A0A087Y1W8_POEFO Loading...

Methylenetetrahydrofolate dehydrogenase (NADP+ dependent) 2 like

AlphaFold DB , UniProt , Accession A0A087Y1W8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 324 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	L	43.9	Very low	35.7	Very low	214 Å²	214	177.2 Å²	177.2	100%	1.12	84%	0.843	S	S	*	*				0	107.2	0	-99.6	86.9	0	0	0	108.4
2	Y	33.6	Very low	35.8	Very low	234 Å²	234	178.8 Å²	178.8	92%	0.918	85%	0.849	S	S	*	*			trans	-168.6	102.5	138.1	-106.9	-77.3	0	0	0	105.2
3	Y	33.5	Very low	35.6	Very low	209 Å²	209	173.5 Å²	173.5	82%	0.82	84%	0.843	S	S	*	*			trans	-78.2	129.7	175.8	-95	-97.8	0	0	0	108.6	T5	Y3-T5 HydrophobicContact CD1-CG2 4.29Å
4	I	39.1	Very low	35.3	Very low	164 Å²	164	173.1 Å²	173.1	84%	0.841	84%	0.839	S	S	*	*			trans	-130.4	99.4	153.3	-60.2	-178.5	0	0	0	106.7
5	T	39.1	Very low	35.3	Very low	103 Å²	103	176.8 Å²	176.8	63%	0.632	84%	0.841	S	S	*	*			trans	-72.3	146.5	164.2	42.4	0	0	0	0	109.2	Y3	Y3-T5 HydrophobicContact CD1-CG2 4.29Å
6	H	35.4	Very low	35.1	Very low	181 Å²	181	178.9 Å²	178.9	84%	0.838	84%	0.838	S	S	*	*			trans	-168.1	157.7	148.7	-106.7	62	0	0	0	109.2
7	P	37.7	Very low	35.1	Very low	107 Å²	107	177.9 Å²	177.9	70%	0.695	83%	0.833	S	S	*	*				-103.1	158.8	-120.6	1.2	20.4	0	0	0	115.6	L9	P7-L9 PolarHBondContact O-N 3.49Å
8	L	34.4	Very low	35.1	Very low	176 Å²	176	176.3 Å²	176.3	92%	0.921	83%	0.829	S	S	*	*			trans	-57.6	111.4	167.7	-76.5	153.7	0	0	0	111.6
9	L	31.6	Very low	35	Very low	155 Å²	155	179.1 Å²	179.1	81%	0.812	83%	0.833	S	S	*	*			trans	-95.7	106.8	161.3	-88.5	157.4	0	0	0	109	P7 Y11	P7-L9 PolarHBondContact O-N 3.49Å; L9-Y11 PolarHBondContact O-N 3.44Å
10	K	34.9	Very low	35.1	Very low	196 Å²	196	179.3 Å²	179.3	85%	0.852	83%	0.834	S	S	*	*			trans	-67.8	119.2	163.7	-77.5	-179.4	174.1	-179.6	0	108.3
11	Y	29.4	Very low	35.3	Very low	210 Å²	210	175.7 Å²	175.7	82%	0.824	83%	0.829	S	S	*	*			trans	-116.3	104.2	158.5	-106	-90.8	0	0	0	108.1	L9 S13	L9-Y11 PolarHBondContact O-N 3.44Å; Y11-S13 PolarHBondContact O-N 3.26Å
12	E	36.7	Very low	35.3	Very low	196 Å²	196	169.9 Å²	169.9	92%	0.916	81%	0.812	S	S	*	*			trans	-69.5	121.3	160.3	-77.5	-178.8	157.5	0	0	108.1
13	S	33.3	Very low	36.1	Very low	111 Å²	111	168.7 Å²	168.7	78%	0.776	81%	0.805	S	S	*	*			trans	-131.3	108.6	171.1	165.6	0	0	0	0	108.8	Y11	Y11-S13 PolarHBondContact O-N 3.26Å
14	Q	31.3	Very low	37.1	Very low	167 Å²	167	169.8 Å²	169.8	78%	0.78	81%	0.808	S	S	*	*			trans	-17	120.1	169.8	-68.5	171.8	-12.2	0	0	115.9	R16	Q14-R16 PolarHBondContact O-N 3.03Å
15	R	35.2	Very low	38.4	Very low	229 Å²	229	168.2 Å²	168.2	86%	0.864	80%	0.797	S	S	*	*			trans	-62.6	101.1	162.8	-77.2	-177.1	175.2	-171.8	-0.3	109.6
16	R	33	Very low	40.7	Very low	210 Å²	210	166 Å²	166	79%	0.792	79%	0.785	S	S	*	*			trans	-87.2	107.9	155.4	-76	-175.9	175.9	-176.6	-1.2	107.8	Q14 L18	Q14-R16 PolarHBondContact O-N 3.03Å; R16-L18 PolarHBondContact O-N 2.86Å
17	H	35.2	Very low	43.5	Very low	163 Å²	163	157.8 Å²	157.8	76%	0.755	75%	0.749	S	S	*	*			trans	-63.8	88.7	164	-84.6	-72.8	0	0	0	108.6	Y19	H17-Y19 PolarHBondContact O-N 2.86Å
18	L	34	Very low	46.4	Very low	148 Å²	148	156.7 Å²	156.7	78%	0.775	74%	0.74	S	S	*	*			trans	-72.9	110.2	163.7	-82.4	156.9	0	0	0	106.8	R16 H20	R16-L18 PolarHBondContact O-N 2.86Å; L18-H20 PolarHBondContact O-N 3.3Å
19	Y	33.4	Very low	49.5	Very low	229 Å²	229	151.2 Å²	151.2	90%	0.898	71%	0.714	S	S	*	*			trans	-50.2	102.5	164.2	-80.9	-95.6	0	0	0	108.4	H17 S21	H17-Y19 PolarHBondContact O-N 2.86Å; Y19-S21 PolarHBondContact O-N 2.89Å
20	H	37.2	Very low	52.6	Low	184 Å²	184	144.4 Å²	144.4	85%	0.852	68%	0.678	S	S	*	*			trans	-70.9	88.6	168.2	-123.2	39	0	0	0	106.3	L18 A22	L18-H20 PolarHBondContact O-N 3.3Å; H20-A22 PolarHBondContact O-N 2.71Å
21	S	39.1	Very low	55.7	Low	104 Å²	104	137.2 Å²	137.2	73%	0.727	65%	0.653	S	S	*	*			trans	-51.6	113.2	158	170.9	0	0	0	0	106.1	Y19 R23	Y19-S21 PolarHBondContact O-N 2.89Å; S21-R23 PolarHBondContact O-N 3.01Å
22	A	44.3	Very low	58.9	Low	92 Å²	92	127.2 Å²	127.2	76%	0.76	61%	0.613	S	S	*	*			trans	-64	82.2	178.8	0	0	0	0	0	108.5	H20 R24	H20-A22 PolarHBondContact O-N 2.71Å; A22-R24 PolarHBondContact O-N 2.92Å
23	R	50.7	Low	61.8	Low	208 Å²	208	120 Å²	120	79%	0.785	58%	0.583	S	S	*	*			trans	-53.9	111.1	162.9	-106.4	-177.7	166.1	-178	-4	105.3	S21 H25	S21-R23 PolarHBondContact O-N 3.01Å; R23-H25 VanDerWaalsContact C-N 3.35Å; R23-H25 PolarHBondContact O-N 3.3Å; R23-H25 PolarHBondContact O-ND1 2.67Å
