWaalsContact O-CB 3.27Å; V41-T142 WeakPolarHBondContact O-CB 3.37Å; V41-T142 PolarHBondContact O-OG1 3.08Å
42	G	93.8	Very high	92.3	Very high	9 Å²	9	17 Å²	17	9%	0.093	12%	0.115	C	C	.	.	S	Bend	trans	96.7	24.1	173.5	0	0	0	0	0	116.3	A40 S45 M46	A40-G42 PolarHBondContact O-N 3.47Å; G42-S45 PolarHBondContact O-N 3.07Å; G42-M46 WeakPolarHBondContact O-CG 3.47Å; G42-M46 PolarHBondContact O-N 3.26Å
43	K	94.8	Very high	91	Very high	9 Å²	9	22.4 Å²	22.4	4%	0.039	14%	0.144	C	C	.	.	H	α-helix	trans	-56.4	-54.9	175.4	-58.5	-174	-60.4	-76.5	0	112.2	L35 G37 D38 V41 S45 M46 I47 T85 C108	L35-K43 HydrophobicContact CB-CB 4.15Å; L35-K43 HydrophobicContact CB-CD 4.27Å; L35-K43 HydrophobicContact CB-CG 4.41Å; L35-K43 HydrophobicContact CD2-CB 4.11Å; L35-K43 WeakPolarHBondContact CD2-O 3.33Å; G37-K43 PolarHBondContact O-NZ 3.35Å; D38-K43 PolarHBondContact O-NZ 3.39Å; V41-K43 HydrophobicContact CG2-CD 4.4Å; V41-K43 HydrophobicContact CG2-CG 3.8Å; K43-S45 VanDerWaalsContact C-N 3.33Å; K43-S45 PolarHBondContact O-N 3.06Å; K43-M46 WeakPolarHBondContact O-CB 3.49Å; K43-M46 PolarHBondContact O-N 3.15Å; K43-M46 VanDerWaalsContact O-N 3.08Å; K43-I47 PolarHBondContact O-N 3.1Å; K43-I47 VanDerWaalsContact O-N 3.08Å; K43-T85 WeakPolarHBondContact CE-O 3.01Å; K43-C108 HydrophobicContact CG-CB 4.01Å
44	T	92.1	Very high	89.4	Confident	21 Å²	21	23.7 Å²	23.7	13%	0.129	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-45.4	176	-43.2	0	0	0	0	111.7	M46 I47 I48 T62 D84	T44-M46 VanDerWaalsContact C-N 3.31Å; T44-M46 PolarHBondContact O-N 3.35Å; T44-I47 PolarHBondContact O-N 2.95Å; T44-I48 HydrophobicContact CG2-CD1 3.76Å; T44-I48 HydrophobicContact CG2-CG1 4.37Å; T44-I48 WeakPolarHBondContact O-CG1 3.32Å; T44-I48 PolarHBondContact O-N 2.93Å; T44-T62 WeakPolarHBondContact CG2-OG1 3.34Å; T44-T62 PolarHBondContact OG1-OG1 3.1Å; T44-D84 WeakPolarHBondContact CA-OD2 3.5Å; T44-D84 WeakPolarHBondContact CB-OD2 3.26Å; T44-D84 VanDerWaalsContact CG2-OD2 3.26Å; T44-D84 WeakPolarHBondContact CG2-OD2 3.35Å; T44-D84 PolarHBondContact OG1-OD1 3.47Å; T44-D84 PolarHBondContact OG1-OD2 3.16Å
45	S	92.6	Very high	87.3	Confident	12 Å²	12	28.9 Å²	28.9	8%	0.084	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-36.7	176.9	-50.8	0	0	0	0	112.4	G42 K43 S49 S186	G42-S45 PolarHBondContact O-N 3.07Å; K43-S45 VanDerWaalsContact C-N 3.33Å; K43-S45 PolarHBondContact O-N 3.06Å; S45-S49 WeakPolarHBondContact O-CB 3.37Å; S45-S49 PolarHBondContact O-N 3.45Å; S45-S186 WeakPolarHBondContact O-CB 3.42Å
46	M	93.8	Very high	85.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-47.9	172.9	-72	173.2	65.1	0	0	111.8	L35 G42 K43 T44 S49 Y50 V140 T142 S186 L192 A195 F196	L35-M46 HydrophobicContact CD2-CB 4.31Å; G42-M46 WeakPolarHBondContact O-CG 3.47Å; G42-M46 PolarHBondContact O-N 3.26Å; K43-M46 WeakPolarHBondContact O-CB 3.49Å; K43-M46 PolarHBondContact O-N 3.15Å; K43-M46 VanDerWaalsContact O-N 3.08Å; T44-M46 VanDerWaalsContact C-N 3.31Å; T44-M46 PolarHBondContact O-N 3.35Å; M46-S49 PolarHBondContact O-N 3.1Å; M46-Y50 WeakPolarHBondContact O-CB 3.42Å; M46-Y50 PolarHBondContact O-N 3.5Å; M46-V140 HydrophobicContact CE-CG1 3.8Å; M46-V140 HydrophobicContact SD-CG1 4.22Å; M46-T142 HydrophobicContact CG-CG2 4.44Å; M46-T142 HydrophobicContact SD-CG2 3.43Å; M46-T142 WeakPolarHBondContact SD-CG2 3.5Å; M46-S186 VanDerWaalsContact CA-OG 3.22Å; M46-S186 WeakPolarHBondContact CA-OG 3.4Å; M46-S186 WeakPolarHBondContact CG-OG 3.41Å; M46-S186 PolarHBondContact N-OG 3.16Å; M46-L192 HydrophobicContact CB-CD1 3.93Å; M46-L192 HydrophobicContact CE-CD1 4.32Å; M46-L192 HydrophobicContact CG-CD1 3.99Å; M46-A195 HydrophobicContact CE-CB 4.48Å; M46-F196 HydrophobicContact CB-CE2 4.36Å; M46-F196 HydrophobicContact CB-CZ 4.34Å; M46-F196 HydrophobicContact CE-CE2 4.4Å
47	I	91.8	Very high	83.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-52.3	-178.5	-65.6	167.1	0	0	0	110.4	L35 K43 T44 S49 Y50 I51 F67 L82 D84 F196	L35-I47 HydrophobicContact CB-CD1 4.44Å; L35-I47 HydrophobicContact CD1-CD1 3.75Å; L35-I47 HydrophobicContact CD1-CG1 3.84Å; L35-I47 HydrophobicContact CD2-CD1 3.77Å; L35-I47 HydrophobicContact CD2-CG1 3.54Å; L35-I47 HydrophobicContact CG-CD1 4.16Å; L35-I47 HydrophobicContact CG-CG1 4.26Å; K43-I47 PolarHBondContact O-N 3.1Å; K43-I47 VanDerWaalsContact O-N 3.08Å; T44-I47 PolarHBondContact O-N 2.95Å; I47-S49 VanDerWaalsContact C-N 3.28Å; I47-S49 PolarHBondContact O-N 3.34Å; I47-Y50 PolarHBondContact O-N 3.23Å; I47-I51 HydrophobicContact CG2-CD1 3.54Å; I47-I51 HydrophobicContact CG2-CG1 4.4Å; I47-I51 WeakPolarHBondContact O-CG1 3.5Å; I47-I51 PolarHBondContact O-N 3Å; I47-F67 HydrophobicContact CG2-CB 4.42Å; I47-F67 HydrophobicContact CG2-CD1 4.49Å; I47-F67 HydrophobicContact CG2-CD2 3.5Å; I47-F67 VanDerWaalsContact CG2-CD2 3.5Å; I47-F67 HydrophobicContact CG2-CE2 3.78Å; I47-F67 HydrophobicContact CG2-CG 3.88Å; I47-F67 HydrophobicContact CG2-CZ 4.4Å; I47-L82 HydrophobicContact CG2-CB 4.34Å; I47-L82 HydrophobicContact CG2-CD1 4.06Å; I47-D84 HydrophobicContact CD1-CB 3.41Å; I47-D84 VanDerWaalsContact CD1-CB 3.41Å; I47-F196 HydrophobicContact CG1-CZ 4.29Å
48	I	88.9	Confident	81.7	Confident	52 Å²	52	42.8 Å²	42.8	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-44.7	179.9	-65.8	173.3	0	0	0	109.6	T44 Y50 I51 S52 P56	T44-I48 HydrophobicContact CG2-CD1 3.76Å; T44-I48 HydrophobicContact CG2-CG1 4.37Å; T44-I48 WeakPolarHBondContact O-CG1 3.32Å; T44-I48 PolarHBondContact O-N 2.93Å; I48-Y50 VanDerWaalsContact C-N 3.32Å; I48-Y50 PolarHBondContact O-N 2.97Å; I48-I51 PolarHBondContact O-N 3.44Å; I48-S52 VanDerWaalsContact O-CB 3.26Å; I48-S52 WeakPolarHBondContact O-CB 3.36Å; I48-S52 PolarHBondContact O-N 3.4Å; I48-S52 PolarHBondContact O-OG 3.01Å; I48-P56 HydrophobicContact CB-CG 4.35Å; I48-P56 HydrophobicContact CD1-CB 4.23Å; I48-P56 HydrophobicContact CD1-CG 4.23Å; I48-P56 HydrophobicContact CG2-CB 4.16Å; I48-P56 HydrophobicContact CG2-CG 4.15Å
49	S	90.3	Very high	79.8	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.007	28%	0.283	C	S	.	.	H	α-helix	trans	-65.8	-37.8	-178.6	-175.9	0	0	0	0	112.8	S45 M46 I47 N53 G54 S186 L192	S45-S49 WeakPolarHBondContact O-CB 3.37Å; S45-S49 PolarHBondContact O-N 3.45Å; M46-S49 PolarHBondContact O-N 3.1Å; I47-S49 VanDerWaalsContact C-N 3.28Å; I47-S49 PolarHBondContact O-N 3.34Å; S49-N53 PolarHBondContact O-N 3.41Å; S49-G54 WeakPolarHBondContact CA-O 3.3Å; S49-G54 WeakPolarHBondContact CB-O 3.43Å; S49-G54 PolarHBondContact OG-O 3.14Å; S49-S186 PolarHBondContact OG-O 3.43Å; S49-L192 WeakPolarHBondContact OG-CD2 3.46Å
50	Y	88.2	Confident	78.4	Confident	17 Å²	17	54 Å²	54	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-66.3	-42.9	177.2	177.6	-106.8	0	0	0	112.2	Y7 M46 I47 I48 I80 L82 K193 F196	Y7-Y50 PolarHBondContact OH-O 3.49Å; M46-Y50 WeakPolarHBondContact O-CB 3.42Å; M46-Y50 PolarHBondContact O-N 3.5Å; I47-Y50 PolarHBondContact O-N 3.23Å; I48-Y50 VanDerWaalsContact C-N 3.32Å; I48-Y50 PolarHBondContact O-N 2.97Å; Y50-I80 HydrophobicContact CE1-CD1 4.35Å; Y50-L82 HydrophobicContact CD1-CD1 3.89Å; Y50-L82 HydrophobicContact CE1-CD1 4.22Å; Y50-K193 HydrophobicContact CE2-CG 4.43Å; Y50-F196 VanDerWaalsContact CB-CE2 3.45Å; Y50-F196 HydrophobicContact CD1-CD1 4.23Å; Y50-F196 AromaticContact CD1-CD2 3.94Å; Y50-F196 HydrophobicContact CD1-CD2 3.94Å; Y50-F196 HydrophobicContact CD1-CE1 4.38Å; Y50-F196 HydrophobicContact CD1-CE2 4.12Å; Y50-F196 HydrophobicContact CD1-CG 4.01Å; Y50-F196 HydrophobicContact CD1-CZ 4.33Å; Y50-F196 HydrophobicContact CD2-CB 4.14Å; Y50-F196 AromaticContact CD2-CD2 3.37Å; Y50-F196 HydrophobicContact CD2-CD2 3.37Å; Y50-F196 AromaticContact CD2-CE2 3.98Å; Y50-F196 HydrophobicContact CD2-CE2 3.98Å; Y50-F196 AromaticContact CD2-CG 3.9Å; Y50-F196 HydrophobicContact CD2-CG 3.9Å; Y50-F196 HydrophobicContact CE1-CB 4.2Å; Y50-F196 HydrophobicContact CE1-CD1 4.28Å; Y50-F196 HydrophobicContact CE1-CD2 4.36Å; Y50-F196 HydrophobicContact CE1-CG 4.03Å; Y50-F196 HydrophobicContact CE2-CB 3.66Å; Y50-F196 AromaticContact CE2-CD2 3.84Å; Y50-F196 HydrophobicContact CE2-CD2 3.84Å; Y50-F196 AromaticContact CE2-CG 3.91Å; Y50-F196 HydrophobicContact CE2-CG 3.91Å; Y50-F196 AromaticContact CG-CD2 3.41Å; Y50-F196 HydrophobicContact CG-CD2 3.41Å; Y50-F196 VanDerWaalsContact CG-CD2 3.41Å; Y50-F196 AromaticContact CG-CE2 3.59Å; Y50-F196 HydrophobicContact CG-CE2 3.59Å; Y50-F196 AromaticContact CG-CG 3.94Å; Y50-F196 HydrophobicContact CG-CG 3.94Å; Y50-F196 HydrophobicContact CG-CZ 4.22Å; Y50-F196 AromaticContact CZ-CG 3.98Å
51	I	83.8	Confident	76.8	Confident	40 Å²	40	58 Å²	58	21%	0.205	31%	0.308	C	S	.	.	H	α-helix	trans	-75.7	-43.7	-178.7	-62.4	167.4	0	0	0	111.6	Y7 I47 I48 F67 L82	Y7-I51 HydrophobicContact CD1-CG2 4.33Å; Y7-I51 HydrophobicContact CE1-CG2 4.42Å; Y7-I51 WeakPolarHBondContact CE2-O 3.47Å; I47-I51 HydrophobicContact CG2-CD1 3.54Å; I47-I51 HydrophobicContact CG2-CG1 4.4Å; I47-I51 WeakPolarHBondContact O-CG1 3.5Å; I47-I51 PolarHBondContact O-N 3Å; I48-I51 PolarHBondContact O-N 3.44Å; I51-F67 HydrophobicContact CD1-CB 3.51Å; I51-F67 HydrophobicContact CD1-CD1 3.67Å; I51-F67 HydrophobicContact CD1-CG 3.65Å; I51-L82 HydrophobicContact CD1-CD1 4.23Å; I51-L82 HydrophobicContact CG1-CD1 4.26Å
52	S	77.9	Confident	75.3	Confident	68 Å²	68	58.9 Å²	58.9	48%	0.476	31%	0.314	S	S	.	.	H	α-helix	trans	-85.7	-8.9	-170.9	64.1	0	0	0	0	114.3	I48 G54	I48-S52 VanDerWaalsContact O-CB 3.26Å; I48-S52 WeakPolarHBondContact O-CB 3.36Å; I48-S52 PolarHBondContact O-N 3.4Å; I48-S52 PolarHBondContact O-OG 3.01Å; S52-G54 PolarHBondContact O-N 2.91Å; S52-G54 PolarHBondContact OG-N 3Å; S52-G54 VanDerWaalsContact OG-N 3.12Å
53	N	67.9	Low	73.8	Confident	120 Å²	120	60 Å²	60	64%	0.642	33%	0.325	S	S	*	.	S	Bend	trans	49	24.8	-162.3	-94.1	-6.9	0	0	0	112.6	S49 Q189	S49-N53 PolarHBondContact O-N 3.41Å; N53-Q189 PolarHBondContact O-NE2 2.84Å
54	G	60.3	Low	72.6	Confident	26 Å²	26	64.1 Å²	64.1	27%	0.268	34%	0.343	S	S	.	.	S	Bend	trans	-129.5	-164.5	-178	0	0	0	0	0	111.2	S49 S52	S49-G54 WeakPolarHBondContact CA-O 3.3Å; S49-G54 WeakPolarHBondContact CB-O 3.43Å; S49-G54 PolarHBondContact OG-O 3.14Å; S52-G54 PolarHBondContact O-N 2.91Å; S52-G54 PolarHBondContact OG-N 3Å; S52-G54 VanDerWaalsContact OG-N 3.12Å
55	Y	53.3	Low	72.1	Confident	109 Å²	109	66.6 Å²	66.6	43%	0.427	36%	0.356	S	S	.	.			trans	-138.8	136.7	170.6	-176.1	-95.4	0	0	0	108.1	A57 S186 L187	Y55-A57 PolarHBondContact O-N 3.45Å; Y55-S186 VanDerWaalsContact CD2-C 3.46Å; Y55-S186 WeakPolarHBondContact CD2-O 3.43Å; Y55-L187 HydrophobicContact CD1-CD1 3.83Å; Y55-L187 HydrophobicContact CD2-CB 4.3Å; Y55-L187 HydrophobicContact CD2-CD1 4.43Å; Y55-L187 HydrophobicContact CE1-CD1 4.05Å; Y55-L187 HydrophobicContact CE2-CB 4.15Å; Y55-L187 HydrophobicContact CG-CD1 4.03Å
56	P	62	Low	71.7	Confident	28 Å²	28	68.6 Å²	68.6	18%	0.182	37%	0.367	C	S	.	.			trans	-64.2	125.6	-178.9	24.5	-31.8	0	0	0	110.5	I48 E58	I48-P56 HydrophobicContact CB-CG 4.35Å; I48-P56 HydrophobicContact CD1-CB 4.23Å; I48-P56 HydrophobicContact CD1-CG 4.23Å; I48-P56 HydrophobicContact CG2-CB 4.16Å; I48-P56 HydrophobicContact CG2-CG 4.15Å; P56-E58 VanDerWaalsContact C-N 3.27Å
57	A	51.1	Low	71.3	Confident	109 Å²	109	70.6 Å²	70.6	90%	0.901	38%	0.376	S	S	*	.	S	Bend	trans	-71.7	-23.9	176.5	0	0	0	0	0	112.5	Y55	Y55-A57 PolarHBondContact O-N 3.45Å
58	E	58.6	Low	71	Confident	155 Å²	155	74.5 Å²	74.5	72%	0.724	40%	0.403	S	S	*	.	S	Bend	trans	-128.2	136	-179.5	-65	-176.6	178.6	0	0	110.6	P56	P56-E58 VanDerWaalsContact C-N 3.27Å
59	Y	55.3	Low	70.7	Confident	137 Å²	137	73.1 Å²	73.1	54%	0.537	40%	0.402	S	S	.	.			trans	-84.8	117.6	175.5	179.2	-96.4	0	0	0	110	Q61	Y59-Q61 HydrophobicContact CE1-CG 3.98Å
60	Q	61.8	Low	70.4	Confident	154 Å²	154	78.3 Å²	78.3	72%	0.72	43%	0.426	S	S	*	.			trans	-104.8	140.9	167.9	-66.3	-173.8	-10.7	0	0	109.5	T62	Q60-T62 PolarHBondContact O-N 2.92Å
61	Q	59.1	Low	70.2	Confident	152 Å²	152	77.9 Å²	77.9	71%	0.71	43%	0.425	S	S	*	.			trans	-74.2	119.4	179.3	-71.3	-176.9	-7	0	0	110.5	Y59	Y59-Q61 HydrophobicContact CE1-CG 3.98Å
62	T	64.1	Low	70.1	Confident	18 Å²	18	81.5 Å²	81.5	11%	0.11	44%	0.441	C	S	.	.			trans	-73.8	132.5	174	-57.5	0	0	0	0	111.2	T44 Q60 D84 A86	T44-T62 WeakPolarHBondContact CG2-OG1 3.34Å; T44-T62 PolarHBondContact OG1-OG1 3.1Å; Q60-T62 PolarHBondContact O-N 2.92Å; T62-D84 HydrophobicContact CG2-CB 3.98Å; T62-D84 WeakPolarHBondContact CG2-OD2 3.47Å; T62-D84 PolarHBondContact OG1-OD2 3.37Å; T62-A86 WeakPolarHBondContact O-CB 3Å
63	G	62.4	Low	70.2	Confident	33 Å²	33	79 Å²	79	34%	0.34	42%	0.423	S	S	.	.	S	Bend	trans	-89.1	-73.8	159.7	0	0	0	0	0	110.4	A86	G63-A86 WeakPolarHBondContact O-CB 3.43Å; G63-A86 PolarHBondContact O-N 2.92Å; G63-A86 VanDerWaalsContact O-N 3.11Å
64	F	69.1	Low	70.7	Confident	95 Å²	95	82.1 Å²	82.1	42%	0.417	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	119	172	179.1	-95.9	0	0	0	108.6	V66 L83 D84 T85 S98	F64-V66 HydrophobicContact CD1-CG2 4.09Å; F64-V66 HydrophobicContact CE1-CG2 3.33Å; F64-V66 HydrophobicContact CZ-CG2 3.82Å; F64-L83 HydrophobicContact CE2-CD2 4.25Å; F64-L83 HydrophobicContact CZ-CD2 3.93Å; F64-L83 HydrophobicContact CZ-CG 4.39Å; F64-D84 WeakPolarHBondContact CA-O 3.47Å; F64-T85 HydrophobicContact CD2-CG2 3.77Å; F64-T85 HydrophobicContact CE2-CG2 3.87Å; F64-S98 WeakPolarHBondContact CE2-OG 3.36Å
65	D	81.5	Confident	71.5	Confident	72 Å²	72	84.1 Å²	84.1	39%	0.385	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140.8	-178.2	-67	-53.4	0	0	0	110.6	F67 D84	D65-F67 HydrophobicContact CB-CD2 4.38Å; D65-F67 HydrophobicContact CB-CE2 3.54Å; D65-F67 HydrophobicContact CB-CZ 3.88Å; D65-D84 HydrophobicContact CB-CB 4.18Å; D65-D84 PolarHBondContact N-O 3.07Å; D65-D84 PolarHBondContact O-N 2.95Å
66	V	85.1	Confident	72.8	Confident	54 Å²	54	82.3 Å²	82.3	33%	0.327	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.2	-178.9	-177.6	0	0	0	0	109.1	F64 Q81	F64-V66 HydrophobicContact CD1-CG2 4.09Å; F64-V66 HydrophobicContact CE1-CG2 3.33Å; F64-V66 HydrophobicContact CZ-CG2 3.82Å; V66-Q81 HydrophobicContact CG1-CG 3.32Å
67	F	85.8	Confident	73.9	Confident	43 Å²	43	84.8 Å²	84.8	19%	0.189	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.5	177.9	-56	-93	0	0	0	109.5	I47 I51 D65 Q81 L82 D84	I47-F67 HydrophobicContact CG2-CB 4.42Å; I47-F67 HydrophobicContact CG2-CD1 4.49Å; I47-F67 HydrophobicContact CG2-CD2 3.5Å; I47-F67 VanDerWaalsContact CG2-CD2 3.5Å; I47-F67 HydrophobicContact CG2-CE2 3.78Å; I47-F67 HydrophobicContact CG2-CG 3.88Å; I47-F67 HydrophobicContact CG2-CZ 4.4Å; I51-F67 HydrophobicContact CD1-CB 3.51Å; I51-F67 HydrophobicContact CD1-CD1 3.67Å; I51-F67 HydrophobicContact CD1-CG 3.65Å; D65-F67 HydrophobicContact CB-CD2 4.38Å; D65-F67 HydrophobicContact CB-CE2 3.54Å; D65-F67 HydrophobicContact CB-CZ 3.88Å; F67-Q81 CarbonylContact O-C 3.21Å; F67-Q81 VanDerWaalsContact O-CA 3.31Å; F67-Q81 WeakPolarHBondContact O-CA 2.86Å; F67-L82 HydrophobicContact CB-CB 4.27Å; F67-L82 PolarHBondContact N-O 3.25Å; F67-L82 PolarHBondContact O-N 3.45Å; F67-D84 HydrophobicContact CE2-CB 4.1Å