24	R	53.8	Low	64.9	Low	233 Å²	233	119.9 Å²	119.9	88%	0.879	57%	0.57	S	S	*	*			trans	-50.2	104	165.4	-75.3	179.2	174.3	163.7	-3.3	106.4	A22 S26	A22-R24 PolarHBondContact O-N 2.92Å; R24-S26 VanDerWaalsContact C-N 3.27Å; R24-S26 PolarHBondContact O-N 2.9Å; R24-S26 VanDerWaalsContact O-N 3.08Å
25	H	66.9	Low	68.1	Low	131 Å²	131	112.9 Å²	112.9	61%	0.606	54%	0.538	S	S	*	.			trans	-83.9	80.3	-179.8	-87.8	70.5	0	0	0	107.3	R23	R23-H25 VanDerWaalsContact C-N 3.35Å; R23-H25 PolarHBondContact O-N 3.3Å; R23-H25 PolarHBondContact O-ND1 2.67Å
26	S	86.4	Confident	71.1	Confident	55 Å²	55	102.2 Å²	102.2	39%	0.385	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-73	141.3	165	-160.3	0	0	0	0	108.1	R24 K289 E290	R24-S26 VanDerWaalsContact C-N 3.27Å; R24-S26 PolarHBondContact O-N 2.9Å; R24-S26 VanDerWaalsContact O-N 3.08Å; S26-K289 WeakPolarHBondContact OG-CE 3.44Å; S26-K289 WeakPolarHBondContact OG-CG 3.39Å; S26-E290 PolarHBondContact OG-OE1 3.13Å
27	A	96	Very high	74.2	Confident	9 Å²	9	99.2 Å²	99.2	7%	0.074	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-59.9	147.3	-175.9	0	0	0	0	0	112	V29 K289 A292 I295	A27-V29 PolarHBondContact O-N 2.84Å; A27-K289 HydrophobicContact CB-CG 4.22Å; A27-K289 VanDerWaalsContact CB-O 3.29Å; A27-K289 WeakPolarHBondContact CB-O 3.23Å; A27-K289 PolarHBondContact N-O 3.25Å; A27-A292 VanDerWaalsContact CA-O 3.32Å; A27-A292 WeakPolarHBondContact CA-O 3.46Å; A27-A292 HydrophobicContact CB-CB 3.96Å; A27-A292 WeakPolarHBondContact CB-O 3.39Å; A27-I295 HydrophobicContact CB-CB 4.16Å; A27-I295 HydrophobicContact CB-CG2 3.7Å
28	V	98	Very high	77.2	Confident	85 Å²	85	94.2 Å²	94.2	52%	0.515	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	117.5	166.9	179.1	0	0	0	0	108.4	I30 G293 F294 I295	V28-I30 PolarHBondContact O-N 2.86Å; V28-G293 PolarHBondContact N-O 3.14Å; V28-F294 HydrophobicContact CB-CD1 3.75Å; V28-F294 HydrophobicContact CB-CE1 4.02Å; V28-F294 HydrophobicContact CG1-CD1 4.09Å; V28-F294 HydrophobicContact CG1-CE1 4.19Å; V28-F294 HydrophobicContact CG2-CD1 4.49Å; V28-F294 HydrophobicContact CG2-CE1 4.35Å; V28-F294 WeakPolarHBondContact O-CA 3.27Å; V28-I295 PolarHBondContact O-N 3.48Å
29	V	98.3	Very high	80.3	Confident	61 Å²	61	87.2 Å²	87.2	37%	0.37	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	112.9	177.5	-176.8	0	0	0	0	109.2	A27 S31 F285 I295 P297	A27-V29 PolarHBondContact O-N 2.84Å; V29-S31 PolarHBondContact O-N 2.96Å; V29-F285 HydrophobicContact CG1-CZ 4.3Å; V29-F285 HydrophobicContact CG2-CZ 4.07Å; V29-I295 CarbonylContact C-O 3.52Å; V29-I295 VanDerWaalsContact CA-O 3.31Å; V29-I295 WeakPolarHBondContact CA-O 3.32Å; V29-I295 HydrophobicContact CG2-CG2 4.09Å; V29-P297 HydrophobicContact CG1-CB 4.35Å; V29-P297 HydrophobicContact CG1-CG 3.95Å
30	I	98.3	Very high	83.4	Confident	12 Å²	12	78.5 Å²	78.5	6%	0.062	40%	0.395	C	S	.	.			trans	-80.6	105.5	178.5	-56.6	171.2	0	0	0	108.7	V28 G32 L35 M173 A177 I179 I262 F294 I295 T296 P297	V28-I30 PolarHBondContact O-N 2.86Å; I30-G32 PolarHBondContact O-N 3.08Å; I30-G32 VanDerWaalsContact O-N 3.13Å; I30-L35 HydrophobicContact CG2-CD1 3.78Å; I30-M173 HydrophobicContact CB-CE 4.31Å; I30-M173 HydrophobicContact CG2-CE 3.58Å; I30-A177 HydrophobicContact CD1-CB 3.75Å; I30-A177 HydrophobicContact CG1-CB 4.27Å; I30-I179 HydrophobicContact CD1-CD1 3.85Å; I30-I262 HydrophobicContact CD1-CD1 4.14Å; I30-F294 HydrophobicContact CD1-CB 3.89Å; I30-F294 HydrophobicContact CD1-CD1 4.05Å; I30-F294 HydrophobicContact CD1-CG 4.33Å; I30-F294 HydrophobicContact CG1-CB 4.36Å; I30-F294 HydrophobicContact CG1-CD1 4.1Å; I30-I295 PolarHBondContact N-O 2.87Å; I30-T296 HydrophobicContact CB-CG2 4.06Å; I30-P297 VanDerWaalsContact O-CD 3.23Å; I30-P297 WeakPolarHBondContact O-CD 3.36Å
31	S	98.4	Very high	86.3	Confident	44 Å²	44	76.9 Å²	76.9	31%	0.308	38%	0.381	S	S	.	.			trans	-76.6	95.5	176.5	-179.6	0	0	0	0	110.8	V29 T33 E34 L35	V29-S31 PolarHBondContact O-N 2.96Å; S31-T33 PolarHBondContact O-N 3.03Å; S31-E34 PolarHBondContact O-N 3.09Å; S31-E34 VanDerWaalsContact O-N 3.1Å; S31-E34 WeakPolarHBondContact OG-CB 3.25Å; S31-E34 PolarHBondContact OG-N 3.44Å; S31-L35 PolarHBondContact O-N 3.3Å; S31-L35 VanDerWaalsContact O-N 3.09Å
32	G	98.2	Very high	89.1	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-24.5	173.3	0	0	0	0	0	112.8	I30 A36 G300 G301 M305	I30-G32 PolarHBondContact O-N 3.08Å; I30-G32 VanDerWaalsContact O-N 3.13Å; G32-A36 WeakPolarHBondContact O-CB 3.41Å; G32-A36 PolarHBondContact O-N 3.47Å; G32-G300 CarbonylContact C-O 3.09Å; G32-G300 WeakPolarHBondContact CA-O 3.45Å; G32-G300 PolarHBondContact N-O 2.76Å; G32-G301 WeakPolarHBondContact CA-O 3.28Å; G32-M305 WeakPolarHBondContact O-CG 3.25Å
33	T	97.9	Very high	91.7	Very high	45 Å²	45	70.9 Å²	70.9	28%	0.276	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-41.4	170.6	-57.6	0	0	0	0	111.9	S31 R37 G300	S31-T33 PolarHBondContact O-N 3.03Å; T33-R37 WeakPolarHBondContact O-CG 3.49Å; T33-R37 PolarHBondContact O-N 2.81Å; T33-G300 PolarHBondContact N-O 3.07Å; T33-G300 PolarHBondContact OG1-O 3.3Å
34	E	98.2	Very high	93.9	Very high	108 Å²	108	64 Å²	64	51%	0.505	30%	0.303	S	S	.	.	H	α-helix	trans	-71.2	-45	177.9	-175.2	176.8	176.4	0	0	111.7	S31 A36 R37 Q38	S31-E34 PolarHBondContact O-N 3.09Å; S31-E34 VanDerWaalsContact O-N 3.1Å; S31-E34 WeakPolarHBondContact OG-CB 3.25Å; S31-E34 PolarHBondContact OG-N 3.44Å; E34-A36 VanDerWaalsContact C-N 3.31Å; E34-A36 PolarHBondContact O-N 2.75Å; E34-R37 WeakPolarHBondContact O-CB 3.46Å; E34-R37 PolarHBondContact O-N 2.96Å; E34-R37 VanDerWaalsContact O-N 3.14Å; E34-Q38 PolarHBondContact O-N 3.28Å
35	L	98.3	Very high	96.1	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-40.6	175.7	-65.1	-179.9	0	0	0	111.6	I30 S31 R37 Q38 I39 M173 R176 M305	I30-L35 HydrophobicContact CG2-CD1 3.78Å; S31-L35 PolarHBondContact O-N 3.3Å; S31-L35 VanDerWaalsContact O-N 3.09Å; L35-R37 VanDerWaalsContact C-N 3.3Å; L35-R37 PolarHBondContact O-N 3.18Å; L35-Q38 WeakPolarHBondContact O-CB 3.33Å; L35-Q38 PolarHBondContact O-N 2.96Å; L35-I39 PolarHBondContact O-N 3.11Å; L35-M173 HydrophobicContact CD1-CB 4.35Å; L35-M173 HydrophobicContact CD1-CG 4.01Å; L35-R176 HydrophobicContact CD1-CB 4.35Å; L35-R176 HydrophobicContact CD2-CB 3.93Å; L35-M305 HydrophobicContact CB-CE 4.2Å; L35-M305 HydrophobicContact CB-SD 3.43Å; L35-M305 WeakPolarHBondContact CB-SD 3.29Å
36	A	98.1	Very high	97.5	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-60.7	-38.6	175.6	0	0	0	0	0	111.7	G32 E34 Q38 I39 H40 P304 M305 A308	G32-A36 WeakPolarHBondContact O-CB 3.41Å; G32-A36 PolarHBondContact O-N 3.47Å; E34-A36 VanDerWaalsContact C-N 3.31Å; E34-A36 PolarHBondContact O-N 2.75Å; A36-Q38 VanDerWaalsContact C-N 3.3Å; A36-Q38 PolarHBondContact O-N 2.95Å; A36-I39 PolarHBondContact O-N 3.03Å; A36-H40 WeakPolarHBondContact O-CB 3.33Å; A36-H40 PolarHBondContact O-CD2 3.22Å; A36-H40 PolarHBondContact O-N 3.45Å; A36-P304 HydrophobicContact CB-CB 4.06Å; A36-M305 HydrophobicContact CB-SD 4.08Å; A36-M305 PolarHBondContact N-SD 3.04Å; A36-A308 HydrophobicContact CB-CB 4.11Å
37	R	98.1	Very high	98.1	Very high	148 Å²	148	53.3 Å²	53.3	56%	0.558	25%	0.251	S	S	*	.	H	α-helix	trans	-63.9	-33.9	174.4	-70	175.1	-168.9	138.5	0.3	112.8	T33 E34 L35 R41	T33-R37 WeakPolarHBondContact O-CG 3.49Å; T33-R37 PolarHBondContact O-N 2.81Å; E34-R37 WeakPolarHBondContact O-CB 3.46Å; E34-R37 PolarHBondContact O-N 2.96Å; E34-R37 VanDerWaalsContact O-N 3.14Å; L35-R37 VanDerWaalsContact C-N 3.3Å; L35-R37 PolarHBondContact O-N 3.18Å; R37-R41 PolarHBondContact O-N 2.67Å
38	Q	98.2	Very high	98.2	Very high	58 Å²	58	59 Å²	59	27%	0.271	28%	0.276	S	S	.	.	H	α-helix	trans	-66.3	-48.7	174.8	-61.8	172.4	3.3	0	0	110.3	E34 L35 A36 H40 R41 E42	E34-Q38 PolarHBondContact O-N 3.28Å; L35-Q38 WeakPolarHBondContact O-CB 3.33Å; L35-Q38 PolarHBondContact O-N 2.96Å; A36-Q38 VanDerWaalsContact C-N 3.3Å; A36-Q38 PolarHBondContact O-N 2.95Å; Q38-H40 VanDerWaalsContact C-N 3.31Å; Q38-H40 PolarHBondContact O-N 3.33Å; Q38-R41 WeakPolarHBondContact O-CB 3.48Å; Q38-R41 PolarHBondContact O-N 3.37Å; Q38-R41 VanDerWaalsContact O-N 3.13Å; Q38-E42 PolarHBondContact O-N 2.75Å; Q38-E42 VanDerWaalsContact O-N 3.16Å
39	I	98.2	Very high	98.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-39.6	177.7	-66.5	168.6	0	0	0	111.2	L35 A36 R41 E42 I43 E172 M305 A308 M309	L35-I39 PolarHBondContact O-N 3.11Å; A36-I39 PolarHBondContact O-N 3.03Å; I39-R41 VanDerWaalsContact C-N 3.29Å; I39-R41 PolarHBondContact O-N 2.94Å; I39-E42 WeakPolarHBondContact O-CB 3.33Å; I39-E42 PolarHBondContact O-N 2.84Å; I39-E42 VanDerWaalsContact O-N 3.13Å; I39-I43 HydrophobicContact CG2-CD1 3.64Å; I39-I43 HydrophobicContact CG2-CG1 4.14Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.28Å; I39-I43 PolarHBondContact O-N 2.96Å; I39-E172 HydrophobicContact CD1-CG 3.84Å; I39-M305 HydrophobicContact CD1-CE 3.29Å; I39-M305 HydrophobicContact CD1-SD 3.79Å; I39-A308 HydrophobicContact CB-CB 4.22Å; I39-A308 HydrophobicContact CG2-CB 3.89Å; I39-M309 HydrophobicContact CD1-SD 4.03Å