68	S	84.3	Confident	75.6	Confident	81 Å²	81	80.9 Å²	80.9	57%	0.566	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	144.2	178.8	-58.1	0	0	0	0	110.7	I80	S68-I80 WeakPolarHBondContact CA-O 3.32Å
69	G	82.8	Confident	77.1	Confident	23 Å²	23	77.9 Å²	77.9	24%	0.237	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	175.7	179.4	0	0	0	0	0	112.5	I80	G69-I80 PolarHBondContact N-O 3.06Å; G69-I80 PolarHBondContact O-N 3.4Å
70	Q	84.1	Confident	78.8	Confident	111 Å²	111	71.7 Å²	71.7	52%	0.519	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.1	173.3	-70	-174.9	24.1	0	0	110	M5 V78 K79	M5-Q70 VanDerWaalsContact CE-O 3.3Å; M5-Q70 WeakPolarHBondContact CE-O 3.48Å; Q70-V78 WeakPolarHBondContact CA-O 3.35Å; Q70-K79 HydrophobicContact CG-CG 4.03Å
71	V	84	Confident	80.3	Confident	7 Å²	7	67 Å²	67	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	150	177.5	-60.8	0	0	0	0	109.7	M5 V73 P77 V78 I80 I200	M5-V71 HydrophobicContact CE-CB 3.78Å; M5-V71 HydrophobicContact CE-CG1 3.12Å; V71-V73 HydrophobicContact CG2-CG2 3.87Å; V71-P77 CarbonylContact O-C 3.6Å; V71-P77 WeakPolarHBondContact O-CA 3.49Å; V71-V78 HydrophobicContact CG2-CB 3.96Å; V71-V78 HydrophobicContact CG2-CG1 4.49Å; V71-V78 WeakPolarHBondContact CG2-O 3.46Å; V71-V78 PolarHBondContact N-O 3.41Å; V71-V78 PolarHBondContact O-N 2.94Å; V71-I80 HydrophobicContact CG1-CD1 3.61Å; V71-I80 HydrophobicContact CG1-CG1 3.93Å; V71-I80 HydrophobicContact CG1-CG2 4.37Å; V71-I80 HydrophobicContact CG2-CG2 3.75Å; V71-I200 HydrophobicContact CG1-CD1 4.2Å; V71-I200 HydrophobicContact CG2-CD1 4.21Å
72	Q	81	Confident	81.9	Confident	116 Å²	116	59.9 Å²	59.9	54%	0.542	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	115.9	172.1	-72.5	-70.5	-18.9	0	0	109.6	G75 S76	Q72-G75 PolarHBondContact OE1-O 3.16Å; Q72-S76 VanDerWaalsContact OE1-C 3.3Å
73	V	80.8	Confident	83.2	Confident	17 Å²	17	59.5 Å²	59.5	10%	0.103	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	118.4	175.9	-175.3	0	0	0	0	108.3	V71 G75 S76 V78 I200 F201 I204	V71-V73 HydrophobicContact CG2-CG2 3.87Å; V73-G75 PolarHBondContact O-N 3.2Å; V73-G75 VanDerWaalsContact O-N 3.1Å; V73-S76 PolarHBondContact N-O 3.45Å; V73-S76 PolarHBondContact O-N 2.99Å; V73-V78 HydrophobicContact CB-CG2 3.94Å; V73-V78 HydrophobicContact CG2-CB 4.26Å; V73-V78 HydrophobicContact CG2-CG2 3.93Å; V73-I200 HydrophobicContact CG2-CG2 3.96Å; V73-F201 HydrophobicContact CG1-CD1 4.11Å; V73-F201 HydrophobicContact CG1-CE1 3.45Å; V73-F201 VanDerWaalsContact CG1-CE1 3.45Å; V73-F201 HydrophobicContact CG1-CZ 4.13Å; V73-I204 HydrophobicContact CB-CD1 4.4Å; V73-I204 HydrophobicContact CG1-CD1 3.89Å; V73-I204 HydrophobicContact CG2-CD1 4.33Å
74	E	79.3	Confident	84.5	Confident	185 Å²	185	58 Å²	58	86%	0.864	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	32.9	-177.6	-58.7	-174.2	158.6	0	0	113.6	S76	E74-S76 VanDerWaalsContact C-N 3.29Å; E74-S76 PolarHBondContact O-N 3.24Å
75	G	77.2	Confident	85.3	Confident	67 Å²	67	53.6 Å²	53.6	69%	0.691	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	5.5	-178.9	0	0	0	0	0	115.1	Q72 V73	Q72-G75 PolarHBondContact OE1-O 3.16Å; V73-G75 PolarHBondContact O-N 3.2Å; V73-G75 VanDerWaalsContact O-N 3.1Å
76	S	80.5	Confident	85.4	Confident	71 Å²	71	50.4 Å²	50.4	50%	0.497	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.4	172.3	-60.5	0	0	0	0	110.9	Q72 V73 E74 V78	Q72-S76 VanDerWaalsContact OE1-C 3.3Å; V73-S76 PolarHBondContact N-O 3.45Å; V73-S76 PolarHBondContact O-N 2.99Å; E74-S76 VanDerWaalsContact C-N 3.29Å; E74-S76 PolarHBondContact O-N 3.24Å; S76-V78 PolarHBondContact O-N 3.04Å
77	P	84.6	Confident	85	Confident	81 Å²	81	48.3 Å²	48.3	53%	0.526	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	129.7	173.2	28.3	-32.6	0	0	0	110	V71	V71-P77 CarbonylContact O-C 3.6Å; V71-P77 WeakPolarHBondContact O-CA 3.49Å
78	V	86.3	Confident	84.7	Confident	26 Å²	26	50 Å²	50	16%	0.158	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.3	176.6	177.7	0	0	0	0	108.1	I31 Q70 V71 V73 S76 I80	I31-V78 HydrophobicContact CD1-CG1 3.57Å; I31-V78 HydrophobicContact CG1-CG1 4.05Å; Q70-V78 WeakPolarHBondContact CA-O 3.35Å; V71-V78 HydrophobicContact CG2-CB 3.96Å; V71-V78 HydrophobicContact CG2-CG1 4.49Å; V71-V78 WeakPolarHBondContact CG2-O 3.46Å; V71-V78 PolarHBondContact N-O 3.41Å; V71-V78 PolarHBondContact O-N 2.94Å; V73-V78 HydrophobicContact CB-CG2 3.94Å; V73-V78 HydrophobicContact CG2-CB 4.26Å; V73-V78 HydrophobicContact CG2-CG2 3.93Å; S76-V78 PolarHBondContact O-N 3.04Å; V78-I80 HydrophobicContact CG1-CG2 4.39Å
79	K	90.3	Very high	84.5	Confident	93 Å²	93	52.8 Å²	52.8	40%	0.404	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132	173	-64.3	177.9	-170.5	170.2	0	109.1	D27 V30 I31 Q70	D27-K79 IonicContact OD2-NZ 2.76Å; D27-K79 PolarHBondContact OD2-NZ 3.37Å; V30-K79 HydrophobicContact CB-CB 4.43Å; V30-K79 HydrophobicContact CG1-CB 4.48Å; V30-K79 HydrophobicContact CG2-CB 3.87Å; V30-K79 HydrophobicContact CG2-CD 3.88Å; I31-K79 PolarHBondContact N-O 3.13Å; Q70-K79 HydrophobicContact CG-CG 4.03Å
80	I	91.1	Very high	84.5	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	150.9	175.7	60.2	154.6	0	0	0	110.2	I31 Y50 S68 G69 V71 V78 L82 I200	I31-I80 HydrophobicContact CB-CG2 4.3Å; I31-I80 CarbonylContact O-C 3.4Å; I31-I80 WeakPolarHBondContact O-CA 3.26Å; Y50-I80 HydrophobicContact CE1-CD1 4.35Å; S68-I80 WeakPolarHBondContact CA-O 3.32Å; G69-I80 PolarHBondContact N-O 3.06Å; G69-I80 PolarHBondContact O-N 3.4Å; V71-I80 HydrophobicContact CG1-CD1 3.61Å; V71-I80 HydrophobicContact CG1-CG1 3.93Å; V71-I80 HydrophobicContact CG1-CG2 4.37Å; V71-I80 HydrophobicContact CG2-CG2 3.75Å; V78-I80 HydrophobicContact CG1-CG2 4.39Å; I80-L82 HydrophobicContact CD1-CD2 4.05Å; I80-L82 HydrophobicContact CD1-CG 4.29Å; I80-I200 HydrophobicContact CD1-CD1 4.43Å; I80-I200 HydrophobicContact CG2-CD1 4.17Å; I80-I200 HydrophobicContact CG2-CG1 4.11Å
81	Q	92.7	Very high	84.4	Confident	55 Å²	55	56.5 Å²	56.5	26%	0.257	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.5	172	-166.8	178.9	56.1	0	0	108.1	V30 I31 S32 C33 V66 F67 L83	V30-Q81 HydrophobicContact CG1-CB 3.94Å; I31-Q81 PolarHBondContact O-N 3.05Å; S32-Q81 CarbonylContact C-O 3.47Å; S32-Q81 WeakPolarHBondContact CA-O 3.35Å; S32-Q81 PolarHBondContact OG-OE1 3.16Å; C33-Q81 PolarHBondContact N-O 3.41Å; V66-Q81 HydrophobicContact CG1-CG 3.32Å; F67-Q81 CarbonylContact O-C 3.21Å; F67-Q81 VanDerWaalsContact O-CA 3.31Å; F67-Q81 WeakPolarHBondContact O-CA 2.86Å; Q81-L83 HydrophobicContact CB-CD1 4.35Å; Q81-L83 HydrophobicContact CG-CD1 4Å
82	L	92.4	Very high	84.4	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	118	176.1	-52.1	-179.2	0	0	0	108.1	C33 I47 Y50 I51 F67 I80 F196	C33-L82 HydrophobicContact CB-CD2 3.73Å; C33-L82 WeakPolarHBondContact O-CA 3.45Å; I47-L82 HydrophobicContact CG2-CB 4.34Å; I47-L82 HydrophobicContact CG2-CD1 4.06Å; Y50-L82 HydrophobicContact CD1-CD1 3.89Å; Y50-L82 HydrophobicContact CE1-CD1 4.22Å; I51-L82 HydrophobicContact CD1-CD1 4.23Å; I51-L82 HydrophobicContact CG1-CD1 4.26Å; F67-L82 HydrophobicContact CB-CB 4.27Å; F67-L82 PolarHBondContact N-O 3.25Å; F67-L82 PolarHBondContact O-N 3.45Å; I80-L82 HydrophobicContact CD1-CD2 4.05Å; I80-L82 HydrophobicContact CD1-CG 4.29Å; L82-F196 HydrophobicContact CD1-CD1 4.37Å; L82-F196 HydrophobicContact CD1-CE1 3.87Å; L82-F196 HydrophobicContact CD1-CZ 4.47Å; L82-F196 HydrophobicContact CD2-CD1 3.94Å; L82-F196 HydrophobicContact CD2-CE1 3.85Å; L82-F196 HydrophobicContact CG-CE1 4.46Å
83	L	92.3	Very high	84.6	Confident	10 Å²	10	60.7 Å²	60.7	5%	0.052	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	110.6	177.9	-70.4	76.6	0	0	0	108.2	C33 M34 L35 F64 Q81	C33-L83 PolarHBondContact O-N 3.29Å; M34-L83 HydrophobicContact CB-CB 4.25Å; M34-L83 HydrophobicContact CG-CB 3.98Å; L35-L83 PolarHBondContact N-O 3.18Å; F64-L83 HydrophobicContact CE2-CD2 4.25Å; F64-L83 HydrophobicContact CZ-CD2 3.93Å; F64-L83 HydrophobicContact CZ-CG 4.39Å; Q81-L83 HydrophobicContact CB-CD1 4.35Å; Q81-L83 HydrophobicContact CG-CD1 4Å
84	D	90	Very high	84.6	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.8	169.5	-162.1	16.7	0	0	0	109.7	T44 I47 T62 F64 D65 F67	T44-D84 WeakPolarHBondContact CA-OD2 3.5Å; T44-D84 WeakPolarHBondContact CB-OD2 3.26Å; T44-D84 VanDerWaalsContact CG2-OD2 3.26Å; T44-D84 WeakPolarHBondContact CG2-OD2 3.35Å; T44-D84 PolarHBondContact OG1-OD1 3.47Å; T44-D84 PolarHBondContact OG1-OD2 3.16Å; I47-D84 HydrophobicContact CD1-CB 3.41Å; I47-D84 VanDerWaalsContact CD1-CB 3.41Å; T62-D84 HydrophobicContact CG2-CB 3.98Å; T62-D84 WeakPolarHBondContact CG2-OD2 3.47Å; T62-D84 PolarHBondContact OG1-OD2 3.37Å; F64-D84 WeakPolarHBondContact CA-O 3.47Å; D65-D84 HydrophobicContact CB-CB 4.18Å; D65-D84 PolarHBondContact N-O 3.07Å; D65-D84 PolarHBondContact O-N 2.95Å; F67-D84 HydrophobicContact CE2-CB 4.1Å
85	T	85.4	Confident	85	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.1	-178.8	66.3	0	0	0	0	111.6	M34 L35 K43 F64 G87 R95	M34-T85 HydrophobicContact CE-CG2 3.24Å; M34-T85 HydrophobicContact CG-CG2 4.31Å; L35-T85 PolarHBondContact O-OG1 3.06Å; K43-T85 WeakPolarHBondContact CE-O 3.01Å; F64-T85 HydrophobicContact CD2-CG2 3.77Å; F64-T85 HydrophobicContact CE2-CG2 3.87Å; T85-G87 PolarHBondContact O-N 2.94Å; T85-R95 HydrophobicContact CG2-CG 4.09Å; T85-R95 WeakPolarHBondContact OG1-CD 3.37Å
86	A	83.6	Confident	85.4	Confident	6 Å²	6	55.7 Å²	55.7	5%	0.05	28%	0.281	C	S	.	.			trans	-56.3	134.3	169.7	0	0	0	0	0	110.4	T62 G63 Q88 F91 R95	T62-A86 WeakPolarHBondContact O-CB 3Å; G63-A86 WeakPolarHBondContact O-CB 3.43Å; G63-A86 PolarHBondContact O-N 2.92Å; G63-A86 VanDerWaalsContact O-N 3.11Å; A86-Q88 VanDerWaalsContact C-N 3.32Å; A86-F91 HydrophobicContact CB-CB 3.89Å; A86-F91 HydrophobicContact CB-CD1 4.37Å; A86-F91 HydrophobicContact CB-CD2 3.29Å; A86-F91 HydrophobicContact CB-CE2 3.84Å; A86-F91 HydrophobicContact CB-CG 3.59Å; A86-R95 PolarHBondContact O-NH1 3.32Å
87	G	75.7	Confident	85.7	Confident	9 Å²	9	58.3 Å²	58.3	9%	0.093	29%	0.288	C	S	.	.			trans	-87.4	-0.6	176	0	0	0	0	0	114.2	G37 T85	G37-G87 WeakPolarHBondContact O-CA 3.43Å; T85-G87 PolarHBondContact O-N 2.94Å
88	Q	80.6	Confident	85.8	Confident	78 Å²	78	55.4 Å²	55.4	36%	0.364	27%	0.27	S	S	.	.	S	Bend	trans	-83.7	154.7	-177.6	-47.6	172.1	-18.4	0	0	110.2	A86 E90 F91 R95	A86-Q88 VanDerWaalsContact C-N 3.32Å; Q88-E90 VanDerWaalsContact C-N 3.3Å; Q88-E90 WeakPolarHBondContact CB-OE2 3.07Å; Q88-E90 PolarHBondContact O-N 2.9Å; Q88-F91 HydrophobicContact CB-CD2 4.13Å; Q88-F91 HydrophobicContact CB-CE2 4.47Å; Q88-F91 PolarHBondContact O-N 2.79Å; Q88-R95 PolarHBondContact O-NH1 3.22Å
89	E	80.4	Confident	86.1	Confident	141 Å²	141	54.2 Å²	54.2	66%	0.659	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-69.1	-28.7	-173.5	-80.8	178.8	-178.4	0	0	113	F91 D92	E89-F91 PolarHBondContact O-N 2.8Å; E89-D92 WeakPolarHBondContact CA-OD1 3.38Å; E89-D92 WeakPolarHBondContact O-CB 3.36Å; E89-D92 PolarHBondContact O-N 3.05Å
90	E	82	Confident	86	Confident	143 Å²	143	53 Å²	53	67%	0.668	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-63	-14.6	-179.6	-58	82.6	175.8	0	0	112.8	Q88	Q88-E90 VanDerWaalsContact C-N 3.3Å; Q88-E90 WeakPolarHBondContact CB-OE2 3.07Å; Q88-E90 PolarHBondContact O-N 2.9Å
91	F	82.4	Confident	85.8	Confident	68 Å²	68	57.6 Å²	57.6	30%	0.298	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-109	6.8	179.3	-59.5	-80.1	0	0	0	113.7	A86 Q88 E89 E93 F94 R95	A86-F91 HydrophobicContact CB-CB 3.89Å; A86-F91 HydrophobicContact CB-CD1 4.37Å; A86-F91 HydrophobicContact CB-CD2 3.29Å; A86-F91 HydrophobicContact CB-CE2 3.84Å; A86-F91 HydrophobicContact CB-CG 3.59Å; Q88-F91 HydrophobicContact CB-CD2 4.13Å; Q88-F91 HydrophobicContact CB-CE2 4.47Å; Q88-F91 PolarHBondContact O-N 2.79Å; E89-F91 PolarHBondContact O-N 2.8Å; F91-E93 PolarHBondContact O-N 2.79Å; F91-F94 PolarHBondContact O-N 2.93Å; F91-R95 VanDerWaalsContact O-CB 3.26Å; F91-R95 WeakPolarHBondContact O-CB 3.49Å; F91-R95 PolarHBondContact O-N 3.01Å
92	D	84.5	Confident	85.9	Confident	44 Å²	44	55.1 Å²	55.1	24%	0.235	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-44.6	-175.1	-75.3	5.9	0	0	0	111.9	E89 R95 A96 K123	E89-D92 WeakPolarHBondContact CA-OD1 3.38Å; E89-D92 WeakPolarHBondContact O-CB 3.36Å; E89-D92 PolarHBondContact O-N 3.05Å; D92-R95 VanDerWaalsContact CG-NH2 3.29Å; D92-R95 PolarHBondContact O-N 2.97Å; D92-R95 IonicContact OD1-CZ 2.73Å; D92-R95 VanDerWaalsContact OD1-CZ 3.27Å; D92-R95 IonicContact OD1-NH1 3.68Å; D92-R95 PolarHBondContact OD1-NH1 3.21Å; D92-R95 VanDerWaalsContact OD1-NH1 3.16Å; D92-R95 IonicContact OD1-NH2 3.98Å; D92-R95 PolarHBondContact OD1-NH2 3.06Å; D92-R95 IonicContact OD2-NH2 2.8Å; D92-A96 WeakPolarHBondContact O-CB 3.47Å; D92-A96 PolarHBondContact O-N 3.24Å; D92-K123 IonicContact OD1-NZ 3.05Å; D92-K123 PolarHBondContact OD1-NZ 2.87Å; D92-K123 VanDerWaalsContact OD1-NZ 3.08Å; D92-K123 VanDerWaalsContact OD2-CE 3.29Å; D92-K123 WeakPolarHBondContact OD2-CE 3.26Å; D92-K123 IonicContact OD2-NZ 2.84Å; D92-K123 PolarHBondContact OD2-NZ 2.95Å
93	E	83.6	Confident	86.1	Confident	168 Å²	168	56.2 Å²	56.2	79%	0.785	29%	0.286	S	S	*	.	H	α-helix	trans	-64	-45.5	179	-66.6	-174.5	175	0	0	112.6	F91 R95 A96	F91-E93 PolarHBondContact O-N 2.79Å; E93-R95 VanDerWaalsContact C-N 3.32Å; E93-R95 PolarHBondContact O-N 2.83Å; E93-A96 PolarHBondContact O-N 2.92Å
94	F	81.1	Confident	86.3	Confident	143 Å²	143	55.7 Å²	55.7	63%	0.627	28%	0.283	S	S	*	.	H	α-helix	trans	-64.3	-39.7	178	-70.8	-75.6	0	0	0	111.6	F91 L97	F91-F94 PolarHBondContact O-N 2.93Å; F94-L97 WeakPolarHBondContact O-CB 3.27Å; F94-L97 PolarHBondContact O-N 3.02Å