40	H	98.3	Very high	98.1	Very high	46 Å²	46	56.9 Å²	56.9	21%	0.213	26%	0.256	C	S	.	.	H	α-helix	trans	-57.1	-41.4	175.1	-75.7	-175.4	0	0	0	112.5	A36 Q38 I43 Q44 L85	A36-H40 WeakPolarHBondContact O-CB 3.33Å; A36-H40 PolarHBondContact O-CD2 3.22Å; A36-H40 PolarHBondContact O-N 3.45Å; Q38-H40 VanDerWaalsContact C-N 3.31Å; Q38-H40 PolarHBondContact O-N 3.33Å; H40-I43 PolarHBondContact O-N 2.89Å; H40-Q44 WeakPolarHBondContact O-CB 3.35Å; H40-Q44 WeakPolarHBondContact O-CG 3.41Å; H40-Q44 PolarHBondContact O-N 3.27Å; H40-L85 HydrophobicContact CB-CD2 3.5Å; H40-L85 VanDerWaalsContact CB-CD2 3.5Å; H40-L85 WeakPolarHBondContact O-CD2 3.45Å
41	R	98.3	Very high	98	Very high	150 Å²	150	58.6 Å²	58.6	57%	0.566	27%	0.267	S	S	*	.	H	α-helix	trans	-66.4	-39.7	175.4	-70.7	-174	-67.8	-102.1	5.3	112.2	R37 Q38 I39 Q44 R45	R37-R41 PolarHBondContact O-N 2.67Å; Q38-R41 WeakPolarHBondContact O-CB 3.48Å; Q38-R41 PolarHBondContact O-N 3.37Å; Q38-R41 VanDerWaalsContact O-N 3.13Å; I39-R41 VanDerWaalsContact C-N 3.29Å; I39-R41 PolarHBondContact O-N 2.94Å; R41-Q44 PolarHBondContact O-N 2.84Å; R41-R45 PolarHBondContact O-N 3.38Å; R41-R45 VanDerWaalsContact O-N 3.1Å
42	E	98.4	Very high	97.9	Very high	70 Å²	70	60.6 Å²	60.6	33%	0.327	29%	0.287	S	S	.	.	H	α-helix	trans	-61	-46	174.6	-65.2	162.3	-152.3	0	0	110.6	Q38 I39 R45 D46 R176	Q38-E42 PolarHBondContact O-N 2.75Å; Q38-E42 VanDerWaalsContact O-N 3.16Å; I39-E42 WeakPolarHBondContact O-CB 3.33Å; I39-E42 PolarHBondContact O-N 2.84Å; I39-E42 VanDerWaalsContact O-N 3.13Å; E42-R45 PolarHBondContact O-N 3.1Å; E42-D46 WeakPolarHBondContact O-CB 3.23Å; E42-D46 VanDerWaalsContact O-CG 3.31Å; E42-D46 PolarHBondContact O-N 3.24Å; E42-R176 VanDerWaalsContact CD-NH2 3.33Å; E42-R176 IonicContact OE1-CZ 2.9Å; E42-R176 IonicContact OE1-NH1 3.52Å; E42-R176 PolarHBondContact OE1-NH1 3.37Å; E42-R176 IonicContact OE1-NH2 3.91Å; E42-R176 PolarHBondContact OE1-NH2 3.36Å; E42-R176 IonicContact OE2-CZ 2.72Å; E42-R176 IonicContact OE2-NH2 3.83Å; E42-R176 PolarHBondContact OE2-NH2 3.41Å
43	I	98.5	Very high	97.8	Very high	1 Å²	1	67 Å²	67	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-45.9	177.9	-67.6	168.3	0	0	0	111.5	I39 H40 R45 D46 V47 L85 I87 A308 M311 K312 V315	I39-I43 HydrophobicContact CG2-CD1 3.64Å; I39-I43 HydrophobicContact CG2-CG1 4.14Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.28Å; I39-I43 PolarHBondContact O-N 2.96Å; H40-I43 PolarHBondContact O-N 2.89Å; I43-R45 VanDerWaalsContact C-N 3.3Å; I43-R45 PolarHBondContact O-N 2.93Å; I43-D46 WeakPolarHBondContact O-CB 3.38Å; I43-D46 PolarHBondContact O-N 3.39Å; I43-D46 VanDerWaalsContact O-N 3.16Å; I43-V47 HydrophobicContact CG2-CG2 4.28Å; I43-V47 WeakPolarHBondContact O-CG2 3.07Å; I43-V47 PolarHBondContact O-N 2.8Å; I43-L85 HydrophobicContact CD1-CD1 4.24Å; I43-L85 HydrophobicContact CG2-CB 4.07Å; I43-L85 HydrophobicContact CG2-CD1 4.03Å; I43-L85 HydrophobicContact CG2-CG 4.45Å; I43-I87 HydrophobicContact CG2-CD1 4.08Å; I43-A308 VanDerWaalsContact CD1-O 3.32Å; I43-A308 WeakPolarHBondContact CD1-O 3.05Å; I43-M311 HydrophobicContact CD1-CB 3.86Å; I43-K312 HydrophobicContact CD1-CB 4.01Å; I43-K312 HydrophobicContact CG1-CB 4.32Å; I43-V315 HydrophobicContact CG2-CG2 3.9Å
44	Q	98.3	Very high	97.7	Very high	64 Å²	64	68.2 Å²	68.2	30%	0.299	34%	0.338	S	S	.	.	H	α-helix	trans	-57.9	-45.5	177.8	-80.1	173.2	-37.8	0	0	111.3	H40 R41 D46 V47 E48 I84 L85	H40-Q44 WeakPolarHBondContact O-CB 3.35Å; H40-Q44 WeakPolarHBondContact O-CG 3.41Å; H40-Q44 PolarHBondContact O-N 3.27Å; R41-Q44 PolarHBondContact O-N 2.84Å; Q44-D46 VanDerWaalsContact C-N 3.34Å; Q44-D46 PolarHBondContact O-N 2.78Å; Q44-V47 PolarHBondContact O-N 2.71Å; Q44-E48 WeakPolarHBondContact O-CB 3.31Å; Q44-E48 VanDerWaalsContact O-CG 3.31Å; Q44-E48 WeakPolarHBondContact O-CG 3.48Å; Q44-E48 PolarHBondContact O-N 3.27Å; Q44-I84 PolarHBondContact NE2-O 3Å; Q44-L85 HydrophobicContact CG-CB 4.35Å; Q44-L85 HydrophobicContact CG-CD2 3.74Å
45	R	98.3	Very high	97.6	Very high	166 Å²	166	65.5 Å²	65.5	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-60	-44.9	175.4	-168.1	-173.2	75.5	179.1	5.1	111.6	R41 E42 I43 V47 E48 E49	R41-R45 PolarHBondContact O-N 3.38Å; R41-R45 VanDerWaalsContact O-N 3.1Å; E42-R45 PolarHBondContact O-N 3.1Å; I43-R45 VanDerWaalsContact C-N 3.3Å; I43-R45 PolarHBondContact O-N 2.93Å; R45-V47 VanDerWaalsContact C-N 3.33Å; R45-V47 PolarHBondContact O-N 3.45Å; R45-E48 PolarHBondContact O-N 3Å; R45-E49 VanDerWaalsContact O-CB 3.32Å; R45-E49 WeakPolarHBondContact O-CB 3.44Å; R45-E49 PolarHBondContact O-N 2.86Å
46	D	97.8	Very high	97.4	Very high	26 Å²	26	69.2 Å²	69.2	14%	0.139	35%	0.345	C	S	.	.	H	α-helix	trans	-62.4	-38.8	178.7	-77.2	-11.7	0	0	0	112.4	E42 I43 Q44 L50 V315 R319	E42-D46 WeakPolarHBondContact O-CB 3.23Å; E42-D46 VanDerWaalsContact O-CG 3.31Å; E42-D46 PolarHBondContact O-N 3.24Å; I43-D46 WeakPolarHBondContact O-CB 3.38Å; I43-D46 PolarHBondContact O-N 3.39Å; I43-D46 VanDerWaalsContact O-N 3.16Å; Q44-D46 VanDerWaalsContact C-N 3.34Å; Q44-D46 PolarHBondContact O-N 2.78Å; D46-L50 WeakPolarHBondContact O-CG 3.37Å; D46-L50 PolarHBondContact O-N 2.9Å; D46-L50 VanDerWaalsContact O-N 3.07Å; D46-V315 HydrophobicContact CB-CG1 4.01Å; D46-R319 VanDerWaalsContact CG-CZ 3.48Å; D46-R319 IonicContact OD1-CZ 3.23Å; D46-R319 IonicContact OD1-NH1 2.72Å; D46-R319 IonicContact OD1-NH2 2.88Å; D46-R319 PolarHBondContact OD1-NH2 3.17Å; D46-R319 IonicContact OD2-CZ 3.65Å; D46-R319 IonicContact OD2-NH1 3.51Å; D46-R319 PolarHBondContact OD2-NH1 2.83Å; D46-R319 IonicContact OD2-NH2 3.57Å
47	V	98.3	Very high	97.3	Very high	1 Å²	1	74.9 Å²	74.9	1%	0.006	37%	0.365	C	S	.	.	H	α-helix	trans	-69.2	-45.6	176.1	170.7	0	0	0	0	111.3	I43 Q44 R45 E49 L50 V51 P58 G86 I87 V315	I43-V47 HydrophobicContact CG2-CG2 4.28Å; I43-V47 WeakPolarHBondContact O-CG2 3.07Å; I43-V47 PolarHBondContact O-N 2.8Å; Q44-V47 PolarHBondContact O-N 2.71Å; R45-V47 VanDerWaalsContact C-N 3.33Å; R45-V47 PolarHBondContact O-N 3.45Å; V47-E49 VanDerWaalsContact C-N 3.3Å; V47-E49 PolarHBondContact O-N 2.9Å; V47-L50 PolarHBondContact O-N 3.28Å; V47-V51 WeakPolarHBondContact O-CG2 3.41Å; V47-V51 PolarHBondContact O-N 2.71Å; V47-V51 VanDerWaalsContact O-N 3.09Å; V47-P58 HydrophobicContact CG2-CG 4.28Å; V47-G86 WeakPolarHBondContact CG1-O 3.45Å; V47-I87 HydrophobicContact CG2-CG1 3.92Å; V47-V315 HydrophobicContact CG2-CG2 3.68Å
48	E	97.6	Very high	97.4	Very high	128 Å²	128	67.9 Å²	67.9	60%	0.598	34%	0.339	S	S	*	.	H	α-helix	trans	-60.2	-42.6	176.9	-74.7	170.3	-176.9	0	0	111.3	Q44 R45 V51 A52	Q44-E48 WeakPolarHBondContact O-CB 3.31Å; Q44-E48 VanDerWaalsContact O-CG 3.31Å; Q44-E48 WeakPolarHBondContact O-CG 3.48Å; Q44-E48 PolarHBondContact O-N 3.27Å; R45-E48 PolarHBondContact O-N 3Å; E48-V51 PolarHBondContact O-N 2.84Å; E48-A52 VanDerWaalsContact O-CB 3.3Å; E48-A52 WeakPolarHBondContact O-CB 3.14Å; E48-A52 PolarHBondContact O-N 3.1Å
49	E	97.4	Very high	97.4	Very high	90 Å²	90	66.1 Å²	66.1	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-48.6	174.9	-176.2	-177.9	-166	0	0	111.6	R45 V47 V51 A52 H53 R319	R45-E49 VanDerWaalsContact O-CB 3.32Å; R45-E49 WeakPolarHBondContact O-CB 3.44Å; R45-E49 PolarHBondContact O-N 2.86Å; V47-E49 VanDerWaalsContact C-N 3.3Å; V47-E49 PolarHBondContact O-N 2.9Å; E49-V51 VanDerWaalsContact C-N 3.31Å; E49-V51 PolarHBondContact O-N 3.18Å; E49-A52 PolarHBondContact O-N 3.1Å; E49-H53 PolarHBondContact O-N 3.28Å; E49-H53 VanDerWaalsContact O-N 3.14Å; E49-H53 PolarHBondContact O-ND1 3.48Å; E49-R319 IonicContact OE2-NH2 3.36Å; E49-R319 PolarHBondContact OE2-NH2 3.35Å
50	L	96.4	Very high	97.4	Very high	12 Å²	12	66.1 Å²	66.1	6%	0.063	33%	0.331	C	S	.	.	H	α-helix	trans	-55.5	-47.4	177.7	-80.9	172	0	0	0	112.1	D46 V47 H53 N55 P58 V315 R319 L322	D46-L50 WeakPolarHBondContact O-CG 3.37Å; D46-L50 PolarHBondContact O-N 2.9Å; D46-L50 VanDerWaalsContact O-N 3.07Å; V47-L50 PolarHBondContact O-N 3.28Å; L50-H53 PolarHBondContact O-N 3.38Å; L50-N55 VanDerWaalsContact O-CB 3.28Å; L50-N55 WeakPolarHBondContact O-CB 3.49Å; L50-N55 PolarHBondContact O-N 2.73Å; L50-N55 PolarHBondContact O-ND2 2.88Å; L50-P58 HydrophobicContact CD1-CG 3.87Å; L50-V315 HydrophobicContact CD1-CG1 3.98Å; L50-R319 HydrophobicContact CD1-CG 4.1Å; L50-R319 HydrophobicContact CD2-CG 3.85Å; L50-R319 HydrophobicContact CG-CG 4.35Å; L50-L322 HydrophobicContact CD2-CD1 3.72Å
51	V	96.8	Very high	97.4	Very high	48 Å²	48	64 Å²	64	29%	0.291	32%	0.321	S	S	.	.	H	α-helix	trans	-68.3	-39.8	-178.9	175.8	0	0	0	0	111.7	V47 E48 E49 H53 G54 R57	V47-V51 WeakPolarHBondContact O-CG2 3.41Å; V47-V51 PolarHBondContact O-N 2.71Å; V47-V51 VanDerWaalsContact O-N 3.09Å; E48-V51 PolarHBondContact O-N 2.84Å; E49-V51 VanDerWaalsContact C-N 3.31Å; E49-V51 PolarHBondContact O-N 3.18Å; V51-H53 PolarHBondContact O-N 3.1Å; V51-G54 PolarHBondContact O-N 3.45Å; V51-R57 HydrophobicContact CG2-CB 4.42Å; V51-R57 HydrophobicContact CG2-CG 3.43Å; V51-R57 VanDerWaalsContact CG2-CG 3.43Å
52	A	97.1	Very high	97.4	Very high	87 Å²	87	56.8 Å²	56.8	72%	0.719	29%	0.294	S	S	*	.	H	α-helix	trans	-62.4	-29.8	177.5	0	0	0	0	0	112.6	E48 E49 G54	E48-A52 VanDerWaalsContact O-CB 3.3Å; E48-A52 WeakPolarHBondContact O-CB 3.14Å; E48-A52 PolarHBondContact O-N 3.1Å; E49-A52 PolarHBondContact O-N 3.1Å; A52-G54 PolarHBondContact O-N 2.95Å