95	R	88	Confident	86.7	Confident	5 Å²	5	55.7 Å²	55.7	2%	0.019	28%	0.283	C	S	.	.	H	α-helix	trans	-67.7	-37.3	179.9	-170.6	172.5	64	-123.5	-5.2	112.1	M34 T85 A86 Q88 F91 D92 E93 L97 S98 Y99 W124 D127	M34-R95 HydrophobicContact CE-CG 3.67Å; T85-R95 HydrophobicContact CG2-CG 4.09Å; T85-R95 WeakPolarHBondContact OG1-CD 3.37Å; A86-R95 PolarHBondContact O-NH1 3.32Å; Q88-R95 PolarHBondContact O-NH1 3.22Å; F91-R95 VanDerWaalsContact O-CB 3.26Å; F91-R95 WeakPolarHBondContact O-CB 3.49Å; F91-R95 PolarHBondContact O-N 3.01Å; D92-R95 VanDerWaalsContact CG-NH2 3.29Å; D92-R95 PolarHBondContact O-N 2.97Å; D92-R95 IonicContact OD1-CZ 2.73Å; D92-R95 VanDerWaalsContact OD1-CZ 3.27Å; D92-R95 IonicContact OD1-NH1 3.68Å; D92-R95 PolarHBondContact OD1-NH1 3.21Å; D92-R95 VanDerWaalsContact OD1-NH1 3.16Å; D92-R95 IonicContact OD1-NH2 3.98Å; D92-R95 PolarHBondContact OD1-NH2 3.06Å; D92-R95 IonicContact OD2-NH2 2.8Å; E93-R95 VanDerWaalsContact C-N 3.32Å; E93-R95 PolarHBondContact O-N 2.83Å; R95-L97 PolarHBondContact O-N 2.99Å; R95-S98 PolarHBondContact O-N 3.22Å; R95-S98 VanDerWaalsContact O-N 3.1Å; R95-Y99 WeakPolarHBondContact CD-OH 3.37Å; R95-Y99 HydrophobicContact CG-CD1 4.45Å; R95-Y99 HydrophobicContact CG-CE1 3.59Å; R95-Y99 PolarHBondContact NE-OH 2.75Å; R95-Y99 WeakPolarHBondContact O-CD1 3.36Å; R95-Y99 PolarHBondContact O-N 3.19Å; R95-W124 VanDerWaalsContact CZ-CH2 3.45Å; R95-W124 VanDerWaalsContact NH2-CZ3 3.29Å; R95-D127 IonicContact NH2-OD2 3.2Å
96	A	86.3	Confident	87.3	Confident	16 Å²	16	55.6 Å²	55.6	13%	0.132	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-32.1	177.6	0	0	0	0	0	112.8	D92 E93 S98 Y99	D92-A96 WeakPolarHBondContact O-CB 3.47Å; D92-A96 PolarHBondContact O-N 3.24Å; E93-A96 PolarHBondContact O-N 2.92Å; A96-S98 PolarHBondContact O-N 3.48Å; A96-Y99 PolarHBondContact O-N 2.94Å
97	L	85.4	Confident	88	Confident	126 Å²	126	55.3 Å²	55.3	66%	0.66	28%	0.28	S	S	*	.	H	α-helix	trans	-61.2	-32.7	175.7	-62.4	173.9	0	0	0	112.3	F94 R95	F94-L97 WeakPolarHBondContact O-CB 3.27Å; F94-L97 PolarHBondContact O-N 3.02Å; R95-L97 PolarHBondContact O-N 2.99Å
98	S	88.3	Confident	89.1	Confident	20 Å²	20	54.9 Å²	54.9	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-84.2	-16.6	-179.4	-51.1	0	0	0	0	113.7	F64 R95 A96 A100 H101 A102	F64-S98 WeakPolarHBondContact CE2-OG 3.36Å; R95-S98 PolarHBondContact O-N 3.22Å; R95-S98 VanDerWaalsContact O-N 3.1Å; A96-S98 PolarHBondContact O-N 3.48Å; S98-A100 VanDerWaalsContact C-N 3.32Å; S98-A100 PolarHBondContact O-N 3.07Å; S98-H101 PolarHBondContact O-N 2.87Å; S98-A102 PolarHBondContact O-N 3.31Å
99	Y	91.9	Very high	90	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-35.9	-176.1	-73.9	-5.8	0	0	0	113.4	M34 V36 R95 A96 H101 A102 F105 D127 I128 H131 N132	M34-Y99 HydrophobicContact CE-CD1 3.6Å; M34-Y99 HydrophobicContact CE-CE1 3.53Å; M34-Y99 HydrophobicContact SD-CD1 3.5Å; M34-Y99 WeakPolarHBondContact SD-CD1 3.48Å; M34-Y99 HydrophobicContact SD-CE1 3.79Å; V36-Y99 HydrophobicContact CG1-CE1 3.72Å; R95-Y99 WeakPolarHBondContact CD-OH 3.37Å; R95-Y99 HydrophobicContact CG-CD1 4.45Å; R95-Y99 HydrophobicContact CG-CE1 3.59Å; R95-Y99 PolarHBondContact NE-OH 2.75Å; R95-Y99 WeakPolarHBondContact O-CD1 3.36Å; R95-Y99 PolarHBondContact O-N 3.19Å; A96-Y99 PolarHBondContact O-N 2.94Å; Y99-H101 PolarHBondContact O-N 2.83Å; Y99-A102 PolarHBondContact O-N 3.22Å; Y99-F105 AromaticContact CD1-CE1 3.66Å; Y99-F105 HydrophobicContact CD1-CE1 3.66Å; Y99-F105 HydrophobicContact CD1-CZ 4.2Å; Y99-F105 HydrophobicContact CE1-CE1 4.04Å; Y99-F105 HydrophobicContact CG-CE1 4.21Å; Y99-F105 HydrophobicContact CG-CZ 4.32Å; Y99-D127 HydrophobicContact CE2-CB 4.44Å; Y99-D127 WeakPolarHBondContact CE2-OD2 3.31Å; Y99-D127 PolarHBondContact OH-OD2 3.43Å; Y99-I128 HydrophobicContact CE2-CG1 4.38Å; Y99-H131 HydrophobicContact CD2-CB 3.86Å; Y99-H131 AromaticContact CD2-ND1 3.89Å; Y99-H131 HydrophobicContact CG-CB 4.27Å; Y99-N132 WeakPolarHBondContact O-CB 3.43Å; Y99-N132 PolarHBondContact O-ND2 2.94Å
100	A	88.4	Confident	90.8	Very high	69 Å²	69	44.5 Å²	44.5	57%	0.57	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.9	179.9	0	0	0	0	0	112.9	S98	S98-A100 VanDerWaalsContact C-N 3.32Å; S98-A100 PolarHBondContact O-N 3.07Å
101	H	87	Confident	91.6	Very high	103 Å²	103	37.7 Å²	37.7	48%	0.477	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-8.9	-175.6	-55.8	-69.4	0	0	0	113.2	L26 S98 Y99	L26-H101 HydrophobicContact CD1-CB 4.33Å; S98-H101 PolarHBondContact O-N 2.87Å; Y99-H101 PolarHBondContact O-N 2.83Å
102	A	94.3	Very high	92.3	Very high	2 Å²	2	35 Å²	35	2%	0.017	19%	0.185	C	C	.	.			trans	-75.2	126.5	179.6	0	0	0	0	0	112.3	M34 S98 Y99 F105 N132 S135	M34-A102 HydrophobicContact CB-CB 3.87Å; M34-A102 HydrophobicContact SD-CB 4.19Å; S98-A102 PolarHBondContact O-N 3.31Å; Y99-A102 PolarHBondContact O-N 3.22Å; A102-F105 HydrophobicContact CB-CD1 4.36Å; A102-F105 HydrophobicContact CB-CE1 3.71Å; A102-F105 HydrophobicContact CB-CE2 4.02Å; A102-F105 HydrophobicContact CB-CZ 3.52Å; A102-N132 PolarHBondContact O-ND2 2.84Å; A102-N132 VanDerWaalsContact O-ND2 3.11Å; A102-S135 PolarHBondContact O-OG 3.44Å
103	D	95.9	Very high	92.9	Very high	26 Å²	26	35.4 Å²	35.4	14%	0.139	19%	0.187	C	C	.	.	S	Bend	trans	-80.7	-28.9	175.1	-73	-50.8	0	0	0	112.4	I31 S32 P136 A203 K207	I31-D103 WeakPolarHBondContact CA-OD2 3.41Å; I31-D103 HydrophobicContact CG2-CB 4.24Å; S32-D103 PolarHBondContact N-OD2 3.38Å; S32-D103 PolarHBondContact O-N 3.19Å; D103-P136 VanDerWaalsContact O-CD 3.32Å; D103-P136 WeakPolarHBondContact O-CD 3.36Å; D103-A203 HydrophobicContact CB-CB 4.01Å; D103-K207 WeakPolarHBondContact OD1-CE 3.33Å; D103-K207 IonicContact OD1-NZ 3.16Å; D103-K207 WeakPolarHBondContact OD2-CE 3.41Å; D103-K207 IonicContact OD2-NZ 3.57Å; D103-K207 PolarHBondContact OD2-NZ 3.45Å
104	V	97.7	Very high	93.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	148.1	177.1	60.4	0	0	0	0	110.4	S32 C33 M34 P136 I138 A199 A202 A203	S32-V104 PolarHBondContact O-N 2.94Å; C33-V104 HydrophobicContact CB-CG1 3.97Å; C33-V104 WeakPolarHBondContact SG-CG1 3.19Å; M34-V104 PolarHBondContact N-O 3.44Å; V104-P136 HydrophobicContact CB-CG 4.05Å; V104-P136 HydrophobicContact CG2-CB 4.34Å; V104-P136 HydrophobicContact CG2-CG 3.93Å; V104-I138 HydrophobicContact CG2-CG1 4.25Å; V104-A199 HydrophobicContact CG1-CB 3.99Å; V104-A199 HydrophobicContact CG2-CB 3.92Å; V104-A202 HydrophobicContact CG2-CB 4.46Å; V104-A203 HydrophobicContact CB-CB 4.04Å; V104-A203 HydrophobicContact CG1-CB 3.94Å
105	F	98.3	Very high	94.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.3	174.5	-63.7	-87.1	0	0	0	111	M34 V36 Y99 A102 I128 N132 P136 I137 I138	M34-F105 HydrophobicContact CB-CD1 4.01Å; M34-F105 HydrophobicContact CB-CE1 4.19Å; M34-F105 HydrophobicContact CG-CD1 4.42Å; M34-F105 HydrophobicContact CG-CE1 4.4Å; M34-F105 CarbonylContact O-C 3.55Å; M34-F105 WeakPolarHBondContact O-CA 3.3Å; M34-F105 HydrophobicContact SD-CD1 4.41Å; M34-F105 HydrophobicContact SD-CE1 3.83Å; V36-F105 HydrophobicContact CG1-CD1 4.3Å; V36-F105 HydrophobicContact CG2-CB 4.44Å; V36-F105 HydrophobicContact CG2-CD1 4.2Å; Y99-F105 AromaticContact CD1-CE1 3.66Å; Y99-F105 HydrophobicContact CD1-CE1 3.66Å; Y99-F105 HydrophobicContact CD1-CZ 4.2Å; Y99-F105 HydrophobicContact CE1-CE1 4.04Å; Y99-F105 HydrophobicContact CG-CE1 4.21Å; Y99-F105 HydrophobicContact CG-CZ 4.32Å; A102-F105 HydrophobicContact CB-CD1 4.36Å; A102-F105 HydrophobicContact CB-CE1 3.71Å; A102-F105 HydrophobicContact CB-CE2 4.02Å; A102-F105 HydrophobicContact CB-CZ 3.52Å; F105-I128 HydrophobicContact CD1-CD1 4.46Å; F105-I128 HydrophobicContact CD1-CG1 4.33Å; F105-I128 HydrophobicContact CD1-CG2 4.35Å; F105-I128 HydrophobicContact CD2-CG2 3.72Å; F105-I128 HydrophobicContact CE1-CG1 4.44Å; F105-I128 HydrophobicContact CE1-CG2 4.25Å; F105-I128 HydrophobicContact CE2-CG2 3.6Å; F105-I128 HydrophobicContact CG-CD1 4.47Å; F105-I128 HydrophobicContact CG-CG2 4.1Å; F105-I128 HydrophobicContact CZ-CG2 3.87Å; F105-N132 HydrophobicContact CE2-CB 3.92Å; F105-N132 HydrophobicContact CZ-CB 3.98Å; F105-P136 PolarHBondContact N-O 2.89Å; F105-I137 HydrophobicContact CB-CG1 4.12Å; F105-I137 HydrophobicContact CD2-CG1 4.47Å; F105-I137 CarbonylContact O-C 3.56Å; F105-I137 WeakPolarHBondContact O-CA 3.17Å; F105-I138 PolarHBondContact O-N 3Å
106	L	98.4	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	99.8	162.9	-76.6	152.8	0	0	0	106.7	M34 L35 V36 C108 I138 V140 F196 A199	M34-L106 PolarHBondContact O-N 3.46Å; L35-L106 WeakPolarHBondContact CA-O 3.32Å; L35-L106 HydrophobicContact CD1-CB 4.47Å; L35-L106 HydrophobicContact CD1-CD1 3.75Å; L35-L106 HydrophobicContact CG-CB 3.92Å; L35-L106 HydrophobicContact CG-CD1 3.98Å; V36-L106 PolarHBondContact N-O 2.81Å; L106-C108 PolarHBondContact O-N 3.02Å; L106-I138 HydrophobicContact CD2-CB 4.17Å; L106-I138 HydrophobicContact CD2-CG2 4.34Å; L106-V140 HydrophobicContact CD2-CG2 3.6Å; L106-F196 HydrophobicContact CD1-CD1 3.85Å; L106-F196 HydrophobicContact CD1-CE1 3.74Å; L106-A199 HydrophobicContact CD1-CB 4.21Å; L106-A199 HydrophobicContact CD2-CB 4.03Å; L106-A199 HydrophobicContact CG-CB 3.99Å
107	L	98.5	Very high	95.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	104.5	179.7	177	54.3	0	0	0	109.3	V36 I120 W124 V125 I128 I137 I138 L139 V140 I176	V36-L107 HydrophobicContact CG2-CB 4.36Å; V36-L107 HydrophobicContact CG2-CD1 3.97Å; L107-I120 HydrophobicContact CD2-CG2 3.9Å; L107-W124 HydrophobicContact CD1-CB 3.5Å; L107-W124 VanDerWaalsContact CD1-CB 3.5Å; L107-W124 HydrophobicContact CD1-CD2 4.48Å; L107-W124 HydrophobicContact CD1-CG 3.82Å; L107-W124 HydrophobicContact CD2-CB 4.29Å; L107-V125 HydrophobicContact CD2-CG2 3.66Å; L107-I128 HydrophobicContact CD1-CD1 4.49Å; L107-I128 HydrophobicContact CD2-CD1 4.45Å; L107-I137 HydrophobicContact CB-CG2 3.73Å; L107-I137 HydrophobicContact CD2-CG2 4.21Å; L107-I138 PolarHBondContact N-O 3.02Å; L107-L139 HydrophobicContact CD2-CD1 4.47Å; L107-L139 HydrophobicContact CG-CD1 4.24Å; L107-V140 PolarHBondContact O-N 3.49Å; L107-I176 HydrophobicContact CD2-CD1 4.2Å
108	C	98.5	Very high	95.8	Very high	1 Å²	1	25 Å²	25	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.5	-171.9	-58.6	0	0	0	0	112.1	V36 G37 V41 K43 L106 V140 T142	V36-C108 PolarHBondContact O-N 3.22Å; G37-C108 WeakPolarHBondContact CA-O 3.38Å; V41-C108 HydrophobicContact CG2-CB 3.93Å; K43-C108 HydrophobicContact CG-CB 4.01Å; L106-C108 PolarHBondContact O-N 3.02Å; C108-V140 WeakPolarHBondContact CA-O 3.41Å; C108-T142 HydrophobicContact CB-CG2 3.91Å
109	F	98.6	Very high	96.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	155.3	165.6	74.8	-83.9	0	0	0	108.6	M111 F117 I120 L139 V140 G141 T142 V164 A169 Y181	F109-M111 HydrophobicContact CE2-SD 3.76Å; F109-M111 HydrophobicContact CZ-SD 3.83Å; F109-F117 HydrophobicContact CD1-CD2 4.18Å; F109-F117 HydrophobicContact CD2-CB 3.83Å; F109-F117 AromaticContact CD2-CD2 3.66Å; F109-F117 HydrophobicContact CD2-CD2 3.66Å; F109-F117 HydrophobicContact CD2-CG 4.2Å; F109-F117 HydrophobicContact CE1-CD2 4.08Å; F109-F117 HydrophobicContact CE1-CE2 4.37Å; F109-F117 HydrophobicContact CE2-CB 4.36Å; F109-F117 AromaticContact CE2-CD2 3.59Å; F109-F117 HydrophobicContact CE2-CD2 3.59Å; F109-F117 HydrophobicContact CE2-CE2 4.31Å; F109-F117 HydrophobicContact CE2-CG 4.33Å; F109-F117 HydrophobicContact CG-CB 4.35Å; F109-F117 AromaticContact CG-CD2 3.96Å; F109-F117 HydrophobicContact CG-CD2 3.96Å; F109-F117 AromaticContact CZ-CD2 3.79Å; F109-F117 HydrophobicContact CZ-CD2 3.79Å; F109-F117 HydrophobicContact CZ-CE2 4.12Å; F109-I120 HydrophobicContact CB-CD1 4.06Å; F109-I120 HydrophobicContact CB-CG1 4.38Å; F109-I120 HydrophobicContact CD1-CD1 3.68Å; F109-I120 HydrophobicContact CE1-CD1 4.33Å; F109-I120 HydrophobicContact CG-CD1 3.92Å; F109-L139 HydrophobicContact CD1-CD1 3.87Å; F109-L139 HydrophobicContact CD1-CG 4.32Å; F109-L139 HydrophobicContact CE1-CD1 4.04Å; F109-L139 HydrophobicContact CE1-CD2 4.2Å; F109-L139 HydrophobicContact CE1-CG 3.99Å; F109-V140 VanDerWaalsContact CD1-O 3.25Å; F109-V140 WeakPolarHBondContact CD1-O 3.07Å; F109-V140 PolarHBondContact N-O 3.37Å; F109-G141 CarbonylContact O-C 3.47Å; F109-G141 WeakPolarHBondContact O-CA 3.25Å; F109-T142 PolarHBondContact O-N 3.21Å; F109-T142 PolarHBondContact O-OG1 2.89Å; F109-V164 HydrophobicContact CD2-CG2 4.35Å; F109-V164 HydrophobicContact CE2-CB 3.96Å; F109-V164 HydrophobicContact CE2-CG1 3.76Å; F109-V164 HydrophobicContact CE2-CG2 4.08Å; F109-V164 HydrophobicContact CZ-CG1 4.29Å; F109-A169 HydrophobicContact CE1-CB 4.38Å; F109-A169 HydrophobicContact CZ-CB 3.74Å; F109-Y181 AromaticContact CE1-CE2 3.89Å; F109-Y181 HydrophobicContact CE1-CE2 3.89Å; F109-Y181 HydrophobicContact CZ-CE2 4.05Å
110	S	98.4	Very high	96.6	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	136.3	176.9	165.7	0	0	0	0	112	V112 D113 S116 T142 Q143	S110-V112 PolarHBondContact O-N 3.02Å; S110-V112 VanDerWaalsContact O-N 3.16Å; S110-V112 VanDerWaalsContact OG-CG2 3.27Å; S110-V112 WeakPolarHBondContact OG-CG2 3.32Å; S110-V112 PolarHBondContact OG-N 2.59Å; S110-D113 PolarHBondContact O-N 2.84Å; S110-D113 VanDerWaalsContact O-N 3.09Å; S110-S116 PolarHBondContact N-OG 2.72Å; S110-T142 WeakPolarHBondContact CA-OG1 3.48Å; S110-Q143 PolarHBondContact OG-OE1 3.48Å
111	M	98	Very high	97.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22	177.3	-65.9	-64	-74.5	0	0	113	F109 T142 L144 L147 P163 V164 E183	F109-M111 HydrophobicContact CE2-SD 3.76Å; F109-M111 HydrophobicContact CZ-SD 3.83Å; M111-T142 VanDerWaalsContact CG-O 3.27Å; M111-T142 WeakPolarHBondContact CG-O 3.46Å; M111-T142 PolarHBondContact N-O 3.17Å; M111-L144 HydrophobicContact CE-CD1 4.48Å; M111-L147 HydrophobicContact CB-CD1 4.13Å; M111-L147 HydrophobicContact CB-CD2 4.14Å; M111-L147 HydrophobicContact CB-CG 4.11Å; M111-L147 HydrophobicContact CE-CD1 4.09Å; M111-P163 WeakPolarHBondContact O-CB 3.11Å; M111-V164 WeakPolarHBondContact CE-O 3.45Å; M111-V164 PolarHBondContact O-N 2.93Å; M111-E183 HydrophobicContact CE-CG 4.02Å; M111-E183 HydrophobicContact SD-CG 4.1Å
112	V	96.8	Very high	97.6	Very high	10 Å²	10	26.5 Å²	26.5	6%	0.061	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	7.5	178.6	-65.6	0	0	0	0	113.2	S110 R146 L147 V152 L156	S110-V112 PolarHBondContact O-N 3.02Å; S110-V112 VanDerWaalsContact O-N 3.16Å; S110-V112 VanDerWaalsContact OG-CG2 3.27Å; S110-V112 WeakPolarHBondContact OG-CG2 3.32Å; S110-V112 PolarHBondContact OG-N 2.59Å; V112-R146 HydrophobicContact CG1-CB 3.83Å; V112-R146 HydrophobicContact CG2-CB 3.91Å; V112-L147 HydrophobicContact CG1-CD2 3.67Å; V112-L147 HydrophobicContact CG1-CG 4.36Å; V112-V152 HydrophobicContact CB-CG1 3.87Å; V112-V152 HydrophobicContact CG1-CG1 3.8Å; V112-V152 HydrophobicContact CG2-CG1 4.26Å; V112-L156 HydrophobicContact CB-CD1 4.23Å; V112-L156 WeakPolarHBondContact O-CD2 2.93Å
113	D	96.7	Very high	97.6	Very high	54 Å²	54	28.1 Å²	28.1	29%	0.289	14%	0.142	S	C	.	.			trans	-125.5	92	176.2	-178.5	-4.8	0	0	0	110.6	S110 D115 S116 F117	S110-D113 PolarHBondContact O-N 2.84Å; S110-D113 VanDerWaalsContact O-N 3.09Å; D113-D115 VanDerWaalsContact C-N 3.26Å; D113-D115 PolarHBondContact O-N 2.79Å; D113-D115 PolarHBondContact OD1-N 3.44Å; D113-D115 VanDerWaalsContact OD1-N 3.14Å; D113-S116 PolarHBondContact O-N 3.45Å; D113-S116 PolarHBondContact O-OG 3.37Å; D113-S116 PolarHBondContact OD1-N 3.01Å; D113-F117 PolarHBondContact O-N 3.4Å