53	H	96.3	Very high	97.4	Very high	134 Å²	134	53.5 Å²	53.5	62%	0.62	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	8.2	172.8	-69.9	93.4	0	0	0	113.8	E49 L50 V51 N55	E49-H53 PolarHBondContact O-N 3.28Å; E49-H53 VanDerWaalsContact O-N 3.14Å; E49-H53 PolarHBondContact O-ND1 3.48Å; L50-H53 PolarHBondContact O-N 3.38Å; V51-H53 PolarHBondContact O-N 3.1Å; H53-N55 VanDerWaalsContact C-N 3.34Å; H53-N55 WeakPolarHBondContact CB-ND2 3.42Å
54	G	95.7	Very high	97.3	Very high	70 Å²	70	53.6 Å²	53.6	72%	0.722	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	6.4	178.4	0	0	0	0	0	114.7	V51 A52	V51-G54 PolarHBondContact O-N 3.45Å; A52-G54 PolarHBondContact O-N 2.95Å
55	N	95.9	Very high	97.3	Very high	51 Å²	51	51 Å²	51	27%	0.273	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-80.1	158.7	177.1	-53.1	-71.3	0	0	0	111.2	L50 H53 L322	L50-N55 VanDerWaalsContact O-CB 3.28Å; L50-N55 WeakPolarHBondContact O-CB 3.49Å; L50-N55 PolarHBondContact O-N 2.73Å; L50-N55 PolarHBondContact O-ND2 2.88Å; H53-N55 VanDerWaalsContact C-N 3.34Å; H53-N55 WeakPolarHBondContact CB-ND2 3.42Å; N55-L322 HydrophobicContact CB-CD1 4Å; N55-L322 HydrophobicContact CB-CD2 4.38Å; N55-L322 WeakPolarHBondContact OD1-CD1 3.16Å; N55-L322 WeakPolarHBondContact OD1-CD2 3.21Å
56	M	94.1	Very high	97.2	Very high	100 Å²	100	43.3 Å²	43.3	49%	0.493	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-64.7	148.8	172.1	-74.3	-169.1	64.2	0	0	111.8	W114 R115	M56-W114 HydrophobicContact CE-CH2 4.42Å; M56-W114 HydrophobicContact CE-CZ3 4.35Å; M56-W114 HydrophobicContact CG-CZ3 4.46Å; M56-W114 HydrophobicContact SD-CE3 3.99Å; M56-W114 HydrophobicContact SD-CH2 3.43Å; M56-W114 WeakPolarHBondContact SD-CH2 3.33Å; M56-W114 HydrophobicContact SD-CZ3 3.06Å; M56-W114 WeakPolarHBondContact SD-CZ3 3.49Å; M56-R115 HydrophobicContact CE-CB 4.37Å; M56-R115 HydrophobicContact CE-CG 4.22Å
57	R	96.4	Very high	96.9	Very high	123 Å²	123	47.7 Å²	47.7	46%	0.464	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-58.5	136.8	167.1	-74.7	-178.8	-176.6	-78.1	-5	109.1	V51 H59 G86	V51-R57 HydrophobicContact CG2-CB 4.42Å; V51-R57 HydrophobicContact CG2-CG 3.43Å; V51-R57 VanDerWaalsContact CG2-CG 3.43Å; R57-H59 PolarHBondContact O-N 3.15Å; R57-G86 PolarHBondContact NH1-O 2.75Å
58	P	98.3	Very high	96.5	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-52.7	141.9	170	-27.2	36.5	0	0	0	111.1	V47 L50 I87 S88 T314 V315 A318	V47-P58 HydrophobicContact CG2-CG 4.28Å; L50-P58 HydrophobicContact CD1-CG 3.87Å; P58-I87 HydrophobicContact CB-CG1 4.45Å; P58-I87 HydrophobicContact CB-CG2 4.31Å; P58-S88 PolarHBondContact O-N 3.32Å; P58-S88 PolarHBondContact O-OG 3.07Å; P58-T314 HydrophobicContact CB-CG2 4.3Å; P58-V315 HydrophobicContact CG-CG2 4.21Å; P58-A318 HydrophobicContact CB-CB 3.82Å; P58-A318 HydrophobicContact CG-CB 3.77Å
59	H	98.3	Very high	96	Very high	22 Å²	22	49.2 Å²	49.2	10%	0.102	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.5	179.7	-170.7	85.7	0	0	0	111.2	R57 S88 D90 R115 S117 G118	R57-H59 PolarHBondContact O-N 3.15Å; H59-S88 CarbonylContact C-O 3.53Å; H59-S88 VanDerWaalsContact CA-O 3.3Å; H59-S88 WeakPolarHBondContact CA-O 3.32Å; H59-S88 WeakPolarHBondContact CA-OG 3.32Å; H59-S88 WeakPolarHBondContact CB-OG 3.03Å; H59-S88 PolarHBondContact ND1-OG 2.86Å; H59-D90 IonicContact CE1-OD2 2.86Å; H59-D90 PolarHBondContact CE1-OD2 3.16Å; H59-D90 IonicContact NE2-OD2 2.65Å; H59-D90 PolarHBondContact NE2-OD2 3.33Å; H59-R115 WeakPolarHBondContact CB-O 3.31Å; H59-S117 PolarHBondContact N-OG 3.28Å; H59-S117 WeakPolarHBondContact O-CB 3.29Å; H59-S117 PolarHBondContact O-N 2.65Å; H59-G118 PolarHBondContact O-N 2.86Å
60	L	98.6	Very high	95.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	108.5	176.4	179	60.2	0	0	0	110.8	V62 I87 S88 S89 D90 G118 L120 V144 M311 T314	L60-V62 HydrophobicContact CD2-CG2 4.21Å; L60-V62 HydrophobicContact CG-CG2 3.96Å; L60-I87 HydrophobicContact CB-CG2 4.29Å; L60-S88 PolarHBondContact N-O 3.45Å; L60-S89 WeakPolarHBondContact O-CA 3.28Å; L60-S89 WeakPolarHBondContact O-CB 3.35Å; L60-D90 PolarHBondContact O-N 2.89Å; L60-D90 VanDerWaalsContact O-N 3.13Å; L60-G118 WeakPolarHBondContact CA-O 3.13Å; L60-L120 HydrophobicContact CD1-CD2 4.15Å; L60-V144 HydrophobicContact CD1-CG2 3.82Å; L60-M311 HydrophobicContact CD2-CE 3.69Å; L60-M311 HydrophobicContact CD2-SD 4.33Å; L60-T314 HydrophobicContact CB-CG2 4.02Å; L60-T314 HydrophobicContact CD1-CG2 4.49Å
61	G	98.2	Very high	95.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.5	167.4	0	0	0	0	0	111.4	G118 L119 L120	G61-G118 PolarHBondContact N-O 2.89Å; G61-L119 WeakPolarHBondContact O-CA 3.35Å; G61-L120 PolarHBondContact O-N 2.74Å
62	V	98.1	Very high	94.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.3	176.6	-178.7	0	0	0	0	109.9	L60 V75 D90 T91 V92 L120	L60-V62 HydrophobicContact CD2-CG2 4.21Å; L60-V62 HydrophobicContact CG-CG2 3.96Å; V62-V75 HydrophobicContact CG1-CG1 3.87Å; V62-V75 HydrophobicContact CG1-CG2 3.97Å; V62-D90 PolarHBondContact N-O 3.2Å; V62-T91 HydrophobicContact CG1-CG2 4.43Å; V62-T91 CarbonylContact O-C 3.52Å; V62-T91 VanDerWaalsContact O-CA 3.31Å; V62-T91 WeakPolarHBondContact O-CA 3.08Å; V62-V92 PolarHBondContact O-N 3.01Å; V62-L120 HydrophobicContact CG1-CD1 3.78Å; V62-L120 HydrophobicContact CG1-CG 4.36Å; V62-L120 HydrophobicContact CG2-CD1 4.42Å; V62-L120 HydrophobicContact CG2-CD2 4.31Å; V62-L120 HydrophobicContact CG2-CG 4.17Å
63	I	98.4	Very high	94.3	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.7	169.1	-55.4	172.4	0	0	0	108.8	V65 V92 L103 L106 I107 M110 L119 L120 V121 Q122	I63-V65 HydrophobicContact CG2-CG2 4.34Å; I63-V92 WeakPolarHBondContact CA-O 3.37Å; I63-L103 HydrophobicContact CD1-CD1 4.48Å; I63-L103 HydrophobicContact CG2-CD1 3.73Å; I63-L106 HydrophobicContact CD1-CD2 3.78Å; I63-L106 HydrophobicContact CD1-CG 3.86Å; I63-L106 HydrophobicContact CG1-CD2 4.02Å; I63-L106 HydrophobicContact CG1-CG 4.47Å; I63-L106 HydrophobicContact CG2-CD2 3.98Å; I63-I107 HydrophobicContact CD1-CG1 3.57Å; I63-M110 HydrophobicContact CD1-SD 3.77Å; I63-M110 HydrophobicContact CG1-SD 3.73Å; I63-L119 HydrophobicContact CD1-CD1 4.26Å; I63-L119 HydrophobicContact CG1-CD1 4.31Å; I63-L120 PolarHBondContact N-O 3.43Å; I63-V121 HydrophobicContact CB-CG1 4.34Å; I63-V121 HydrophobicContact CB-CG2 4.08Å; I63-V121 HydrophobicContact CD1-CG2 4.04Å; I63-V121 HydrophobicContact CG1-CG2 4.49Å; I63-V121 HydrophobicContact CG2-CG1 4.45Å; I63-Q122 PolarHBondContact O-N 2.75Å
64	L	97.9	Very high	93.9	Very high	3 Å²	3	44 Å²	44	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125	175.8	175.2	61.9	0	0	0	109.5	H72 V75 T91 V92 V93 R94 Q122	L64-H72 WeakPolarHBondContact CD2-ND1 3.32Å; L64-V75 HydrophobicContact CD1-CG2 4.25Å; L64-V75 HydrophobicContact CD2-CG2 4.43Å; L64-T91 HydrophobicContact CB-CG2 4.25Å; L64-V92 PolarHBondContact N-O 2.83Å; L64-V93 HydrophobicContact CD2-CG2 4.47Å; L64-V93 CarbonylContact O-C 3.54Å; L64-V93 WeakPolarHBondContact O-CA 3.33Å; L64-R94 PolarHBondContact O-N 2.93Å; L64-Q122 HydrophobicContact CD1-CB 4.04Å; L64-Q122 HydrophobicContact CD1-CG 3.99Å
65	V	98.1	Very high	93.7	Very high	9 Å²	9	41 Å²	41	6%	0.055	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.9	178.7	-177.1	0	0	0	0	110.1	I63 R94 V98 L103 L125 P126	I63-V65 HydrophobicContact CG2-CG2 4.34Å; V65-R94 WeakPolarHBondContact CA-O 3.4Å; V65-R94 HydrophobicContact CG2-CB 4.36Å; V65-V98 HydrophobicContact CG1-CG1 3.57Å; V65-V98 HydrophobicContact CG2-CG1 4.29Å; V65-L103 HydrophobicContact CG2-CD1 4.17Å; V65-L103 HydrophobicContact CG2-CD2 4.29Å; V65-L125 HydrophobicContact CB-CD2 3.73Å; V65-L125 HydrophobicContact CG1-CD2 4.46Å; V65-L125 HydrophobicContact CG2-CD2 3.67Å; V65-P126 HydrophobicContact CG1-CG 3.76Å
66	G	94.9	Very high	93.6	Very high	5 Å²	5	45.7 Å²	45.7	5%	0.052	23%	0.229	C	C	.	.	S	Bend	trans	77.3	-170.8	179.2	0	0	0	0	0	114.3	R94	G66-R94 PolarHBondContact N-O 3.32Å
67	D	91.3	Very high	93.4	Very high	119 Å²	119	44.6 Å²	44.6	64%	0.636	22%	0.224	S	C	*	.			trans	-116.7	23.1	-166.2	-59.5	-67.7	0	0	0	113.9	P69 H72	D67-P69 VanDerWaalsContact O-CD 3.22Å; D67-P69 WeakPolarHBondContact O-CD 3.38Å; D67-P69 VanDerWaalsContact O-N 3.15Å; D67-H72 WeakPolarHBondContact CA-NE2 3.27Å; D67-H72 IonicContact OD1-NE2 3Å
68	D	89.8	Confident	93.3	Very high	71 Å²	71	39.9 Å²	39.9	38%	0.38	21%	0.207	S	C	.	.			trans	-60.4	119.2	-179.6	174.5	68.4	0	0	0	111	A70 S71 H72	D68-A70 PolarHBondContact O-N 2.92Å; D68-A70 VanDerWaalsContact O-N 3.15Å; D68-A70 WeakPolarHBondContact OD2-CA 3.45Å; D68-A70 WeakPolarHBondContact OD2-CB 3.37Å; D68-A70 PolarHBondContact OD2-N 2.98Å; D68-S71 WeakPolarHBondContact O-CB 3.36Å; D68-S71 PolarHBondContact O-N 2.88Å; D68-S71 VanDerWaalsContact O-N 3.11Å; D68-S71 PolarHBondContact OD2-N 3.12Å; D68-S71 PolarHBondContact OD2-OG 3.41Å; D68-H72 PolarHBondContact O-CD2 3.5Å; D68-H72 VanDerWaalsContact O-CD2 3.26Å; D68-H72 PolarHBondContact O-N 3.22Å
69	P	87.6	Confident	93	Very high	90 Å²	90	41.2 Å²	41.2	58%	0.584	22%	0.216	S	C	*	.	H	α-helix	trans	-62.1	-27.4	-175.1	-25.6	35	0	0	0	113.9	D67 T73	D67-P69 VanDerWaalsContact O-CD 3.22Å; D67-P69 WeakPolarHBondContact O-CD 3.38Å; D67-P69 VanDerWaalsContact O-N 3.15Å; P69-T73 PolarHBondContact O-N 3.12Å; P69-T73 PolarHBondContact O-OG1 2.99Å