114	P	96.1	Very high	97.7	Very high	22 Å²	22	27 Å²	27	14%	0.143	14%	0.135	C	C	.	.	H	α-helix	trans	-67.9	-20.2	-178.1	-28.8	42.7	0	0	0	115.3	F117 H118 V161 K162 V164	P114-F117 WeakPolarHBondContact O-CB 3.01Å; P114-F117 PolarHBondContact O-N 2.88Å; P114-H118 PolarHBondContact O-N 3.34Å; P114-V161 HydrophobicContact CB-CG1 4.01Å; P114-V161 HydrophobicContact CG-CG1 3.39Å; P114-K162 WeakPolarHBondContact CG-O 3.38Å; P114-V164 HydrophobicContact CB-CG2 4.4Å; P114-V164 HydrophobicContact CG-CG2 4.29Å
115	D	96.8	Very high	97.7	Very high	116 Å²	116	28 Å²	28	62%	0.62	14%	0.142	S	C	*	.	H	α-helix	trans	-70.7	-42.5	175.1	-71.3	-34.3	0	0	0	109.8	D113 F117 H118 N119	D113-D115 VanDerWaalsContact C-N 3.26Å; D113-D115 PolarHBondContact O-N 2.79Å; D113-D115 PolarHBondContact OD1-N 3.44Å; D113-D115 VanDerWaalsContact OD1-N 3.14Å; D115-F117 PolarHBondContact O-N 3.4Å; D115-H118 WeakPolarHBondContact O-CB 3.22Å; D115-H118 PolarHBondContact O-N 2.84Å; D115-N119 PolarHBondContact O-N 2.98Å; D115-N119 PolarHBondContact O-ND2 3.37Å
116	S	97.9	Very high	97.6	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.014	16%	0.163	C	C	.	.	H	α-helix	trans	-56.8	-35.3	172.1	78.9	0	0	0	0	112.8	D38 S110 D113	D38-S116 VanDerWaalsContact OD2-CA 3.28Å; D38-S116 WeakPolarHBondContact OD2-CA 3.39Å; S110-S116 PolarHBondContact N-OG 2.72Å; D113-S116 PolarHBondContact O-N 3.45Å; D113-S116 PolarHBondContact O-OG 3.37Å; D113-S116 PolarHBondContact OD1-N 3.01Å
117	F	98.4	Very high	97.5	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-71.6	-37.2	175.1	-177.8	-104.9	0	0	0	113	F109 D113 P114 D115 N119 I120 V164 R168 A169 M172	F109-F117 HydrophobicContact CD1-CD2 4.18Å; F109-F117 HydrophobicContact CD2-CB 3.83Å; F109-F117 AromaticContact CD2-CD2 3.66Å; F109-F117 HydrophobicContact CD2-CD2 3.66Å; F109-F117 HydrophobicContact CD2-CG 4.2Å; F109-F117 HydrophobicContact CE1-CD2 4.08Å; F109-F117 HydrophobicContact CE1-CE2 4.37Å; F109-F117 HydrophobicContact CE2-CB 4.36Å; F109-F117 AromaticContact CE2-CD2 3.59Å; F109-F117 HydrophobicContact CE2-CD2 3.59Å; F109-F117 HydrophobicContact CE2-CE2 4.31Å; F109-F117 HydrophobicContact CE2-CG 4.33Å; F109-F117 HydrophobicContact CG-CB 4.35Å; F109-F117 AromaticContact CG-CD2 3.96Å; F109-F117 HydrophobicContact CG-CD2 3.96Å; F109-F117 AromaticContact CZ-CD2 3.79Å; F109-F117 HydrophobicContact CZ-CD2 3.79Å; F109-F117 HydrophobicContact CZ-CE2 4.12Å; D113-F117 PolarHBondContact O-N 3.4Å; P114-F117 WeakPolarHBondContact O-CB 3.01Å; P114-F117 PolarHBondContact O-N 2.88Å; D115-F117 PolarHBondContact O-N 3.4Å; F117-N119 VanDerWaalsContact C-N 3.32Å; F117-I120 HydrophobicContact CD2-CD1 3.46Å; F117-I120 VanDerWaalsContact CD2-CD1 3.46Å; F117-I120 HydrophobicContact CE2-CD1 3.9Å; F117-I120 HydrophobicContact CG-CD1 4.23Å; F117-I120 WeakPolarHBondContact O-CB 3.27Å; F117-I120 WeakPolarHBondContact O-CD1 3.31Å; F117-I120 WeakPolarHBondContact O-CG1 3.35Å; F117-I120 PolarHBondContact O-N 3.02Å; F117-V164 HydrophobicContact CB-CG1 4.45Å; F117-V164 HydrophobicContact CB-CG2 3.72Å; F117-V164 HydrophobicContact CD1-CG1 4.07Å; F117-V164 HydrophobicContact CD1-CG2 4.45Å; F117-V164 HydrophobicContact CD2-CG1 3.76Å; F117-V164 HydrophobicContact CE1-CG1 4.23Å; F117-V164 HydrophobicContact CE2-CG1 3.94Å; F117-V164 HydrophobicContact CG-CG1 3.82Å; F117-V164 HydrophobicContact CG-CG2 3.98Å; F117-V164 HydrophobicContact CZ-CG1 4.14Å; F117-R168 HydrophobicContact CE1-CG 3.79Å; F117-R168 HydrophobicContact CZ-CG 3.96Å; F117-A169 HydrophobicContact CE2-CB 3.89Å; F117-A169 HydrophobicContact CZ-CB 4.39Å; F117-M172 HydrophobicContact CD1-CE 4.24Å; F117-M172 HydrophobicContact CE1-CE 3.6Å; F117-M172 HydrophobicContact CE2-CB 3.79Å; F117-M172 HydrophobicContact CE2-CE 4.23Å; F117-M172 HydrophobicContact CE2-CG 3.98Å; F117-M172 HydrophobicContact CZ-CB 3.56Å; F117-M172 HydrophobicContact CZ-CE 3.62Å; F117-M172 HydrophobicContact CZ-CG 3.96Å
118	H	97.6	Very high	97.4	Very high	97 Å²	97	32.7 Å²	32.7	45%	0.449	17%	0.171	S	C	.	.	H	α-helix	trans	-65.5	-38.7	174.5	-176.9	69.3	0	0	0	111.7	P114 D115 I120 T121 K122	P114-H118 PolarHBondContact O-N 3.34Å; D115-H118 WeakPolarHBondContact O-CB 3.22Å; D115-H118 PolarHBondContact O-N 2.84Å; H118-I120 PolarHBondContact O-N 3.27Å; H118-T121 PolarHBondContact O-N 2.62Å; H118-K122 PolarHBondContact O-N 3.37Å
119	N	98.2	Very high	97.3	Very high	36 Å²	36	36 Å²	36	19%	0.193	18%	0.183	C	C	.	.	H	α-helix	trans	-66.1	-18.5	-178.3	-72.4	-21.7	0	0	0	113.8	D38 D115 F117 T121 K122 K123 W124	D38-N119 PolarHBondContact OD2-ND2 3.35Å; D115-N119 PolarHBondContact O-N 2.98Å; D115-N119 PolarHBondContact O-ND2 3.37Å; F117-N119 VanDerWaalsContact C-N 3.32Å; N119-T121 PolarHBondContact O-N 2.98Å; N119-K122 PolarHBondContact O-N 2.88Å; N119-K123 PolarHBondContact O-N 2.84Å; N119-W124 PolarHBondContact O-N 3.11Å; N119-W124 VanDerWaalsContact O-N 3.08Å
120	I	98.4	Very high	97.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-48.6	-56.2	171.5	-67.1	168.4	0	0	0	111	L107 F109 F117 H118 W124 V125 L139 M172 I176	L107-I120 HydrophobicContact CD2-CG2 3.9Å; F109-I120 HydrophobicContact CB-CD1 4.06Å; F109-I120 HydrophobicContact CB-CG1 4.38Å; F109-I120 HydrophobicContact CD1-CD1 3.68Å; F109-I120 HydrophobicContact CE1-CD1 4.33Å; F109-I120 HydrophobicContact CG-CD1 3.92Å; F117-I120 HydrophobicContact CD2-CD1 3.46Å; F117-I120 VanDerWaalsContact CD2-CD1 3.46Å; F117-I120 HydrophobicContact CE2-CD1 3.9Å; F117-I120 HydrophobicContact CG-CD1 4.23Å; F117-I120 WeakPolarHBondContact O-CB 3.27Å; F117-I120 WeakPolarHBondContact O-CD1 3.31Å; F117-I120 WeakPolarHBondContact O-CG1 3.35Å; F117-I120 PolarHBondContact O-N 3.02Å; H118-I120 PolarHBondContact O-N 3.27Å; I120-W124 PolarHBondContact O-N 3.33Å; I120-V125 HydrophobicContact CG2-CG2 4.02Å; I120-V125 WeakPolarHBondContact O-CB 3.31Å; I120-V125 WeakPolarHBondContact O-CG2 3.49Å; I120-V125 PolarHBondContact O-N 2.89Å; I120-L139 HydrophobicContact CD1-CD1 3.67Å; I120-L139 HydrophobicContact CG1-CD1 4.34Å; I120-L139 HydrophobicContact CG2-CD1 4.47Å; I120-M172 HydrophobicContact CD1-CG 4.32Å; I120-M172 HydrophobicContact CG2-CG 4.09Å; I120-M172 HydrophobicContact CG2-SD 4.45Å; I120-I176 HydrophobicContact CG2-CD1 3.97Å; I120-I176 HydrophobicContact CG2-CG2 4.2Å
121	T	97.9	Very high	96.9	Very high	42 Å²	42	44.3 Å²	44.3	26%	0.258	24%	0.235	S	C	.	.	I	π-helix	trans	-86.9	-24.6	-176.7	48.4	0	0	0	0	113.6	H118 N119 P126 M172 K175 I176	H118-T121 PolarHBondContact O-N 2.62Å; N119-T121 PolarHBondContact O-N 2.98Å; T121-P126 WeakPolarHBondContact O-CD 3.3Å; T121-P126 WeakPolarHBondContact O-CG 3.34Å; T121-M172 HydrophobicContact CG2-CE 4.23Å; T121-M172 HydrophobicContact CG2-SD 3.37Å; T121-M172 WeakPolarHBondContact CG2-SD 3.45Å; T121-K175 HydrophobicContact CG2-CD 4.47Å; T121-I176 HydrophobicContact CG2-CG2 3.73Å
122	K	97.6	Very high	96.8	Very high	146 Å²	146	45 Å²	45	64%	0.635	24%	0.238	S	C	*	.	I	π-helix	trans	-80.2	-37.9	-176.5	-174.6	-177.3	173.7	-170.4	0	112.2	H118 N119	H118-K122 PolarHBondContact O-N 3.37Å; N119-K122 PolarHBondContact O-N 2.88Å
123	K	95.8	Very high	96.6	Very high	35 Å²	35	48.5 Å²	48.5	15%	0.152	27%	0.269	C	S	.	.	I	π-helix	trans	-121.6	-63.8	-173.9	178.9	177.6	178.7	169.7	0	111.9	D92 N119 P126 D127	D92-K123 IonicContact OD1-NZ 3.05Å; D92-K123 PolarHBondContact OD1-NZ 2.87Å; D92-K123 VanDerWaalsContact OD1-NZ 3.08Å; D92-K123 VanDerWaalsContact OD2-CE 3.29Å; D92-K123 WeakPolarHBondContact OD2-CE 3.26Å; D92-K123 IonicContact OD2-NZ 2.84Å; D92-K123 PolarHBondContact OD2-NZ 2.95Å; N119-K123 PolarHBondContact O-N 2.84Å; K123-P126 VanDerWaalsContact O-CD 3.31Å; K123-P126 WeakPolarHBondContact O-CD 3.45Å; K123-D127 VanDerWaalsContact O-CB 3.29Å; K123-D127 WeakPolarHBondContact O-CB 3.14Å; K123-D127 PolarHBondContact O-N 2.88Å
124	W	97.1	Very high	96.4	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.008	28%	0.278	C	S	.	.	I	π-helix	trans	-68.4	-47.3	-161	-65.2	109.2	0	0	0	114.6	V36 G37 D38 R95 L107 N119 I120 D127 I128	V36-W124 HydrophobicContact CB-CE3 4.16Å; V36-W124 HydrophobicContact CB-CZ3 4.26Å; G37-W124 VanDerWaalsContact C-CE2 3.41Å; G37-W124 VanDerWaalsContact CA-CE2 3.47Å; G37-W124 WeakPolarHBondContact O-CH2 3.24Å; G37-W124 WeakPolarHBondContact O-CZ2 3.44Å; D38-W124 PolarHBondContact OD1-NE1 2.96Å; R95-W124 VanDerWaalsContact CZ-CH2 3.45Å; R95-W124 VanDerWaalsContact NH2-CZ3 3.29Å; L107-W124 HydrophobicContact CD1-CB 3.5Å; L107-W124 VanDerWaalsContact CD1-CB 3.5Å; L107-W124 HydrophobicContact CD1-CD2 4.48Å; L107-W124 HydrophobicContact CD1-CG 3.82Å; L107-W124 HydrophobicContact CD2-CB 4.29Å; N119-W124 PolarHBondContact O-N 3.11Å; N119-W124 VanDerWaalsContact O-N 3.08Å; I120-W124 PolarHBondContact O-N 3.33Å; W124-D127 PolarHBondContact O-N 2.78Å; W124-I128 WeakPolarHBondContact O-CB 3.5Å; W124-I128 WeakPolarHBondContact O-CD1 3.47Å; W124-I128 WeakPolarHBondContact O-CG1 3.45Å; W124-I128 PolarHBondContact O-N 2.99Å
125	V	97.9	Very high	96.4	Very high	22 Å²	22	48.4 Å²	48.4	13%	0.133	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-47.1	179.2	172	0	0	0	0	111.6	L107 I120 D127 R129 I176	L107-V125 HydrophobicContact CD2-CG2 3.66Å; I120-V125 HydrophobicContact CG2-CG2 4.02Å; I120-V125 WeakPolarHBondContact O-CB 3.31Å; I120-V125 WeakPolarHBondContact O-CG2 3.49Å; I120-V125 PolarHBondContact O-N 2.89Å; V125-D127 VanDerWaalsContact C-N 3.34Å; V125-D127 PolarHBondContact O-N 3.43Å; V125-R129 HydrophobicContact CG1-CG 4.23Å; V125-R129 VanDerWaalsContact O-CB 3.3Å; V125-R129 WeakPolarHBondContact O-CB 3.43Å; V125-R129 WeakPolarHBondContact O-CG 3.41Å; V125-R129 PolarHBondContact O-N 3.28Å; V125-I176 HydrophobicContact CG2-CB 4.04Å; V125-I176 HydrophobicContact CG2-CD1 3.98Å; V125-I176 HydrophobicContact CG2-CG2 3.95Å
126	P	96.9	Very high	96.5	Very high	69 Å²	69	43.5 Å²	43.5	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-54.1	-47	171.7	-28	34.3	0	0	0	113.5	T121 K123 R129 A130	T121-P126 WeakPolarHBondContact O-CD 3.3Å; T121-P126 WeakPolarHBondContact O-CG 3.34Å; K123-P126 VanDerWaalsContact O-CD 3.31Å; K123-P126 WeakPolarHBondContact O-CD 3.45Å; P126-R129 PolarHBondContact O-N 2.82Å; P126-A130 WeakPolarHBondContact O-CB 3.44Å; P126-A130 PolarHBondContact O-N 2.81Å
127	D	95.5	Very high	96.5	Very high	30 Å²	30	43.4 Å²	43.4	16%	0.16	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-48.1	-177.2	-172.4	27.4	0	0	0	112.3	R95 Y99 K123 W124 V125 R129 A130 H131	R95-D127 IonicContact NH2-OD2 3.2Å; Y99-D127 HydrophobicContact CE2-CB 4.44Å; Y99-D127 WeakPolarHBondContact CE2-OD2 3.31Å; Y99-D127 PolarHBondContact OH-OD2 3.43Å; K123-D127 VanDerWaalsContact O-CB 3.29Å; K123-D127 WeakPolarHBondContact O-CB 3.14Å; K123-D127 PolarHBondContact O-N 2.88Å; W124-D127 PolarHBondContact O-N 2.78Å; V125-D127 VanDerWaalsContact C-N 3.34Å; V125-D127 PolarHBondContact O-N 3.43Å; D127-R129 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 2.97Å; D127-A130 PolarHBondContact O-N 3.12Å; D127-H131 PolarHBondContact O-ND1 3.4Å; D127-H131 IonicContact OD1-CE1 2.83Å; D127-H131 IonicContact OD1-ND1 2.59Å
128	I	96.4	Very high	96.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.3	-46.1	173.7	-67.5	162	0	0	0	110.2	V36 Y99 F105 L107 W124 H131 N132 I137	V36-I128 HydrophobicContact CG2-CD1 3.71Å; V36-I128 HydrophobicContact CG2-CG1 4.37Å; Y99-I128 HydrophobicContact CE2-CG1 4.38Å; F105-I128 HydrophobicContact CD1-CD1 4.46Å; F105-I128 HydrophobicContact CD1-CG1 4.33Å; F105-I128 HydrophobicContact CD1-CG2 4.35Å; F105-I128 HydrophobicContact CD2-CG2 3.72Å; F105-I128 HydrophobicContact CE1-CG1 4.44Å; F105-I128 HydrophobicContact CE1-CG2 4.25Å; F105-I128 HydrophobicContact CE2-CG2 3.6Å; F105-I128 HydrophobicContact CG-CD1 4.47Å; F105-I128 HydrophobicContact CG-CG2 4.1Å; F105-I128 HydrophobicContact CZ-CG2 3.87Å; L107-I128 HydrophobicContact CD1-CD1 4.49Å; L107-I128 HydrophobicContact CD2-CD1 4.45Å; W124-I128 WeakPolarHBondContact O-CB 3.5Å; W124-I128 WeakPolarHBondContact O-CD1 3.47Å; W124-I128 WeakPolarHBondContact O-CG1 3.45Å; W124-I128 PolarHBondContact O-N 2.99Å; I128-H131 PolarHBondContact O-N 2.96Å; I128-N132 CarbonylContact O-C 3.48Å; I128-N132 WeakPolarHBondContact O-CA 3.4Å; I128-N132 PolarHBondContact O-N 3.28Å; I128-I137 HydrophobicContact CD1-CD1 4.23Å; I128-I137 HydrophobicContact CG2-CD1 4.14Å
129	R	96.4	Very high	96.6	Very high	71 Å²	71	38.8 Å²	38.8	27%	0.268	23%	0.225	S	C	.	.	H	α-helix	trans	-76.2	-24.1	-173.4	-67.3	-68.3	174.6	-128.5	7.9	113.5	V125 P126 D127 H131 N132 S135	V125-R129 HydrophobicContact CG1-CG 4.23Å; V125-R129 VanDerWaalsContact O-CB 3.3Å; V125-R129 WeakPolarHBondContact O-CB 3.43Å; V125-R129 WeakPolarHBondContact O-CG 3.41Å; V125-R129 PolarHBondContact O-N 3.28Å; P126-R129 PolarHBondContact O-N 2.82Å; D127-R129 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 2.97Å; R129-H131 VanDerWaalsContact C-N 3.32Å; R129-N132 PolarHBondContact NH1-O 2.82Å; R129-S135 PolarHBondContact NH1-O 3.33Å; R129-S135 PolarHBondContact NH2-O 3.39Å
130	A	95	Very high	96.6	Very high	79 Å²	79	37 Å²	37	65%	0.653	22%	0.216	S	C	*	.	H	α-helix	trans	-63.4	-38.1	172.3	0	0	0	0	0	112	P126 D127	P126-A130 WeakPolarHBondContact O-CB 3.44Å; P126-A130 PolarHBondContact O-N 2.81Å; D127-A130 PolarHBondContact O-N 3.12Å
131	H	94.3	Very high	96.6	Very high	95 Å²	95	37 Å²	37	44%	0.44	22%	0.216	S	C	.	.	H	α-helix	trans	-103.8	-23.4	-176.6	-56.3	91.2	0	0	0	113.5	Y99 D127 I128 R129	Y99-H131 HydrophobicContact CD2-CB 3.86Å; Y99-H131 AromaticContact CD2-ND1 3.89Å; Y99-H131 HydrophobicContact CG-CB 4.27Å; D127-H131 PolarHBondContact O-ND1 3.4Å; D127-H131 IonicContact OD1-CE1 2.83Å; D127-H131 IonicContact OD1-ND1 2.59Å; I128-H131 PolarHBondContact O-N 2.96Å; R129-H131 VanDerWaalsContact C-N 3.32Å
132	N	94.5	Very high	96.7	Very high	14 Å²	14	35.1 Å²	35.1	8%	0.075	20%	0.204	C	C	.	.			trans	-143.1	89.8	178.6	-167.7	-31.4	0	0	0	111.9	Y99 A102 F105 I128 R129 S134 S135	Y99-N132 WeakPolarHBondContact O-CB 3.43Å; Y99-N132 PolarHBondContact O-ND2 2.94Å; A102-N132 PolarHBondContact O-ND2 2.84Å; A102-N132 VanDerWaalsContact O-ND2 3.11Å; F105-N132 HydrophobicContact CE2-CB 3.92Å; F105-N132 HydrophobicContact CZ-CB 3.98Å; I128-N132 CarbonylContact O-C 3.48Å; I128-N132 WeakPolarHBondContact O-CA 3.4Å; I128-N132 PolarHBondContact O-N 3.28Å; R129-N132 PolarHBondContact NH1-O 2.82Å; N132-S134 VanDerWaalsContact C-N 3.27Å; N132-S134 PolarHBondContact O-N 2.91Å; N132-S134 PolarHBondContact OD1-N 3.05Å; N132-S135 WeakPolarHBondContact ND2-CB 3.4Å; N132-S135 PolarHBondContact ND2-OG 2.86Å; N132-S135 WeakPolarHBondContact OD1-CB 3.29Å; N132-S135 PolarHBondContact OD1-N 3.17Å; N132-S135 PolarHBondContact OD1-OG 3.27Å
133	A	93.6	Very high	96.6	Very high	84 Å²	84	29.8 Å²	29.8	69%	0.694	18%	0.181	S	C	*	.	S	Bend	trans	-70.1	-15.9	-175.5	0	0	0	0	0	114.9
134	S	92.8	Very high	96.7	Very high	71 Å²	71	29.2 Å²	29.2	50%	0.497	18%	0.18	S	C	.	.	S	Bend	trans	-125.5	-25	-163	72.3	0	0	0	0	116	N132 K210	N132-S134 VanDerWaalsContact C-N 3.27Å; N132-S134 PolarHBondContact O-N 2.91Å; N132-S134 PolarHBondContact OD1-N 3.05Å; S134-K210 PolarHBondContact OG-NZ 3.05Å
135	S	96.3	Very high	96.6	Very high	4 Å²	4	31 Å²	31	3%	0.028	19%	0.19	C	C	.	.	S	Bend	trans	-66	139.7	-176.7	-70	0	0	0	0	110.8	A102 R129 N132	A102-S135 PolarHBondContact O-OG 3.44Å; R129-S135 PolarHBondContact NH1-O 3.33Å; R129-S135 PolarHBondContact NH2-O 3.39Å; N132-S135 WeakPolarHBondContact ND2-CB 3.4Å; N132-S135 PolarHBondContact ND2-OG 2.86Å; N132-S135 WeakPolarHBondContact OD1-CB 3.29Å; N132-S135 PolarHBondContact OD1-N 3.17Å; N132-S135 PolarHBondContact OD1-OG 3.27Å
136	P	98.1	Very high	96.5	Very high	13 Å²	13	34.7 Å²	34.7	8%	0.084	20%	0.201	C	C	.	.			trans	-58.3	150.6	178.1	23	-33.9	0	0	0	111.8	D103 V104 F105 T179 A202	D103-P136 VanDerWaalsContact O-CD 3.32Å; D103-P136 WeakPolarHBondContact O-CD 3.36Å; V104-P136 HydrophobicContact CB-CG 4.05Å; V104-P136 HydrophobicContact CG2-CB 4.34Å; V104-P136 HydrophobicContact CG2-CG 3.93Å; F105-P136 PolarHBondContact N-O 2.89Å; P136-T179 WeakPolarHBondContact CB-OG1 3.47Å; P136-A202 HydrophobicContact CB-CB 3.94Å; P136-A202 HydrophobicContact CG-CB 3.94Å
137	I	98.6	Very high	96.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.3	171.5	-66.8	170.7	0	0	0	107.1	F105 L107 I128 I176 A178 T179	F105-I137 HydrophobicContact CB-CG1 4.12Å; F105-I137 HydrophobicContact CD2-CG1 4.47Å; F105-I137 CarbonylContact O-C 3.56Å; F105-I137 WeakPolarHBondContact O-CA 3.17Å; L107-I137 HydrophobicContact CB-CG2 3.73Å; L107-I137 HydrophobicContact CD2-CG2 4.21Å; I128-I137 HydrophobicContact CD1-CD1 4.23Å; I128-I137 HydrophobicContact CG2-CD1 4.14Å; I137-I176 HydrophobicContact CG2-CD1 4.47Å; I137-A178 CarbonylContact O-C 3.39Å; I137-A178 VanDerWaalsContact O-CA 3.3Å; I137-A178 WeakPolarHBondContact O-CA 3.47Å; I137-A178 WeakPolarHBondContact O-CB 3.05Å; I137-T179 PolarHBondContact O-N 3.24Å
138	I	98.7	Very high	96.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123	163.1	-52.4	-57	0	0	0	106.6	V104 F105 L106 L107 V140 T179 D180 I182 A198 A199 A202	V104-I138 HydrophobicContact CG2-CG1 4.25Å; F105-I138 PolarHBondContact O-N 3Å; L106-I138 HydrophobicContact CD2-CB 4.17Å; L106-I138 HydrophobicContact CD2-CG2 4.34Å; L107-I138 PolarHBondContact N-O 3.02Å; I138-V140 HydrophobicContact CG2-CG2 4.1Å; I138-T179 HydrophobicContact CD1-CG2 4.4Å; I138-D180 HydrophobicContact CD1-CB 4.05Å; I138-D180 HydrophobicContact CG2-CB 4.47Å; I138-I182 HydrophobicContact CG2-CD1 4.47Å; I138-A198 HydrophobicContact CD1-CB 4.46Å; I138-A199 HydrophobicContact CG1-CB 3.97Å; I138-A202 HydrophobicContact CD1-CB 4.13Å
139	L	98.8	Very high	96.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	129	174.2	-177.9	66.3	0	0	0	108.8	L107 F109 I120 M172 A173 I176 A178 D180 Y181 I182	L107-L139 HydrophobicContact CD2-CD1 4.47Å; L107-L139 HydrophobicContact CG-CD1 4.24Å; F109-L139 HydrophobicContact CD1-CD1 3.87Å; F109-L139 HydrophobicContact CD1-CG 4.32Å; F109-L139 HydrophobicContact CE1-CD1 4.04Å; F109-L139 HydrophobicContact CE1-CD2 4.2Å; F109-L139 HydrophobicContact CE1-CG 3.99Å; I120-L139 HydrophobicContact CD1-CD1 3.67Å; I120-L139 HydrophobicContact CG1-CD1 4.34Å; I120-L139 HydrophobicContact CG2-CD1 4.47Å; L139-M172 HydrophobicContact CD2-CB 4.36Å; L139-M172 HydrophobicContact CD2-CG 4.41Å; L139-A173 HydrophobicContact CB-CB 4.31Å; L139-A173 HydrophobicContact CD2-CB 3.86Å; L139-I176 HydrophobicContact CD1-CD1 4.31Å; L139-A178 HydrophobicContact CB-CB 4.15Å; L139-D180 PolarHBondContact N-O 3.29Å; L139-Y181 HydrophobicContact CB-CD2 4.03Å; L139-Y181 HydrophobicContact CD2-CD2 3.83Å; L139-Y181 HydrophobicContact CD2-CE2 4.3Å; L139-Y181 HydrophobicContact CG-CD2 3.81Å; L139-Y181 HydrophobicContact CG-CE2 4.31Å; L139-Y181 WeakPolarHBondContact O-CA 3.5Å; L139-Y181 WeakPolarHBondContact O-CD2 3.28Å; L139-I182 PolarHBondContact O-N 2.65Å
140	V	98.8	Very high	96	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.1	-177.6	-170.7	0	0	0	0	111.2	M46 L106 L107 C108 F109 I138 T142 I182 C184	M46-V140 HydrophobicContact CE-CG1 3.8Å; M46-V140 HydrophobicContact SD-CG1 4.22Å; L106-V140 HydrophobicContact CD2-CG2 3.6Å; L107-V140 PolarHBondContact O-N 3.49Å; C108-V140 WeakPolarHBondContact CA-O 3.41Å; F109-V140 VanDerWaalsContact CD1-O 3.25Å; F109-V140 WeakPolarHBondContact CD1-O 3.07Å; F109-V140 PolarHBondContact N-O 3.37Å; I138-V140 HydrophobicContact CG2-CG2 4.1Å; V140-T142 HydrophobicContact CG1-CG2 4.06Å; V140-I182 CarbonylContact C-O 3.58Å; V140-I182 VanDerWaalsContact CA-O 3.27Å; V140-I182 WeakPolarHBondContact CA-O 3.41Å; V140-C184 VanDerWaalsContact CG1-SG 3.57Å
141	G	98.6	Very high	96	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	107.7	168.8	0	0	0	0	0	110.2	F109 I182 E183 C184	F109-G141 CarbonylContact O-C 3.47Å; F109-G141 WeakPolarHBondContact O-CA 3.25Å; G141-I182 PolarHBondContact N-O 3.38Å; G141-E183 CarbonylContact O-C 3.58Å; G141-E183 VanDerWaalsContact O-CA 3.26Å; G141-E183 WeakPolarHBondContact O-CA 3.16Å; G141-C184 PolarHBondContact O-N 3.4Å
142	T	98.3	Very high	96	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	172.9	-174.9	65.3	0	0	0	0	112	V41 M46 C108 F109 S110 M111 V140 L144 C184	V41-T142 VanDerWaalsContact O-CB 3.27Å; V41-T142 WeakPolarHBondContact O-CB 3.37Å; V41-T142 PolarHBondContact O-OG1 3.08Å; M46-T142 HydrophobicContact CG-CG2 4.44Å; M46-T142 HydrophobicContact SD-CG2 3.43Å; M46-T142 WeakPolarHBondContact SD-CG2 3.5Å; C108-T142 HydrophobicContact CB-CG2 3.91Å; F109-T142 PolarHBondContact O-N 3.21Å; F109-T142 PolarHBondContact O-OG1 2.89Å; S110-T142 WeakPolarHBondContact CA-OG1 3.48Å; M111-T142 VanDerWaalsContact CG-O 3.27Å; M111-T142 WeakPolarHBondContact CG-O 3.46Å; M111-T142 PolarHBondContact N-O 3.17Å; V140-T142 HydrophobicContact CG1-CG2 4.06Å; T142-L144 PolarHBondContact O-N 3.01Å; T142-C184 CarbonylContact C-O 3.5Å
143	Q	96.7	Very high	95.9	Very high	34 Å²	34	44.2 Å²	44.2	16%	0.159	25%	0.248	C	C	.	.			trans	59.1	34.6	175.9	-54.6	179.5	-7.3	0	0	112.9	A40 S110 D145 R146 C184	A40-Q143 PolarHBondContact O-NE2 3.43Å; S110-Q143 PolarHBondContact OG-OE1 3.48Å; Q143-D145 PolarHBondContact O-N 2.87Å; Q143-D145 VanDerWaalsContact O-N 3.15Å; Q143-R146 HydrophobicContact CB-CB 4.46Å; Q143-R146 HydrophobicContact CB-CG 4.04Å; Q143-R146 WeakPolarHBondContact O-CB 3.48Å; Q143-R146 PolarHBondContact O-N 3.41Å; Q143-R146 VanDerWaalsContact OE1-NH1 3.12Å; Q143-C184 PolarHBondContact N-O 3.1Å
144	L	97.3	Very high	96	Very high	23 Å²	23	43.9 Å²	43.9	12%	0.12	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-56.7	-31.5	-178.2	-178.8	64.5	0	0	0	112.9	M111 T142 R146 L147 E183 C184 K190	M111-L144 HydrophobicContact CE-CD1 4.48Å; T142-L144 PolarHBondContact O-N 3.01Å; L144-R146 VanDerWaalsContact C-N 3.26Å; L144-R146 PolarHBondContact O-N 3.36Å; L144-L147 HydrophobicContact CD1-CD1 3.77Å; L144-L147 WeakPolarHBondContact O-CB 3.37Å; L144-L147 PolarHBondContact O-N 3Å; L144-E183 HydrophobicContact CD1-CB 4.27Å; L144-E183 HydrophobicContact CD2-CB 4.12Å; L144-C184 VanDerWaalsContact CB-O 3.32Å; L144-C184 WeakPolarHBondContact CB-O 3.27Å; L144-C184 PolarHBondContact N-O 2.92Å; L144-C184 VanDerWaalsContact N-O 3.14Å; L144-K190 HydrophobicContact CD2-CD 3.97Å
145	D	95.9	Very high	96	Very high	40 Å²	40	44.5 Å²	44.5	21%	0.214	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.4	-32.3	175	53.6	-76.4	0	0	0	113.2	Q143 L147 L148 S185 L187 T188	Q143-D145 PolarHBondContact O-N 2.87Å; Q143-D145 VanDerWaalsContact O-N 3.15Å; D145-L147 PolarHBondContact O-N 3.5Å; D145-L148 WeakPolarHBondContact O-CB 3.41Å; D145-L148 PolarHBondContact O-N 3.24Å; D145-S185 WeakPolarHBondContact CB-OG 2.92Å; D145-S185 VanDerWaalsContact CG-OG 3.26Å; D145-S185 WeakPolarHBondContact OD1-CB 3.27Å; D145-S185 PolarHBondContact OD1-OG 2.93Å; D145-L187 WeakPolarHBondContact OD2-CD2 3.36Å; D145-T188 HydrophobicContact CB-CG2 4.14Å
146	R	95.6	Very high	95.9	Very high	100 Å²	100	45.4 Å²	45.4	38%	0.377	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-69.7	-16.9	-178.3	-61.1	-173.6	73.2	-171.6	2.9	113.3	V112 Q143 L144 L148 D149	V112-R146 HydrophobicContact CG1-CB 3.83Å; V112-R146 HydrophobicContact CG2-CB 3.91Å; Q143-R146 HydrophobicContact CB-CB 4.46Å; Q143-R146 HydrophobicContact CB-CG 4.04Å; Q143-R146 WeakPolarHBondContact O-CB 3.48Å; Q143-R146 PolarHBondContact O-N 3.41Å; Q143-R146 VanDerWaalsContact OE1-NH1 3.12Å; L144-R146 VanDerWaalsContact C-N 3.26Å; L144-R146 PolarHBondContact O-N 3.36Å; R146-L148 PolarHBondContact O-N 3.34Å; R146-D149 PolarHBondContact O-N 3.31Å; R146-D149 VanDerWaalsContact O-N 3.17Å
147	L	93.8	Very high	95.7	Very high	46 Å²	46	50.4 Å²	50.4	24%	0.241	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-65.5	-17.8	171.2	-65.4	-177.8	0	0	0	112.8	M111 V112 L144 D145 P163	M111-L147 HydrophobicContact CB-CD1 4.13Å; M111-L147 HydrophobicContact CB-CD2 4.14Å; M111-L147 HydrophobicContact CB-CG 4.11Å; M111-L147 HydrophobicContact CE-CD1 4.09Å; V112-L147 HydrophobicContact CG1-CD2 3.67Å; V112-L147 HydrophobicContact CG1-CG 4.36Å; L144-L147 HydrophobicContact CD1-CD1 3.77Å; L144-L147 WeakPolarHBondContact O-CB 3.37Å; L144-L147 PolarHBondContact O-N 3Å; D145-L147 PolarHBondContact O-N 3.5Å; L147-P163 HydrophobicContact CD2-CB 3.46Å; L147-P163 VanDerWaalsContact CD2-CB 3.46Å; L147-P163 HydrophobicContact CD2-CG 4.08Å
148	L	92.9	Very high	95.5	Very high	151 Å²	151	57.1 Å²	57.1	79%	0.791	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-92.7	-9.1	176.9	-55.6	178	0	0	0	112.6	D145 R146 V150	D145-L148 WeakPolarHBondContact O-CB 3.41Å; D145-L148 PolarHBondContact O-N 3.24Å; R146-L148 PolarHBondContact O-N 3.34Å; L148-V150 PolarHBondContact O-N 2.79Å
149	D	93.9	Very high	95.2	Very high	69 Å²	69	61.6 Å²	61.6	37%	0.369	32%	0.322	S	S	.	.			trans	-83.8	111.1	179.1	-173.4	-15	0	0	0	110.7	R146 N151 V152 L153	R146-D149 PolarHBondContact O-N 3.31Å; R146-D149 VanDerWaalsContact O-N 3.17Å; D149-N151 PolarHBondContact O-N 2.99Å; D149-N151 WeakPolarHBondContact OD1-CB 3.49Å; D149-N151 PolarHBondContact OD1-N 2.98Å; D149-V152 HydrophobicContact CB-CB 4.14Å; D149-V152 HydrophobicContact CB-CG2 3.86Å; D149-V152 PolarHBondContact O-N 2.55Å; D149-L153 WeakPolarHBondContact O-CG 3.48Å; D149-L153 PolarHBondContact O-N 3.46Å; D149-L153 VanDerWaalsContact O-N 3.16Å
150	V	94.1	Very high	95	Very high	95 Å²	95	70.9 Å²	70.9	58%	0.576	36%	0.362	S	S	*	.	H	α-helix	trans	-59.4	-35.4	-179.3	179.5	0	0	0	0	111.9	L148 L153 I154	L148-V150 PolarHBondContact O-N 2.79Å; V150-L153 PolarHBondContact O-N 2.97Å; V150-I154 HydrophobicContact CG1-CD1 3.77Å; V150-I154 HydrophobicContact CG1-CG1 4.3Å; V150-I154 VanDerWaalsContact O-CG1 3.26Å; V150-I154 WeakPolarHBondContact O-CG1 3.27Å; V150-I154 PolarHBondContact O-N 3.01Å
151	N	95.3	Very high	94.8	Very high	110 Å²	110	73.5 Å²	73.5	59%	0.588	38%	0.378	S	S	*	.	H	α-helix	trans	-67.1	-41.7	-179.8	-64.8	-48.1	0	0	0	111.1	D149 L153 I154 D155	D149-N151 PolarHBondContact O-N 2.99Å; D149-N151 WeakPolarHBondContact OD1-CB 3.49Å; D149-N151 PolarHBondContact OD1-N 2.98Å; N151-L153 VanDerWaalsContact C-N 3.32Å; N151-L153 PolarHBondContact O-N 2.8Å; N151-I154 PolarHBondContact O-N 2.98Å; N151-D155 PolarHBondContact O-N 3.19Å
152	V	93.1	Very high	94.5	Very high	18 Å²	18	81.5 Å²	81.5	11%	0.109	41%	0.413	C	S	.	.	H	α-helix	trans	-60.6	-43.6	175.5	175.6	0	0	0	0	110.6	V112 D149 D155 L156	V112-V152 HydrophobicContact CB-CG1 3.87Å; V112-V152 HydrophobicContact CG1-CG1 3.8Å; V112-V152 HydrophobicContact CG2-CG1 4.26Å; D149-V152 HydrophobicContact CB-CB 4.14Å; D149-V152 HydrophobicContact CB-CG2 3.86Å; D149-V152 PolarHBondContact O-N 2.55Å; V152-D155 PolarHBondContact O-N 3.15Å; V152-L156 HydrophobicContact CG1-CD1 4.21Å; V152-L156 WeakPolarHBondContact O-CG 3.43Å; V152-L156 PolarHBondContact O-N 3.32Å
153	L	93.4	Very high	94.4	Very high	68 Å²	68	83.1 Å²	83.1	36%	0.356	42%	0.423	S	S	.	.	H	α-helix	trans	-65.5	-39.8	178.2	-62.5	-178.6	0	0	0	112.6	D149 V150 N151 L156 D157 P163	D149-L153 WeakPolarHBondContact O-CG 3.48Å; D149-L153 PolarHBondContact O-N 3.46Å; D149-L153 VanDerWaalsContact O-N 3.16Å; V150-L153 PolarHBondContact O-N 2.97Å; N151-L153 VanDerWaalsContact C-N 3.32Å; N151-L153 PolarHBondContact O-N 2.8Å; L153-L156 PolarHBondContact O-N 3.14Å; L153-D157 PolarHBondContact O-N 3.28Å; L153-P163 HydrophobicContact CD2-CG 3.57Å
154	I	94.6	Very high	94.5	Very high	78 Å²	78	81.7 Å²	81.7	40%	0.4	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175.6	-72.9	167.9	0	0	0	110.6	V150 N151 D157 K158	V150-I154 HydrophobicContact CG1-CD1 3.77Å; V150-I154 HydrophobicContact CG1-CG1 4.3Å; V150-I154 VanDerWaalsContact O-CG1 3.26Å; V150-I154 WeakPolarHBondContact O-CG1 3.27Å; V150-I154 PolarHBondContact O-N 3.01Å; N151-I154 PolarHBondContact O-N 2.98Å; I154-D157 PolarHBondContact O-N 3.25Å; I154-K158 HydrophobicContact CG2-CD 4.42Å; I154-K158 WeakPolarHBondContact O-CG 3.32Å; I154-K158 PolarHBondContact O-N 3.45Å
155	D	94	Very high	94.5	Very high	83 Å²	83	86.1 Å²	86.1	44%	0.444	44%	0.44	S	S	.	.	H	α-helix	trans	-68	-36.4	-178.2	-71.4	-21.2	0	0	0	112.1	N151 V152 K158 C159	N151-D155 PolarHBondContact O-N 3.19Å; V152-D155 PolarHBondContact O-N 3.15Å; D155-K158 PolarHBondContact O-N 2.88Å; D155-K158 IonicContact OD1-NZ 3.59Å; D155-K158 PolarHBondContact OD1-NZ 3.06Å; D155-C159 PolarHBondContact O-N 2.57Å; D155-C159 PolarHBondContact O-SG 3.37Å
156	L	92.7	Very high	94.5	Very high	24 Å²	24	86.1 Å²	86.1	13%	0.126	44%	0.443	C	S	.	.	H	α-helix	trans	-61.4	-45	170.9	-73.3	174.1	0	0	0	111.9	V112 V152 L153 K158 C159 K160 V161 P163	V112-L156 HydrophobicContact CB-CD1 4.23Å; V112-L156 WeakPolarHBondContact O-CD2 2.93Å; V152-L156 HydrophobicContact CG1-CD1 4.21Å; V152-L156 WeakPolarHBondContact O-CG 3.43Å; V152-L156 PolarHBondContact O-N 3.32Å; L153-L156 PolarHBondContact O-N 3.14Å; L156-K158 PolarHBondContact O-N 3.41Å; L156-C159 CarbonylContact O-C 3.44Å; L156-C159 WeakPolarHBondContact O-CA 3.34Å; L156-C159 PolarHBondContact O-N 3.49Å; L156-C159 VanDerWaalsContact O-N 3.13Å; L156-K160 PolarHBondContact O-N 2.88Å; L156-K160 VanDerWaalsContact O-N 3.11Å; L156-V161 CarbonylContact C-O 3.58Å; L156-V161 WeakPolarHBondContact CB-O 3.49Å; L156-V161 HydrophobicContact CD2-CB 4.39Å; L156-V161 HydrophobicContact CD2-CG1 4.13Å; L156-V161 PolarHBondContact O-N 3.25Å; L156-P163 HydrophobicContact CD1-CB 4.45Å; L156-P163 HydrophobicContact CD1-CG 3.72Å
157	D	94.1	Very high	94.7	Very high	117 Å²	117	85.1 Å²	85.1	63%	0.626	45%	0.451	S	S	*	.	H	α-helix	trans	-64.9	-38.9	179.1	-170	68.3	0	0	0	112.4	L153 I154 C159 K160	L153-D157 PolarHBondContact O-N 3.28Å; I154-D157 PolarHBondContact O-N 3.25Å; D157-C159 PolarHBondContact O-N 2.87Å; D157-K160 WeakPolarHBondContact O-CA 3.1Å; D157-K160 PolarHBondContact O-N 2.9Å
158	K	95.3	Very high	94.8	Very high	142 Å²	142	89.9 Å²	89.9	62%	0.617	47%	0.466	S	S	*	.	H	α-helix	trans	-56.4	-40.2	171.7	-72.3	173.3	-168.7	155.8	0	111.7	I154 D155 L156 K160	I154-K158 HydrophobicContact CG2-CD 4.42Å; I154-K158 WeakPolarHBondContact O-CG 3.32Å; I154-K158 PolarHBondContact O-N 3.45Å; D155-K158 PolarHBondContact O-N 2.88Å; D155-K158 IonicContact OD1-NZ 3.59Å; D155-K158 PolarHBondContact OD1-NZ 3.06Å; L156-K158 PolarHBondContact O-N 3.41Å; K158-K160 PolarHBondContact O-N 3.23Å
159	C	92.6	Very high	95.1	Very high	94 Å²	94	82.7 Å²	82.7	64%	0.635	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-0	176	-66.8	0	0	0	0	113.4	D155 L156 D157 V161	D155-C159 PolarHBondContact O-N 2.57Å; D155-C159 PolarHBondContact O-SG 3.37Å; L156-C159 CarbonylContact O-C 3.44Å; L156-C159 WeakPolarHBondContact O-CA 3.34Å; L156-C159 PolarHBondContact O-N 3.49Å; L156-C159 VanDerWaalsContact O-N 3.13Å; D157-C159 PolarHBondContact O-N 2.87Å; C159-V161 HydrophobicContact CB-CG2 4.32Å; C159-V161 PolarHBondContact O-N 3.45Å
160	K	94.1	Very high	95.3	Very high	196 Å²	196	86.8 Å²	86.8	85%	0.852	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	28.8	-174.6	-55.9	-178.3	179	177.8	0	113.6	L156 D157 K158	L156-K160 PolarHBondContact O-N 2.88Å; L156-K160 VanDerWaalsContact O-N 3.11Å; D157-K160 WeakPolarHBondContact O-CA 3.1Å; D157-K160 PolarHBondContact O-N 2.9Å; K158-K160 PolarHBondContact O-N 3.23Å
161	V	94.1	Very high	95.5	Very high	55 Å²	55	86 Å²	86	33%	0.333	44%	0.437	S	S	.	.			trans	-110.8	147.1	179.5	176.3	0	0	0	0	108.2	P114 L156 C159	P114-V161 HydrophobicContact CB-CG1 4.01Å; P114-V161 HydrophobicContact CG-CG1 3.39Å; L156-V161 CarbonylContact C-O 3.58Å; L156-V161 WeakPolarHBondContact CB-O 3.49Å; L156-V161 HydrophobicContact CD2-CB 4.39Å; L156-V161 HydrophobicContact CD2-CG1 4.13Å; L156-V161 PolarHBondContact O-N 3.25Å; C159-V161 HydrophobicContact CB-CG2 4.32Å; C159-V161 PolarHBondContact O-N 3.45Å
162	K	93.8	Very high	95.7	Very high	168 Å²	168	81.8 Å²	81.8	73%	0.73	41%	0.414	S	S	*	.			trans	-117.1	146.9	177.7	-68.3	-172.6	177.9	-176	0	110.2	P114	P114-K162 WeakPolarHBondContact CG-O 3.38Å
163	P	96.2	Very high	95.9	Very high	34 Å²	34	81.2 Å²	81.2	22%	0.221	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-54.4	157.2	172.6	-19.4	27.6	0	0	0	112.6	M111 L147 L153 L156 L165	M111-P163 WeakPolarHBondContact O-CB 3.11Å; L147-P163 HydrophobicContact CD2-CB 3.46Å; L147-P163 VanDerWaalsContact CD2-CB 3.46Å; L147-P163 HydrophobicContact CD2-CG 4.08Å; L153-P163 HydrophobicContact CD2-CG 3.57Å; L156-P163 HydrophobicContact CD1-CB 4.45Å; L156-P163 HydrophobicContact CD1-CG 3.72Å; P163-L165 PolarHBondContact O-N 2.87Å
164	V	97.4	Very high	96.2	Very high	5 Å²	5	83.9 Å²	83.9	3%	0.03	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-72.7	121.8	179.3	-174.2	0	0	0	0	109.4	F109 M111 P114 F117 A169	F109-V164 HydrophobicContact CD2-CG2 4.35Å; F109-V164 HydrophobicContact CE2-CB 3.96Å; F109-V164 HydrophobicContact CE2-CG1 3.76Å; F109-V164 HydrophobicContact CE2-CG2 4.08Å; F109-V164 HydrophobicContact CZ-CG1 4.29Å; M111-V164 WeakPolarHBondContact CE-O 3.45Å; M111-V164 PolarHBondContact O-N 2.93Å; P114-V164 HydrophobicContact CB-CG2 4.4Å; P114-V164 HydrophobicContact CG-CG2 4.29Å; F117-V164 HydrophobicContact CB-CG1 4.45Å; F117-V164 HydrophobicContact CB-CG2 3.72Å; F117-V164 HydrophobicContact CD1-CG1 4.07Å; F117-V164 HydrophobicContact CD1-CG2 4.45Å; F117-V164 HydrophobicContact CD2-CG1 3.76Å; F117-V164 HydrophobicContact CE1-CG1 4.23Å; F117-V164 HydrophobicContact CE2-CG1 3.94Å; F117-V164 HydrophobicContact CG-CG1 3.82Å; F117-V164 HydrophobicContact CG-CG2 3.98Å; F117-V164 HydrophobicContact CZ-CG1 4.14Å; V164-A169 HydrophobicContact CG1-CB 4.22Å
165	L	97.2	Very high	96.3	Very high	116 Å²	116	87.2 Å²	87.2	61%	0.607	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-74.6	136.1	175.8	-61.3	177.2	0	0	0	110.9	P163 S167 R168 A169	P163-L165 PolarHBondContact O-N 2.87Å; L165-S167 PolarHBondContact O-N 3.2Å; L165-S167 VanDerWaalsContact O-N 3.16Å; L165-R168 HydrophobicContact CB-CB 4.29Å; L165-R168 WeakPolarHBondContact O-CA 3.2Å; L165-R168 WeakPolarHBondContact O-CB 3.37Å; L165-R168 PolarHBondContact O-N 3.38Å; L165-A169 PolarHBondContact O-N 3.21Å
166	S	97.3	Very high	96.5	Very high	40 Å²	40	84 Å²	84	28%	0.28	42%	0.421	S	S	.	.	H	α-helix	trans	-51	-39.9	175.4	-55.2	0	0	0	0	113.4	A169 R170 E183	S166-A169 PolarHBondContact O-N 2.74Å; S166-R170 WeakPolarHBondContact O-CG 3.14Å; S166-R170 PolarHBondContact O-N 2.73Å; S166-E183 VanDerWaalsContact CA-OE1 3.32Å; S166-E183 WeakPolarHBondContact CA-OE1 3.36Å; S166-E183 WeakPolarHBondContact CB-OE1 3.26Å; S166-E183 PolarHBondContact OG-OE1 2.96Å; S166-E183 PolarHBondContact OG-OE2 2.95Å
167	S	98	Very high	96.7	Very high	78 Å²	78	93.3 Å²	93.3	55%	0.545	45%	0.454	S	S	.	.	H	α-helix	trans	-63.4	-41.4	177.3	53.8	0	0	0	0	112.2	L165 R170 S171	L165-S167 PolarHBondContact O-N 3.2Å; L165-S167 VanDerWaalsContact O-N 3.16Å; S167-R170 PolarHBondContact O-N 2.87Å; S167-S171 PolarHBondContact O-N 2.96Å; S167-S171 VanDerWaalsContact O-N 3.07Å; S167-S171 PolarHBondContact O-OG 3.22Å
168	R	97.8	Very high	96.9	Very high	147 Å²	147	88.7 Å²	88.7	56%	0.555	43%	0.432	S	S	*	.	H	α-helix	trans	-66.7	-40.5	177.3	-172	-178.6	179.8	-173.3	-5.6	111.1	F117 L165 S171 M172	F117-R168 HydrophobicContact CE1-CG 3.79Å; F117-R168 HydrophobicContact CZ-CG 3.96Å; L165-R168 HydrophobicContact CB-CB 4.29Å; L165-R168 WeakPolarHBondContact O-CA 3.2Å; L165-R168 WeakPolarHBondContact O-CB 3.37Å; L165-R168 PolarHBondContact O-N 3.38Å; R168-S171 PolarHBondContact O-N 3.24Å; R168-M172 PolarHBondContact O-N 3.33Å
169	A	98	Very high	97.1	Very high	0 Å²	0	85.9 Å²	85.9	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-68.3	-38.3	178	0	0	0	0	0	112.7	F109 F117 V164 L165 S166 M172 A173 Y181	F109-A169 HydrophobicContact CE1-CB 4.38Å; F109-A169 HydrophobicContact CZ-CB 3.74Å; F117-A169 HydrophobicContact CE2-CB 3.89Å; F117-A169 HydrophobicContact CZ-CB 4.39Å; V164-A169 HydrophobicContact CG1-CB 4.22Å; L165-A169 PolarHBondContact O-N 3.21Å; S166-A169 PolarHBondContact O-N 2.74Å; A169-M172 WeakPolarHBondContact O-CB 3.33Å; A169-M172 PolarHBondContact O-N 2.92Å; A169-M172 VanDerWaalsContact O-N 3.16Å; A169-A173 PolarHBondContact O-N 3.44Å; A169-Y181 HydrophobicContact CB-CE1 3.82Å; A169-Y181 HydrophobicContact CB-CE2 3.76Å; A169-Y181 WeakPolarHBondContact CB-OH 3.22Å
170	R	98.4	Very high	97.3	Very high	155 Å²	155	85.3 Å²	85.3	59%	0.585	42%	0.417	S	S	*	.	H	α-helix	trans	-58.7	-48.9	169.5	-73.4	176.7	-154.7	-170.6	6.1	112.1	S166 S167 M172 A173 D174 Y181	S166-R170 WeakPolarHBondContact O-CG 3.14Å; S166-R170 PolarHBondContact O-N 2.73Å; S167-R170 PolarHBondContact O-N 2.87Å; R170-M172 PolarHBondContact O-N 3.2Å; R170-A173 WeakPolarHBondContact O-CB 3.21Å; R170-A173 PolarHBondContact O-N 3.35Å; R170-D174 PolarHBondContact O-N 2.92Å; R170-Y181 HydrophobicContact CB-CD1 4.42Å; R170-Y181 HydrophobicContact CG-CD1 3.47Å; R170-Y181 VanDerWaalsContact CG-CD1 3.47Å; R170-Y181 HydrophobicContact CG-CE1 3.86Å; R170-Y181 HydrophobicContact CG-CG 4.5Å
171	S	98.5	Very high	97.6	Very high	78 Å²	78	77.2 Å²	77.2	55%	0.545	38%	0.382	S	S	.	.	H	α-helix	trans	-60.8	-31.5	176.1	-59.6	0	0	0	0	112.8	S167 R168 K175	S167-S171 PolarHBondContact O-N 2.96Å; S167-S171 VanDerWaalsContact O-N 3.07Å; S167-S171 PolarHBondContact O-OG 3.22Å; R168-S171 PolarHBondContact O-N 3.24Å; S171-K175 WeakPolarHBondContact O-CB 3.31Å; S171-K175 PolarHBondContact O-N 2.89Å
172	M	98.5	Very high	97.8	Very high	21 Å²	21	75.5 Å²	75.5	10%	0.103	37%	0.37	C	S	.	.	H	α-helix	trans	-68.2	-43.6	173	-173.4	69.8	83.7	0	0	111.8	F117 I120 T121 L139 R168 A169 R170 D174 K175 I176	F117-M172 HydrophobicContact CD1-CE 4.24Å; F117-M172 HydrophobicContact CE1-CE 3.6Å; F117-M172 HydrophobicContact CE2-CB 3.79Å; F117-M172 HydrophobicContact CE2-CE 4.23Å; F117-M172 HydrophobicContact CE2-CG 3.98Å; F117-M172 HydrophobicContact CZ-CB 3.56Å; F117-M172 HydrophobicContact CZ-CE 3.62Å; F117-M172 HydrophobicContact CZ-CG 3.96Å; I120-M172 HydrophobicContact CD1-CG 4.32Å; I120-M172 HydrophobicContact CG2-CG 4.09Å; I120-M172 HydrophobicContact CG2-SD 4.45Å; T121-M172 HydrophobicContact CG2-CE 4.23Å; T121-M172 HydrophobicContact CG2-SD 3.37Å; T121-M172 WeakPolarHBondContact CG2-SD 3.45Å; L139-M172 HydrophobicContact CD2-CB 4.36Å; L139-M172 HydrophobicContact CD2-CG 4.41Å; R168-M172 PolarHBondContact O-N 3.33Å; A169-M172 WeakPolarHBondContact O-CB 3.33Å; A169-M172 PolarHBondContact O-N 2.92Å; A169-M172 VanDerWaalsContact O-N 3.16Å; R170-M172 PolarHBondContact O-N 3.2Å; M172-D174 VanDerWaalsContact C-N 3.29Å; M172-D174 PolarHBondContact O-N 3.14Å; M172-K175 WeakPolarHBondContact O-CB 3.48Å; M172-K175 PolarHBondContact O-N 2.75Å; M172-K175 VanDerWaalsContact O-N 3.13Å; M172-K175 HydrophobicContact SD-CD 4.21Å; M172-I176 HydrophobicContact CG-CG2 4.45Å; M172-I176 WeakPolarHBondContact O-CG1 3.29Å; M172-I176 WeakPolarHBondContact O-CG2 3.35Å; M172-I176 PolarHBondContact O-N 3.33Å; M172-I176 HydrophobicContact SD-CG2 4.3Å
173	A	98.5	Very high	98	Very high	6 Å²	6	69 Å²	69	5%	0.05	34%	0.343	C	S	.	.	H	α-helix	trans	-56.1	-45.5	175.9	0	0	0	0	0	111.3	L139 A169 R170 I176 R177 A178 Y181	L139-A173 HydrophobicContact CB-CB 4.31Å; L139-A173 HydrophobicContact CD2-CB 3.86Å; A169-A173 PolarHBondContact O-N 3.44Å; R170-A173 WeakPolarHBondContact O-CB 3.21Å; R170-A173 PolarHBondContact O-N 3.35Å; A173-I176 WeakPolarHBondContact O-CG1 3.42Å; A173-I176 PolarHBondContact O-N 3.09Å; A173-R177 PolarHBondContact O-N 3Å; A173-A178 HydrophobicContact CB-CB 4.09Å; A173-A178 PolarHBondContact O-N 3.43Å; A173-Y181 HydrophobicContact CB-CG 4.43Å
174	D	98.3	Very high	98.1	Very high	125 Å²	125	67.4 Å²	67.4	67%	0.668	33%	0.332	S	S	*	.	H	α-helix	trans	-61.1	-46.7	174.7	-64.8	-33.8	0	0	0	111.5	R170 M172 I176 R177	R170-D174 PolarHBondContact O-N 2.92Å; M172-D174 VanDerWaalsContact C-N 3.29Å; M172-D174 PolarHBondContact O-N 3.14Å; D174-I176 VanDerWaalsContact C-N 3.31Å; D174-I176 PolarHBondContact O-N 3.31Å; D174-R177 PolarHBondContact O-N 3.36Å; D174-R177 VanDerWaalsContact O-N 3.1Å
175	K	98.1	Very high	98.1	Very high	147 Å²	147	67.2 Å²	67.2	64%	0.639	33%	0.331	S	S	*	.	H	α-helix	trans	-58.4	-41.5	180	-177.7	-177	178	-173.6	0	112.3	T121 S171 M172 R177	T121-K175 HydrophobicContact CG2-CD 4.47Å; S171-K175 WeakPolarHBondContact O-CB 3.31Å; S171-K175 PolarHBondContact O-N 2.89Å; M172-K175 WeakPolarHBondContact O-CB 3.48Å; M172-K175 PolarHBondContact O-N 2.75Å; M172-K175 VanDerWaalsContact O-N 3.13Å; M172-K175 HydrophobicContact SD-CD 4.21Å; K175-R177 VanDerWaalsContact C-N 3.31Å
176	I	97.8	Very high	97.9	Very high	16 Å²	16	62 Å²	62	8%	0.082	31%	0.305	C	S	.	.	H	α-helix	trans	-88.1	-1	-179.2	72.9	176.4	0	0	0	113	L107 I120 T121 V125 I137 L139 M172 A173 D174 A178	L107-I176 HydrophobicContact CD2-CD1 4.2Å; I120-I176 HydrophobicContact CG2-CD1 3.97Å; I120-I176 HydrophobicContact CG2-CG2 4.2Å; T121-I176 HydrophobicContact CG2-CG2 3.73Å; V125-I176 HydrophobicContact CG2-CB 4.04Å; V125-I176 HydrophobicContact CG2-CD1 3.98Å; V125-I176 HydrophobicContact CG2-CG2 3.95Å; I137-I176 HydrophobicContact CG2-CD1 4.47Å; L139-I176 HydrophobicContact CD1-CD1 4.31Å; M172-I176 HydrophobicContact CG-CG2 4.45Å; M172-I176 WeakPolarHBondContact O-CG1 3.29Å; M172-I176 WeakPolarHBondContact O-CG2 3.35Å; M172-I176 PolarHBondContact O-N 3.33Å; M172-I176 HydrophobicContact SD-CG2 4.3Å; A173-I176 WeakPolarHBondContact O-CG1 3.42Å; A173-I176 PolarHBondContact O-N 3.09Å; D174-I176 VanDerWaalsContact C-N 3.31Å; D174-I176 PolarHBondContact O-N 3.31Å; I176-A178 VanDerWaalsContact C-N 3.29Å; I176-A178 HydrophobicContact CD1-CB 4.2Å; I176-A178 HydrophobicContact CG1-CB 3.98Å; I176-A178 PolarHBondContact O-N 2.67Å
177	R	97.8	Very high	97.7	Very high	220 Å²	220	64.5 Å²	64.5	83%	0.83	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	43.4	-174.4	-53.1	177.6	-179.3	178.3	-0.4	112.1	A173 D174 K175	A173-R177 PolarHBondContact O-N 3Å; D174-R177 PolarHBondContact O-N 3.36Å; D174-R177 VanDerWaalsContact O-N 3.1Å; K175-R177 VanDerWaalsContact C-N 3.31Å
178	A	98.3	Very high	97.5	Very high	19 Å²	19	64.9 Å²	64.9	16%	0.157	31%	0.313	C	S	.	.			trans	-62.4	147.1	168.4	0	0	0	0	0	109.3	I137 L139 A173 I176 D180	I137-A178 CarbonylContact O-C 3.39Å; I137-A178 VanDerWaalsContact O-CA 3.3Å; I137-A178 WeakPolarHBondContact O-CA 3.47Å; I137-A178 WeakPolarHBondContact O-CB 3.05Å; L139-A178 HydrophobicContact CB-CB 4.15Å; A173-A178 HydrophobicContact CB-CB 4.09Å; A173-A178 PolarHBondContact O-N 3.43Å; I176-A178 VanDerWaalsContact C-N 3.29Å; I176-A178 HydrophobicContact CD1-CB 4.2Å; I176-A178 HydrophobicContact CG1-CB 3.98Å; I176-A178 PolarHBondContact O-N 2.67Å; A178-D180 VanDerWaalsContact C-N 3.3Å
179	T	98	Very high	97.3	Very high	84 Å²	84	61.6 Å²	61.6	52%	0.515	30%	0.304	S	S	.	.	S	Bend	trans	-69.7	-33.9	176.4	-53.2	0	0	0	0	110.9	P136 I137 I138 A202	P136-T179 WeakPolarHBondContact CB-OG1 3.47Å; I137-T179 PolarHBondContact O-N 3.24Å; I138-T179 HydrophobicContact CD1-CG2 4.4Å; T179-A202 HydrophobicContact CG2-CB 4.1Å
180	D	98.3	Very high	97.2	Very high	81 Å²	81	67.2 Å²	67.2	43%	0.433	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	165.1	178.1	-149.6	-14.6	0	0	0	111.2	I138 L139 A178	I138-D180 HydrophobicContact CD1-CB 4.05Å; I138-D180 HydrophobicContact CG2-CB 4.47Å; L139-D180 PolarHBondContact N-O 3.29Å; A178-D180 VanDerWaalsContact C-N 3.3Å
181	Y	98.6	Very high	97.1	Very high	26 Å²	26	62.6 Å²	62.6	10%	0.102	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.8	171.7	170.3	-117.9	0	0	0	111.3	F109 L139 A169 R170 A173 E183	F109-Y181 AromaticContact CE1-CE2 3.89Å; F109-Y181 HydrophobicContact CE1-CE2 3.89Å; F109-Y181 HydrophobicContact CZ-CE2 4.05Å; L139-Y181 HydrophobicContact CB-CD2 4.03Å; L139-Y181 HydrophobicContact CD2-CD2 3.83Å; L139-Y181 HydrophobicContact CD2-CE2 4.3Å; L139-Y181 HydrophobicContact CG-CD2 3.81Å; L139-Y181 HydrophobicContact CG-CE2 4.31Å; L139-Y181 WeakPolarHBondContact O-CA 3.5Å; L139-Y181 WeakPolarHBondContact O-CD2 3.28Å; A169-Y181 HydrophobicContact CB-CE1 3.82Å; A169-Y181 HydrophobicContact CB-CE2 3.76Å; A169-Y181 WeakPolarHBondContact CB-OH 3.22Å; R170-Y181 HydrophobicContact CB-CD1 4.42Å; R170-Y181 HydrophobicContact CG-CD1 3.47Å; R170-Y181 VanDerWaalsContact CG-CD1 3.47Å; R170-Y181 HydrophobicContact CG-CE1 3.86Å; R170-Y181 HydrophobicContact CG-CG 4.5Å; A173-Y181 HydrophobicContact CB-CG 4.43Å; Y181-E183 HydrophobicContact CE1-CG 3.87Å; Y181-E183 WeakPolarHBondContact CE1-OE1 3.19Å; Y181-E183 HydrophobicContact CE2-CG 4.22Å; Y181-E183 VanDerWaalsContact CZ-CG 3.45Å; Y181-E183 WeakPolarHBondContact OH-CG 3.49Å; Y181-E183 PolarHBondContact OH-OE1 2.99Å
182	I	98.7	Very high	96.9	Very high	19 Å²	19	59.1 Å²	59.1	10%	0.097	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134	-177.2	-62.7	169.4	0	0	0	109.8	I138 L139 V140 G141 N191 E194 A195 A198	I138-I182 HydrophobicContact CG2-CD1 4.47Å; L139-I182 PolarHBondContact O-N 2.65Å; V140-I182 CarbonylContact C-O 3.58Å; V140-I182 VanDerWaalsContact CA-O 3.27Å; V140-I182 WeakPolarHBondContact CA-O 3.41Å; G141-I182 PolarHBondContact N-O 3.38Å; I182-N191 HydrophobicContact CG2-CB 4.07Å; I182-E194 WeakPolarHBondContact CD1-O 3.34Å; I182-A195 HydrophobicContact CB-CB 4.49Å; I182-A195 HydrophobicContact CD1-CB 4.48Å; I182-A195 HydrophobicContact CG2-CB 4.06Å; I182-A198 HydrophobicContact CD1-CB 3.58Å
183	E	98.4	Very high	96.6	Very high	33 Å²	33	63.5 Å²	63.5	15%	0.154	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.1	170.6	-67	170	-161.6	0	0	109	M111 G141 L144 S166 Y181 N191	M111-E183 HydrophobicContact CE-CG 4.02Å; M111-E183 HydrophobicContact SD-CG 4.1Å; G141-E183 CarbonylContact O-C 3.58Å; G141-E183 VanDerWaalsContact O-CA 3.26Å; G141-E183 WeakPolarHBondContact O-CA 3.16Å; L144-E183 HydrophobicContact CD1-CB 4.27Å; L144-E183 HydrophobicContact CD2-CB 4.12Å; S166-E183 VanDerWaalsContact CA-OE1 3.32Å; S166-E183 WeakPolarHBondContact CA-OE1 3.36Å; S166-E183 WeakPolarHBondContact CB-OE1 3.26Å; S166-E183 PolarHBondContact OG-OE1 2.96Å; S166-E183 PolarHBondContact OG-OE2 2.95Å; Y181-E183 HydrophobicContact CE1-CG 3.87Å; Y181-E183 WeakPolarHBondContact CE1-OE1 3.19Å; Y181-E183 HydrophobicContact CE2-CG 4.22Å; Y181-E183 VanDerWaalsContact CZ-CG 3.45Å; Y181-E183 WeakPolarHBondContact OH-CG 3.49Å; Y181-E183 PolarHBondContact OH-OE1 2.99Å; E183-N191 WeakPolarHBondContact O-CB 3.41Å; E183-N191 PolarHBondContact O-ND2 2.79Å
184	C	97.9	Very high	96.5	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.329	C	S	.	.			trans	-137.7	162.5	-177.6	72.5	0	0	0	0	113.2	V140 G141 T142 Q143 L144 K190 N191	V140-C184 VanDerWaalsContact CG1-SG 3.57Å; G141-C184 PolarHBondContact O-N 3.4Å; T142-C184 CarbonylContact C-O 3.5Å; Q143-C184 PolarHBondContact N-O 3.1Å; L144-C184 VanDerWaalsContact CB-O 3.32Å; L144-C184 WeakPolarHBondContact CB-O 3.27Å; L144-C184 PolarHBondContact N-O 2.92Å; L144-C184 VanDerWaalsContact N-O 3.14Å; C184-K190 WeakPolarHBondContact CA-O 3.45Å; C184-K190 VanDerWaalsContact CB-O 3.31Å; C184-K190 WeakPolarHBondContact CB-O 3.49Å; C184-N191 HydrophobicContact CB-CB 4.1Å
185	S	97.3	Very high	96.5	Very high	1 Å²	1	62 Å²	62	1%	0.007	30%	0.297	C	S	.	.			trans	-129.2	116.3	171.2	165.3	0	0	0	0	108.2	D145 L187 T188 Q189 K190	D145-S185 WeakPolarHBondContact CB-OG 2.92Å; D145-S185 VanDerWaalsContact CG-OG 3.26Å; D145-S185 WeakPolarHBondContact OD1-CB 3.27Å; D145-S185 PolarHBondContact OD1-OG 2.93Å; S185-L187 VanDerWaalsContact C-N 3.25Å; S185-L187 PolarHBondContact O-N 3.31Å; S185-L187 PolarHBondContact OG-N 3.37Å; S185-T188 WeakPolarHBondContact CB-OG1 3.34Å; S185-T188 PolarHBondContact OG-N 3.24Å; S185-T188 PolarHBondContact OG-OG1 2.67Å; S185-Q189 CarbonylContact O-C 3.58Å; S185-Q189 WeakPolarHBondContact O-CA 3.29Å; S185-Q189 PolarHBondContact O-N 3.37Å; S185-K190 PolarHBondContact N-O 3.37Å; S185-K190 PolarHBondContact O-N 3.46Å
186	S	94.5	Very high	96.3	Very high	7 Å²	7	55 Å²	55	5%	0.049	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-31.9	173.1	-48.3	0	0	0	0	111.1	S45 M46 S49 Y55	S45-S186 WeakPolarHBondContact O-CB 3.42Å; M46-S186 VanDerWaalsContact CA-OG 3.22Å; M46-S186 WeakPolarHBondContact CA-OG 3.4Å; M46-S186 WeakPolarHBondContact CG-OG 3.41Å; M46-S186 PolarHBondContact N-OG 3.16Å; S49-S186 PolarHBondContact OG-O 3.43Å; Y55-S186 VanDerWaalsContact CD2-C 3.46Å; Y55-S186 WeakPolarHBondContact CD2-O 3.43Å
187	L	92.6	Very high	96.1	Very high	92 Å²	92	56 Å²	56	48%	0.482	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-46.3	179.8	179.1	63	0	0	0	112.3	Y55 D145 S185	Y55-L187 HydrophobicContact CD1-CD1 3.83Å; Y55-L187 HydrophobicContact CD2-CB 4.3Å; Y55-L187 HydrophobicContact CD2-CD1 4.43Å; Y55-L187 HydrophobicContact CE1-CD1 4.05Å; Y55-L187 HydrophobicContact CE2-CB 4.15Å; Y55-L187 HydrophobicContact CG-CD1 4.03Å; D145-L187 WeakPolarHBondContact OD2-CD2 3.36Å; S185-L187 VanDerWaalsContact C-N 3.25Å; S185-L187 PolarHBondContact O-N 3.31Å; S185-L187 PolarHBondContact OG-N 3.37Å
188	T	93.4	Very high	96.1	Very high	85 Å²	85	46.5 Å²	46.5	52%	0.521	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-1.9	-178.9	62.9	0	0	0	0	113	D145 S185 K190	D145-T188 HydrophobicContact CB-CG2 4.14Å; S185-T188 WeakPolarHBondContact CB-OG1 3.34Å; S185-T188 PolarHBondContact OG-N 3.24Å; S185-T188 PolarHBondContact OG-OG1 2.67Å; T188-K190 PolarHBondContact O-N 2.77Å; T188-K190 WeakPolarHBondContact OG1-CB 3.21Å
189	Q	93.3	Very high	96	Very high	79 Å²	79	45.6 Å²	45.6	37%	0.369	23%	0.233	S	C	.	.			trans	57.9	9.9	-171.5	-61.1	172.8	-1.5	0	0	114.9	N53 S185 N191 L192	N53-Q189 PolarHBondContact O-NE2 2.84Å; S185-Q189 CarbonylContact O-C 3.58Å; S185-Q189 WeakPolarHBondContact O-CA 3.29Å; S185-Q189 PolarHBondContact O-N 3.37Å; Q189-N191 PolarHBondContact O-N 3.21Å; Q189-L192 WeakPolarHBondContact O-CB 3.2Å; Q189-L192 PolarHBondContact O-N 3.29Å
190	K	96.1	Very high	95.8	Very high	118 Å²	118	41.7 Å²	41.7	51%	0.513	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	126.1	179.1	-176.9	177.6	178.7	-178.3	0	110.4	L144 C184 S185 T188 L192	L144-K190 HydrophobicContact CD2-CD 3.97Å; C184-K190 WeakPolarHBondContact CA-O 3.45Å; C184-K190 VanDerWaalsContact CB-O 3.31Å; C184-K190 WeakPolarHBondContact CB-O 3.49Å; S185-K190 PolarHBondContact N-O 3.37Å; S185-K190 PolarHBondContact O-N 3.46Å; T188-K190 PolarHBondContact O-N 2.77Å; T188-K190 WeakPolarHBondContact OG1-CB 3.21Å; K190-L192 PolarHBondContact O-N 3.43Å; K190-L192 VanDerWaalsContact O-N 3.12Å
191	N	97.3	Very high	95.7	Very high	57 Å²	57	42.7 Å²	42.7	31%	0.305	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	13.4	178.8	-59.7	-15.8	0	0	0	115	I182 E183 C184 Q189 E194 A195	I182-N191 HydrophobicContact CG2-CB 4.07Å; E183-N191 WeakPolarHBondContact O-CB 3.41Å; E183-N191 PolarHBondContact O-ND2 2.79Å; C184-N191 HydrophobicContact CB-CB 4.1Å; Q189-N191 PolarHBondContact O-N 3.21Å; N191-E194 WeakPolarHBondContact CA-OE2 3.5Å; N191-A195 PolarHBondContact O-N 2.96Å
192	L	94.3	Very high	95.5	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-70.2	-46.2	-174.2	-173.6	64.9	0	0	0	110.9	M46 S49 Q189 K190 E194 A195 F196	M46-L192 HydrophobicContact CB-CD1 3.93Å; M46-L192 HydrophobicContact CE-CD1 4.32Å; M46-L192 HydrophobicContact CG-CD1 3.99Å; S49-L192 WeakPolarHBondContact OG-CD2 3.46Å; Q189-L192 WeakPolarHBondContact O-CB 3.2Å; Q189-L192 PolarHBondContact O-N 3.29Å; K190-L192 PolarHBondContact O-N 3.43Å; K190-L192 VanDerWaalsContact O-N 3.12Å; L192-E194 VanDerWaalsContact C-N 3.3Å; L192-E194 PolarHBondContact O-N 3.04Å; L192-A195 PolarHBondContact O-N 2.91Å; L192-F196 HydrophobicContact CD1-CD2 4.41Å; L192-F196 HydrophobicContact CD1-CE2 3.91Å; L192-F196 HydrophobicContact CG-CD2 4.46Å; L192-F196 HydrophobicContact CG-CE2 4.28Å; L192-F196 VanDerWaalsContact O-CD2 3.31Å; L192-F196 WeakPolarHBondContact O-CD2 3.26Å; L192-F196 PolarHBondContact O-N 3.17Å
193	K	91.7	Very high	95.3	Very high	114 Å²	114	41 Å²	41	50%	0.496	20%	0.204	S	C	.	.	H	α-helix	trans	-62.2	-42.1	178	-170.8	-170.1	-175.4	-53.6	0	111	Y50 A195 F196 D197	Y50-K193 HydrophobicContact CE2-CG 4.43Å; K193-A195 VanDerWaalsContact C-N 3.29Å; K193-A195 PolarHBondContact O-N 3.36Å; K193-F196 PolarHBondContact O-N 3.26Å; K193-D197 IonicContact NZ-OD1 2.63Å; K193-D197 PolarHBondContact NZ-OD1 3.08Å; K193-D197 IonicContact NZ-OD2 3.27Å; K193-D197 PolarHBondContact NZ-OD2 3.08Å; K193-D197 WeakPolarHBondContact O-CB 3.36Å; K193-D197 VanDerWaalsContact O-CG 3.25Å; K193-D197 PolarHBondContact O-N 3.5Å
194	E	95.9	Very high	95	Very high	98 Å²	98	41.9 Å²	41.9	46%	0.458	21%	0.209	S	C	.	.	H	α-helix	trans	-59	-40.6	179.7	-66.7	80.5	172.2	0	0	111.4	I182 N191 L192 A198	I182-E194 WeakPolarHBondContact CD1-O 3.34Å; N191-E194 WeakPolarHBondContact CA-OE2 3.5Å; L192-E194 VanDerWaalsContact C-N 3.3Å; L192-E194 PolarHBondContact O-N 3.04Å; E194-A198 VanDerWaalsContact O-CB 3.26Å; E194-A198 WeakPolarHBondContact O-CB 3.34Å; E194-A198 PolarHBondContact O-N 3.23Å
195	A	97.4	Very high	94.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-47.2	176	0	0	0	0	0	112.4	M46 I182 N191 L192 K193 A199	M46-A195 HydrophobicContact CE-CB 4.48Å; I182-A195 HydrophobicContact CB-CB 4.49Å; I182-A195 HydrophobicContact CD1-CB 4.48Å; I182-A195 HydrophobicContact CG2-CB 4.06Å; N191-A195 PolarHBondContact O-N 2.96Å; L192-A195 PolarHBondContact O-N 2.91Å; K193-A195 VanDerWaalsContact C-N 3.29Å; K193-A195 PolarHBondContact O-N 3.36Å; A195-A199 PolarHBondContact O-N 2.84Å
196	F	95.6	Very high	94.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.6	-42.1	178.7	-75.7	-78.4	0	0	0	112.4	L35 M46 I47 Y50 L82 L106 L192 K193 A198 A199 I200	L35-F196 HydrophobicContact CD1-CE1 4.23Å; L35-F196 HydrophobicContact CD2-CZ 4.46Å; M46-F196 HydrophobicContact CB-CE2 4.36Å; M46-F196 HydrophobicContact CB-CZ 4.34Å; M46-F196 HydrophobicContact CE-CE2 4.4Å; I47-F196 HydrophobicContact CG1-CZ 4.29Å; Y50-F196 VanDerWaalsContact CB-CE2 3.45Å; Y50-F196 HydrophobicContact CD1-CD1 4.23Å; Y50-F196 AromaticContact CD1-CD2 3.94Å; Y50-F196 HydrophobicContact CD1-CD2 3.94Å; Y50-F196 HydrophobicContact CD1-CE1 4.38Å; Y50-F196 HydrophobicContact CD1-CE2 4.12Å; Y50-F196 HydrophobicContact CD1-CG 4.01Å; Y50-F196 HydrophobicContact CD1-CZ 4.33Å; Y50-F196 HydrophobicContact CD2-CB 4.14Å; Y50-F196 AromaticContact CD2-CD2 3.37Å; Y50-F196 HydrophobicContact CD2-CD2 3.37Å; Y50-F196 AromaticContact CD2-CE2 3.98Å; Y50-F196 HydrophobicContact CD2-CE2 3.98Å; Y50-F196 AromaticContact CD2-CG 3.9Å; Y50-F196 HydrophobicContact CD2-CG 3.9Å; Y50-F196 HydrophobicContact CE1-CB 4.2Å; Y50-F196 HydrophobicContact CE1-CD1 4.28Å; Y50-F196 HydrophobicContact CE1-CD2 4.36Å; Y50-F196 HydrophobicContact CE1-CG 4.03Å; Y50-F196 HydrophobicContact CE2-CB 3.66Å; Y50-F196 AromaticContact CE2-CD2 3.84Å; Y50-F196 HydrophobicContact CE2-CD2 3.84Å; Y50-F196 AromaticContact CE2-CG 3.91Å; Y50-F196 HydrophobicContact CE2-CG 3.91Å; Y50-F196 AromaticContact CG-CD2 3.41Å; Y50-F196 HydrophobicContact CG-CD2 3.41Å; Y50-F196 VanDerWaalsContact CG-CD2 3.41Å; Y50-F196 AromaticContact CG-CE2 3.59Å; Y50-F196 HydrophobicContact CG-CE2 3.59Å; Y50-F196 AromaticContact CG-CG 3.94Å; Y50-F196 HydrophobicContact CG-CG 3.94Å; Y50-F196 HydrophobicContact CG-CZ 4.22Å; Y50-F196 AromaticContact CZ-CG 3.98Å; L82-F196 HydrophobicContact CD1-CD1 4.37Å; L82-F196 HydrophobicContact CD1-CE1 3.87Å; L82-F196 HydrophobicContact CD1-CZ 4.47Å; L82-F196 HydrophobicContact CD2-CD1 3.94Å; L82-F196 HydrophobicContact CD2-CE1 3.85Å; L82-F196 HydrophobicContact CG-CE1 4.46Å; L106-F196 HydrophobicContact CD1-CD1 3.85Å; L106-F196 HydrophobicContact CD1-CE1 3.74Å; L192-F196 HydrophobicContact CD1-CD2 4.41Å; L192-F196 HydrophobicContact CD1-CE2 3.91Å; L192-F196 HydrophobicContact CG-CD2 4.46Å; L192-F196 HydrophobicContact CG-CE2 4.28Å; L192-F196 VanDerWaalsContact O-CD2 3.31Å; L192-F196 WeakPolarHBondContact O-CD2 3.26Å; L192-F196 PolarHBondContact O-N 3.17Å; K193-F196 PolarHBondContact O-N 3.26Å; F196-A198 PolarHBondContact O-N 3.39Å; F196-A199 WeakPolarHBondContact O-CB 3.17Å; F196-A199 PolarHBondContact O-N 2.67Å; F196-I200 WeakPolarHBondContact O-CD1 3.05Å; F196-I200 VanDerWaalsContact O-CG1 3.27Å; F196-I200 WeakPolarHBondContact O-CG1 3.48Å; F196-I200 PolarHBondContact O-N 2.82Å
197	D	93.7	Very high	94	Very high	39 Å²	39	52.6 Å²	52.6	21%	0.209	26%	0.258	C	S	.	.	H	α-helix	trans	-57.2	-49.1	175.3	-75	-5.2	0	0	0	110.5	K193 A199 I200 F201	K193-D197 IonicContact NZ-OD1 2.63Å; K193-D197 PolarHBondContact NZ-OD1 3.08Å; K193-D197 IonicContact NZ-OD2 3.27Å; K193-D197 PolarHBondContact NZ-OD2 3.08Å; K193-D197 WeakPolarHBondContact O-CB 3.36Å; K193-D197 VanDerWaalsContact O-CG 3.25Å; K193-D197 PolarHBondContact O-N 3.5Å; D197-A199 VanDerWaalsContact C-N 3.28Å; D197-A199 PolarHBondContact O-N 3.05Å; D197-I200 PolarHBondContact O-N 3.36Å; D197-F201 HydrophobicContact CB-CD2 4.23Å; D197-F201 HydrophobicContact CB-CE2 4.08Å; D197-F201 WeakPolarHBondContact O-CB 3.39Å; D197-F201 WeakPolarHBondContact O-CD2 3.38Å; D197-F201 WeakPolarHBondContact O-CG 3.49Å; D197-F201 PolarHBondContact O-N 2.97Å
198	A	96.6	Very high	93.5	Very high	19 Å²	19	51.9 Å²	51.9	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-58.5	-40.1	178.7	0	0	0	0	0	112.1	I138 I182 E194 F196 A202	I138-A198 HydrophobicContact CD1-CB 4.46Å; I182-A198 HydrophobicContact CD1-CB 3.58Å; E194-A198 VanDerWaalsContact O-CB 3.26Å; E194-A198 WeakPolarHBondContact O-CB 3.34Å; E194-A198 PolarHBondContact O-N 3.23Å; F196-A198 PolarHBondContact O-N 3.39Å; A198-A202 VanDerWaalsContact O-CB 3.26Å; A198-A202 WeakPolarHBondContact O-CB 3.34Å; A198-A202 PolarHBondContact O-N 2.94Å
199	A	97.1	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-48.1	175.5	0	0	0	0	0	112	V104 L106 I138 A195 F196 D197 F201 A202 A203	V104-A199 HydrophobicContact CG1-CB 3.99Å; V104-A199 HydrophobicContact CG2-CB 3.92Å; L106-A199 HydrophobicContact CD1-CB 4.21Å; L106-A199 HydrophobicContact CD2-CB 4.03Å; L106-A199 HydrophobicContact CG-CB 3.99Å; I138-A199 HydrophobicContact CG1-CB 3.97Å; A195-A199 PolarHBondContact O-N 2.84Å; F196-A199 WeakPolarHBondContact O-CB 3.17Å; F196-A199 PolarHBondContact O-N 2.67Å; D197-A199 VanDerWaalsContact C-N 3.28Å; D197-A199 PolarHBondContact O-N 3.05Å; A199-F201 PolarHBondContact O-N 2.88Å; A199-A202 PolarHBondContact O-N 3.04Å; A199-A203 PolarHBondContact O-N 3.41Å
200	I	94.1	Very high	91.4	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-47.5	179.2	-67.3	158.3	0	0	0	110.4	I31 V71 V73 I80 F196 D197 A202 A203 I204	I31-I200 HydrophobicContact CD1-CG2 4.22Å; V71-I200 HydrophobicContact CG1-CD1 4.2Å; V71-I200 HydrophobicContact CG2-CD1 4.21Å; V73-I200 HydrophobicContact CG2-CG2 3.96Å; I80-I200 HydrophobicContact CD1-CD1 4.43Å; I80-I200 HydrophobicContact CG2-CD1 4.17Å; I80-I200 HydrophobicContact CG2-CG1 4.11Å; F196-I200 WeakPolarHBondContact O-CD1 3.05Å; F196-I200 VanDerWaalsContact O-CG1 3.27Å; F196-I200 WeakPolarHBondContact O-CG1 3.48Å; F196-I200 PolarHBondContact O-N 2.82Å; D197-I200 PolarHBondContact O-N 3.36Å; I200-A202 VanDerWaalsContact C-N 3.34Å; I200-A202 PolarHBondContact O-N 2.86Å; I200-A203 WeakPolarHBondContact O-CB 3.09Å; I200-A203 PolarHBondContact O-N 3.13Å; I200-I204 HydrophobicContact CG2-CD1 3.94Å; I200-I204 WeakPolarHBondContact O-CG1 3.26Å; I200-I204 PolarHBondContact O-N 3.2Å
201	F	94.4	Very high	89.8	Confident	101 Å²	101	47.8 Å²	47.8	44%	0.443	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-41.5	176.7	-74.4	-59.8	0	0	0	112.3	V73 D197 A199 A203 I204 K205	V73-F201 HydrophobicContact CG1-CD1 4.11Å; V73-F201 HydrophobicContact CG1-CE1 3.45Å; V73-F201 VanDerWaalsContact CG1-CE1 3.45Å; V73-F201 HydrophobicContact CG1-CZ 4.13Å; D197-F201 HydrophobicContact CB-CD2 4.23Å; D197-F201 HydrophobicContact CB-CE2 4.08Å; D197-F201 WeakPolarHBondContact O-CB 3.39Å; D197-F201 WeakPolarHBondContact O-CD2 3.38Å; D197-F201 WeakPolarHBondContact O-CG 3.49Å; D197-F201 PolarHBondContact O-N 2.97Å; A199-F201 PolarHBondContact O-N 2.88Å; F201-A203 VanDerWaalsContact C-N 3.35Å; F201-A203 PolarHBondContact O-N 3.19Å; F201-I204 PolarHBondContact O-N 2.61Å; F201-K205 WeakPolarHBondContact O-CB 3.33Å; F201-K205 PolarHBondContact O-N 3.12Å
202	A	95.9	Very high	87.9	Confident	10 Å²	10	52.7 Å²	52.7	8%	0.083	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-40.7	176.5	0	0	0	0	0	112	V104 P136 I138 T179 A198 A199 I200 K205 S206	V104-A202 HydrophobicContact CG2-CB 4.46Å; P136-A202 HydrophobicContact CB-CB 3.94Å; P136-A202 HydrophobicContact CG-CB 3.94Å; I138-A202 HydrophobicContact CD1-CB 4.13Å; T179-A202 HydrophobicContact CG2-CB 4.1Å; A198-A202 VanDerWaalsContact O-CB 3.26Å; A198-A202 WeakPolarHBondContact O-CB 3.34Å; A198-A202 PolarHBondContact O-N 2.94Å; A199-A202 PolarHBondContact O-N 3.04Å; I200-A202 VanDerWaalsContact C-N 3.34Å; I200-A202 PolarHBondContact O-N 2.86Å; A202-K205 PolarHBondContact O-N 3.3Å; A202-S206 WeakPolarHBondContact O-CB 3.39Å; A202-S206 PolarHBondContact O-N 3.11Å
203	A	94.9	Very high	86.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.5	-49.2	175.7	0	0	0	0	0	112.1	I31 D103 V104 A199 I200 F201 K205 S206 K207	I31-A203 HydrophobicContact CD1-CB 4.43Å; I31-A203 HydrophobicContact CG2-CB 3.49Å; I31-A203 VanDerWaalsContact CG2-CB 3.49Å; D103-A203 HydrophobicContact CB-CB 4.01Å; V104-A203 HydrophobicContact CB-CB 4.04Å; V104-A203 HydrophobicContact CG1-CB 3.94Å; A199-A203 PolarHBondContact O-N 3.41Å; I200-A203 WeakPolarHBondContact O-CB 3.09Å; I200-A203 PolarHBondContact O-N 3.13Å; F201-A203 VanDerWaalsContact C-N 3.35Å; F201-A203 PolarHBondContact O-N 3.19Å; A203-K205 VanDerWaalsContact C-N 3.33Å; A203-K205 PolarHBondContact O-N 3.08Å; A203-S206 WeakPolarHBondContact O-CB 3.26Å; A203-S206 PolarHBondContact O-N 2.63Å; A203-S206 VanDerWaalsContact O-N 3.14Å; A203-K207 PolarHBondContact O-N 3.03Å
204	I	92.3	Very high	84.2	Confident	51 Å²	51	64.3 Å²	64.3	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-57.7	-47.2	177.7	-66.4	169.1	0	0	0	110.5	I31 V73 I200 F201 S206 K207 T208	I31-I204 HydrophobicContact CD1-CD1 3.99Å; I31-I204 HydrophobicContact CD1-CG1 3.37Å; V73-I204 HydrophobicContact CB-CD1 4.4Å; V73-I204 HydrophobicContact CG1-CD1 3.89Å; V73-I204 HydrophobicContact CG2-CD1 4.33Å; I200-I204 HydrophobicContact CG2-CD1 3.94Å; I200-I204 WeakPolarHBondContact O-CG1 3.26Å; I200-I204 PolarHBondContact O-N 3.2Å; F201-I204 PolarHBondContact O-N 2.61Å; I204-S206 VanDerWaalsContact C-N 3.32Å; I204-S206 PolarHBondContact O-N 3.05Å; I204-K207 PolarHBondContact O-N 3.38Å; I204-T208 HydrophobicContact CG2-CG2 4.45Å; I204-T208 WeakPolarHBondContact O-CG2 3.38Å; I204-T208 PolarHBondContact O-N 2.96Å; I204-T208 PolarHBondContact O-OG1 3.26Å; I204-T208 VanDerWaalsContact O-OG1 3.1Å
205	K	91.7	Very high	81.9	Confident	145 Å²	145	69.5 Å²	69.5	63%	0.63	33%	0.328	S	S	*	.	H	α-helix	trans	-61.1	-40.7	177.7	-172.2	178	179.8	-179.8	0	111.9	F201 A202 A203 T208 C209	F201-K205 WeakPolarHBondContact O-CB 3.33Å; F201-K205 PolarHBondContact O-N 3.12Å; A202-K205 PolarHBondContact O-N 3.3Å; A203-K205 VanDerWaalsContact C-N 3.33Å; A203-K205 PolarHBondContact O-N 3.08Å; K205-T208 PolarHBondContact O-OG1 3.16Å; K205-C209 WeakPolarHBondContact O-CB 3.43Å; K205-C209 PolarHBondContact O-N 3.05Å; K205-C209 PolarHBondContact O-SG 3.49Å; K205-C209 VanDerWaalsContact O-SG 3.41Å
206	S	90.3	Very high	79.6	Confident	25 Å²	25	76.4 Å²	76.4	18%	0.175	36%	0.359	C	S	.	.	H	α-helix	trans	-63.8	-47.4	176.7	-176	0	0	0	0	112.1	A202 A203 I204 C209 K210	A202-S206 WeakPolarHBondContact O-CB 3.39Å; A202-S206 PolarHBondContact O-N 3.11Å; A203-S206 WeakPolarHBondContact O-CB 3.26Å; A203-S206 PolarHBondContact O-N 2.63Å; A203-S206 VanDerWaalsContact O-N 3.14Å; I204-S206 VanDerWaalsContact C-N 3.32Å; I204-S206 PolarHBondContact O-N 3.05Å; S206-C209 PolarHBondContact O-N 3.03Å; S206-K210 WeakPolarHBondContact O-CG 3.37Å; S206-K210 PolarHBondContact O-N 3.44Å
207	K	85.8	Confident	77.5	Confident	64 Å²	64	79.8 Å²	79.8	28%	0.278	38%	0.382	S	S	.	.	H	α-helix	trans	-61.5	-46.1	178.6	-74.5	-167.7	178	-177	0	112.2	P28 V30 D103 A203 I204 C209 K210 G211	P28-K207 PolarHBondContact O-NZ 2.96Å; V30-K207 PolarHBondContact O-NZ 3.49Å; D103-K207 WeakPolarHBondContact OD1-CE 3.33Å; D103-K207 IonicContact OD1-NZ 3.16Å; D103-K207 WeakPolarHBondContact OD2-CE 3.41Å; D103-K207 IonicContact OD2-NZ 3.57Å; D103-K207 PolarHBondContact OD2-NZ 3.45Å; A203-K207 PolarHBondContact O-N 3.03Å; I204-K207 PolarHBondContact O-N 3.38Å; K207-C209 VanDerWaalsContact C-N 3.33Å; K207-C209 PolarHBondContact O-N 3.5Å; K207-K210 PolarHBondContact O-N 2.88Å; K207-G211 PolarHBondContact O-N 3.43Å; K207-G211 VanDerWaalsContact O-N 3.07Å
208	T	82.3	Confident	75.5	Confident	76 Å²	76	82.9 Å²	82.9	47%	0.466	40%	0.399	S	S	.	.	H	α-helix	trans	-63.2	-36.8	179	55.8	0	0	0	0	112.7	I204 K205 K212	I204-T208 HydrophobicContact CG2-CG2 4.45Å; I204-T208 WeakPolarHBondContact O-CG2 3.38Å; I204-T208 PolarHBondContact O-N 2.96Å; I204-T208 PolarHBondContact O-OG1 3.26Å; I204-T208 VanDerWaalsContact O-OG1 3.1Å; K205-T208 PolarHBondContact O-OG1 3.16Å; T208-K212 PolarHBondContact O-N 3.44Å
209	C	75.1	Confident	73.1	Confident	68 Å²	68	91.9 Å²	91.9	46%	0.459	43%	0.429	S	S	.	.	H	α-helix	trans	-68.8	-39.6	174.7	-76.9	0	0	0	0	113.3	K205 S206 K207 K212 K213	K205-C209 WeakPolarHBondContact O-CB 3.43Å; K205-C209 PolarHBondContact O-N 3.05Å; K205-C209 PolarHBondContact O-SG 3.49Å; K205-C209 VanDerWaalsContact O-SG 3.41Å; S206-C209 PolarHBondContact O-N 3.03Å; K207-C209 VanDerWaalsContact C-N 3.33Å; K207-C209 PolarHBondContact O-N 3.5Å; C209-K212 PolarHBondContact O-N 3.33Å; C209-K213 PolarHBondContact O-N 2.94Å
210	K	67.9	Low	70.7	Confident	93 Å²	93	101.9 Å²	101.9	40%	0.404	47%	0.466	S	S	.	.	H	α-helix	trans	-64.1	-39.9	175.9	-73	177.9	179.7	180	0	111.7	S134 S206 K207 K212 K213 R214	S134-K210 PolarHBondContact OG-NZ 3.05Å; S206-K210 WeakPolarHBondContact O-CG 3.37Å; S206-K210 PolarHBondContact O-N 3.44Å; K207-K210 PolarHBondContact O-N 2.88Å; K210-K212 PolarHBondContact O-N 3.38Å; K210-K213 PolarHBondContact O-N 3.28Å; K210-R214 PolarHBondContact O-N 3.32Å; K210-R214 VanDerWaalsContact O-N 3.16Å
211	G	61.3	Low	68.5	Low	36 Å²	36	106.8 Å²	106.8	37%	0.371	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-39.5	176.1	0	0	0	0	0	114	K207 R215	K207-G211 PolarHBondContact O-N 3.43Å; K207-G211 VanDerWaalsContact O-N 3.07Å; G211-R215 PolarHBondContact O-N 3.44Å; G211-R215 VanDerWaalsContact O-N 3.15Å
212	K	57.6	Low	66.1	Low	159 Å²	159	110.5 Å²	110.5	69%	0.691	51%	0.513	S	S	*	.	H	α-helix	trans	-66.8	-39.7	176.5	-72.9	178.8	-179.5	175.1	0	112.7	T208 C209 K210 R215 F216	T208-K212 PolarHBondContact O-N 3.44Å; C209-K212 PolarHBondContact O-N 3.33Å; K210-K212 PolarHBondContact O-N 3.38Å; K212-R215 PolarHBondContact O-N 2.95Å; K212-F216 PolarHBondContact O-N 2.94Å; K212-F216 VanDerWaalsContact O-N 3.1Å
213	K	56.1	Low	63.6	Low	166 Å²	166	115.2 Å²	115.2	72%	0.722	54%	0.54	S	S	*	.	H	α-helix	trans	-64.8	-42.1	176.6	-75	-174.7	178.6	179.8	0	112.2	C209 K210 F216 S217	C209-K213 PolarHBondContact O-N 2.94Å; K210-K213 PolarHBondContact O-N 3.28Å; K213-F216 PolarHBondContact O-N 3.25Å; K213-S217 PolarHBondContact O-N 2.9Å; K213-S217 PolarHBondContact O-OG 3.28Å
214	R	53.1	Low	60.6	Low	197 Å²	197	124.9 Å²	124.9	74%	0.743	58%	0.583	S	S	*	*	H	α-helix	trans	-61	-43	174.5	-73.8	-179.7	65.4	141.6	-1.7	112.3	K210 F216 S217 D218	K210-R214 PolarHBondContact O-N 3.32Å; K210-R214 VanDerWaalsContact O-N 3.16Å; R214-F216 VanDerWaalsContact C-N 3.32Å; R214-F216 PolarHBondContact O-N 2.92Å; R214-S217 PolarHBondContact O-N 2.83Å; R214-S217 PolarHBondContact O-OG 3.01Å; R214-D218 VanDerWaalsContact O-CB 3.29Å; R214-D218 WeakPolarHBondContact O-CB 3.31Å; R214-D218 PolarHBondContact O-N 2.76Å
215	R	47.3	Very low	57.8	Low	207 Å²	207	127 Å²	127	78%	0.781	60%	0.602	S	S	*	*	H	α-helix	trans	-65.4	-31.5	176.3	-80	-177.8	162.7	168.9	-2.5	113.4	G211 K212 R219	G211-R215 PolarHBondContact O-N 3.44Å; G211-R215 VanDerWaalsContact O-N 3.15Å; K212-R215 PolarHBondContact O-N 2.95Å; R215-R219 PolarHBondContact O-N 3.16Å
216	F	48.7	Very low	55.3	Low	146 Å²	146	132.3 Å²	132.3	64%	0.64	62%	0.618	S	S	*	*	H	α-helix	trans	-78.4	-37.7	177.6	-159.6	-95.2	0	0	0	112.6	K212 K213 R214 R219 R220	K212-F216 PolarHBondContact O-N 2.94Å; K212-F216 VanDerWaalsContact O-N 3.1Å; K213-F216 PolarHBondContact O-N 3.25Å; R214-F216 VanDerWaalsContact C-N 3.32Å; R214-F216 PolarHBondContact O-N 2.92Å; F216-R219 PolarHBondContact O-N 3.11Å; F216-R220 PolarHBondContact O-N 3.4Å
217	S	51.3	Low	52.3	Low	71 Å²	71	136.7 Å²	136.7	50%	0.497	65%	0.648	S	S	.	*	H	α-helix	trans	-67	-39.6	174	62.8	0	0	0	0	112	K213 R214 R219 R220 T221	K213-S217 PolarHBondContact O-N 2.9Å; K213-S217 PolarHBondContact O-OG 3.28Å; R214-S217 PolarHBondContact O-N 2.83Å; R214-S217 PolarHBondContact O-OG 3.01Å; S217-R219 VanDerWaalsContact C-N 3.3Å; S217-R219 PolarHBondContact O-N 2.94Å; S217-R220 WeakPolarHBondContact O-CB 3.09Å; S217-R220 PolarHBondContact O-N 3.21Å; S217-R220 VanDerWaalsContact O-N 3.07Å; S217-T221 PolarHBondContact O-N 3.21Å; S217-T221 PolarHBondContact O-OG1 3.22Å
218	D	51.5	Low	49.9	Very low	103 Å²	103	138.5 Å²	138.5	55%	0.551	67%	0.668	S	S	*	*	H	α-helix	trans	-71.1	-25.1	-179.8	-157.5	15.3	0	0	0	112.7	R214 R220 T221	R214-D218 VanDerWaalsContact O-CB 3.29Å; R214-D218 WeakPolarHBondContact O-CB 3.31Å; R214-D218 PolarHBondContact O-N 2.76Å; D218-R220 VanDerWaalsContact C-N 3.35Å; D218-T221 PolarHBondContact O-N 3.01Å; D218-T221 PolarHBondContact O-OG1 2.8Å
219	R	46.7	Very low	47.3	Very low	209 Å²	209	146 Å²	146	79%	0.789	69%	0.688	S	S	*	*	H	α-helix	trans	-70.5	-27.6	168.8	-102.4	-175.9	176	-174.8	-1.6	113.3	R215 F216 S217 T221	R215-R219 PolarHBondContact O-N 3.16Å; F216-R219 PolarHBondContact O-N 3.11Å; S217-R219 VanDerWaalsContact C-N 3.3Å; S217-R219 PolarHBondContact O-N 2.94Å; R219-T221 VanDerWaalsContact C-N 3.32Å
220	R	46.2	Very low	45.1	Very low	209 Å²	209	152.1 Å²	152.1	79%	0.789	71%	0.707	S	S	*	*	H	α-helix	trans	-77	-17.1	176.7	-112.4	-179.3	-179.3	177.6	-0	113.1	F216 S217 D218	F216-R220 PolarHBondContact O-N 3.4Å; S217-R220 WeakPolarHBondContact O-CB 3.09Å; S217-R220 PolarHBondContact O-N 3.21Å; S217-R220 VanDerWaalsContact O-N 3.07Å; D218-R220 VanDerWaalsContact C-N 3.35Å
221	T	49.2	Very low	43.6	Very low	107 Å²	107	157 Å²	157	66%	0.656	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	3.7	177.7	30.4	0	0	0	0	115.2	S217 D218 R219	S217-T221 PolarHBondContact O-N 3.21Å; S217-T221 PolarHBondContact O-OG1 3.22Å; D218-T221 PolarHBondContact O-N 3.01Å; D218-T221 PolarHBondContact O-OG1 2.8Å; R219-T221 VanDerWaalsContact C-N 3.32Å
222	K	42.8	Very low	42.1	Very low	179 Å²	179	164.2 Å²	164.2	78%	0.778	75%	0.749	S	S	*	*	S	Bend	trans	-111	10.2	173.4	-83.1	-176.3	177.7	170.9	0	116
223	T	43.9	Very low	40.7	Very low	108 Å²	108	165.7 Å²	165.7	66%	0.663	76%	0.756	S	S	*	*			trans	-142.4	75	170.3	38.8	0	0	0	0	111.4
224	F	32.4	Very low	39.5	Very low	204 Å²	204	162.6 Å²	162.6	90%	0.895	75%	0.754	S	S	*	*			trans	-149	75.1	144.7	-123.9	-88.3	0	0	0	109.3
225	S	32.1	Very low	38.3	Very low	94 Å²	94	162 Å²	162	66%	0.657	76%	0.757	S	S	*	*				42.6	108.6	128.7	-35.8	0	0	0	0	117.9	C227	S225-C227 PolarHBondContact O-N 2.73Å; S225-C227 VanDerWaalsContact O-N 3.08Å
226	R	39.8	Very low	38.1	Very low	257 Å²	257	163.3 Å²	163.3	97%	0.97	78%	0.777	S	S	*	*			trans	-56.5	106.6	139.5	-77.8	170.3	76.7	159.9	2.2	107.5
227	C	28.1	Very low	37.5	Very low	118 Å²	118	164.2 Å²	164.2	80%	0.797	78%	0.784	S	S	*	*			trans	-162.5	108.1	145.1	-124.4	0	0	0	0	109.8	S225	S225-C227 PolarHBondContact O-N 2.73Å; S225-C227 VanDerWaalsContact O-N 3.08Å
228	S	35.4	Very low	36.8	Very low	101 Å²	101	169.1 Å²	169.1	71%	0.706	80%	0.799	S	S	*	*			trans	-51.3	140	151.6	-176.9	0	0	0	0	108.5
229	W	27.5	Very low	36	Very low	233 Å²	233	172.7 Å²	172.7	88%	0.883	81%	0.813	S	S	*	*			trans	-178.8	112.5	130.1	-90.7	26.4	0	0	0	110.8
230	K	29.3	Very low	35.4	Very low	197 Å²	197	170.6 Å²	170.6	86%	0.857	82%	0.815	S	S	*	*			trans	42.8	130.4	140.2	-64.8	179.9	176.8	179.3	0	122.2
231	K	36.6	Very low	34.7	Very low	197 Å²	197	168.2 Å²	168.2	86%	0.857	82%	0.816	S	S	*	*			trans	-48.2	154.8	159.5	-62.2	173.8	172.7	177.3	0	114
232	F	29.8	Very low	33.7	Very low	186 Å²	186	172.3 Å²	172.3	82%	0.816	83%	0.827	S	S	*	*			trans	175.2	110.5	132	-96.8	-79.6	0	0	0	107.5
233	F	27.4	Very low	33.1	Very low	191 Å²	191	171.8 Å²	171.8	84%	0.838	83%	0.83	S	S	*	*				103.6	158.8	91.5	-107	-94	0	0	0	114.4
234	C	31.3	Very low	32.2	Very low	100 Å²	100	176.7 Å²	176.7	68%	0.676	84%	0.843	S	S	*	*			trans	-96.8	-178.8	-155.2	-156.5	0	0	0	0	115.2
235	F	28.3	Very low	32.2	Very low	185 Å²	185	174.4 Å²	174.4	81%	0.811	84%	0.839	S	S	*	*			trans	87.9	135.9	169.6	-62	-81.9	0	0	0	116.7
236	I	41.3	Very low	32.2	Very low	234 Å²	234	181.7 Å²	181.7	100%	1.2	86%	0.855	S	S	*	*			cis	-126.9	0	26.6	-70.4	166.7	0	0	0	111.4

Retrieved 236 of 236 residues in 391.6 ms (Link to these results)

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