70	A	85.6	Confident	92.9	Very high	14 Å²	14	48.1 Å²	48.1	12%	0.116	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-51.2	175.1	0	0	0	0	0	110.1	D68 H72 T73 Y74	D68-A70 PolarHBondContact O-N 2.92Å; D68-A70 VanDerWaalsContact O-N 3.15Å; D68-A70 WeakPolarHBondContact OD2-CA 3.45Å; D68-A70 WeakPolarHBondContact OD2-CB 3.37Å; D68-A70 PolarHBondContact OD2-N 2.98Å; A70-H72 VanDerWaalsContact C-N 3.35Å; A70-H72 PolarHBondContact O-N 3.1Å; A70-T73 WeakPolarHBondContact O-CB 3.43Å; A70-T73 PolarHBondContact O-N 2.81Å; A70-T73 VanDerWaalsContact O-N 3.11Å; A70-Y74 HydrophobicContact CB-CD2 4.36Å; A70-Y74 HydrophobicContact CB-CE2 4.22Å; A70-Y74 WeakPolarHBondContact O-CD2 3.09Å; A70-Y74 PolarHBondContact O-N 3.36Å
71	S	89	Confident	92.7	Very high	5 Å²	5	48.7 Å²	48.7	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-56.7	-45.2	178	-69.1	0	0	0	0	111.8	D68 T73 Y74 V75	D68-S71 WeakPolarHBondContact O-CB 3.36Å; D68-S71 PolarHBondContact O-N 2.88Å; D68-S71 VanDerWaalsContact O-N 3.11Å; D68-S71 PolarHBondContact OD2-N 3.12Å; D68-S71 PolarHBondContact OD2-OG 3.41Å; S71-T73 VanDerWaalsContact C-N 3.34Å; S71-T73 PolarHBondContact O-N 3.23Å; S71-Y74 PolarHBondContact O-N 2.88Å; S71-V75 WeakPolarHBondContact O-CB 3.4Å; S71-V75 WeakPolarHBondContact O-CG2 3.49Å; S71-V75 PolarHBondContact O-N 2.97Å
72	H	90.1	Very high	92.6	Very high	70 Å²	70	48.7 Å²	48.7	32%	0.324	25%	0.245	S	C	.	.	H	α-helix	trans	-58.1	-44.9	174	-80.3	-78	0	0	0	112.9	L64 D67 D68 A70 K76	L64-H72 WeakPolarHBondContact CD2-ND1 3.32Å; D67-H72 WeakPolarHBondContact CA-NE2 3.27Å; D67-H72 IonicContact OD1-NE2 3Å; D68-H72 PolarHBondContact O-CD2 3.5Å; D68-H72 VanDerWaalsContact O-CD2 3.26Å; D68-H72 PolarHBondContact O-N 3.22Å; A70-H72 VanDerWaalsContact C-N 3.35Å; A70-H72 PolarHBondContact O-N 3.1Å; H72-K76 VanDerWaalsContact O-CB 3.25Å; H72-K76 WeakPolarHBondContact O-CB 3.44Å; H72-K76 PolarHBondContact O-N 2.96Å
73	T	88.4	Confident	92.5	Very high	80 Å²	80	53.4 Å²	53.4	49%	0.491	27%	0.274	S	S	.	.	H	α-helix	trans	-64.5	-42.7	179	-58.7	0	0	0	0	111	P69 A70 S71 N77	P69-T73 PolarHBondContact O-N 3.12Å; P69-T73 PolarHBondContact O-OG1 2.99Å; A70-T73 WeakPolarHBondContact O-CB 3.43Å; A70-T73 PolarHBondContact O-N 2.81Å; A70-T73 VanDerWaalsContact O-N 3.11Å; S71-T73 VanDerWaalsContact C-N 3.34Å; S71-T73 PolarHBondContact O-N 3.23Å; T73-N77 WeakPolarHBondContact O-CB 3.42Å; T73-N77 PolarHBondContact O-N 3.13Å; T73-N77 PolarHBondContact O-ND2 3.31Å
74	Y	86.8	Confident	92.4	Very high	93 Å²	93	58 Å²	58	37%	0.365	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-47.6	177.3	-76.6	-60.8	0	0	0	112.2	A70 S71 K76 N77 K78	A70-Y74 HydrophobicContact CB-CD2 4.36Å; A70-Y74 HydrophobicContact CB-CE2 4.22Å; A70-Y74 WeakPolarHBondContact O-CD2 3.09Å; A70-Y74 PolarHBondContact O-N 3.36Å; S71-Y74 PolarHBondContact O-N 2.88Å; Y74-K76 PolarHBondContact O-N 2.8Å; Y74-N77 PolarHBondContact O-N 3.16Å; Y74-K78 WeakPolarHBondContact O-CG 3.12Å; Y74-K78 PolarHBondContact O-N 3.4Å
75	V	93.1	Very high	92.4	Very high	6 Å²	6	57.9 Å²	57.9	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-45.2	177.4	170.9	0	0	0	0	110.9	V62 L64 S71 N77 K78 T79 T91 Q122	V62-V75 HydrophobicContact CG1-CG1 3.87Å; V62-V75 HydrophobicContact CG1-CG2 3.97Å; L64-V75 HydrophobicContact CD1-CG2 4.25Å; L64-V75 HydrophobicContact CD2-CG2 4.43Å; S71-V75 WeakPolarHBondContact O-CB 3.4Å; S71-V75 WeakPolarHBondContact O-CG2 3.49Å; S71-V75 PolarHBondContact O-N 2.97Å; V75-N77 VanDerWaalsContact C-N 3.28Å; V75-N77 PolarHBondContact O-N 3.05Å; V75-K78 WeakPolarHBondContact O-CB 3.26Å; V75-K78 PolarHBondContact O-N 3.13Å; V75-K78 VanDerWaalsContact O-N 3.12Å; V75-T79 HydrophobicContact CG1-CG2 4.37Å; V75-T79 PolarHBondContact O-N 3.07Å; V75-T79 PolarHBondContact O-OG1 3.41Å; V75-T91 HydrophobicContact CG1-CG2 3.73Å; V75-Q122 HydrophobicContact CG2-CB 3.9Å; V75-Q122 HydrophobicContact CG2-CG 3.74Å
76	K	92.2	Very high	92.3	Very high	150 Å²	150	58.6 Å²	58.6	65%	0.652	31%	0.307	S	S	*	.	H	α-helix	trans	-58.3	-39.3	175.5	-179.3	175.5	-178.5	176.3	0	112.6	H72 Y74 T79 R80	H72-K76 VanDerWaalsContact O-CB 3.25Å; H72-K76 WeakPolarHBondContact O-CB 3.44Å; H72-K76 PolarHBondContact O-N 2.96Å; Y74-K76 PolarHBondContact O-N 2.8Å; K76-T79 PolarHBondContact O-OG1 3.22Å; K76-R80 VanDerWaalsContact O-CB 3.22Å; K76-R80 WeakPolarHBondContact O-CB 3.23Å; K76-R80 PolarHBondContact O-N 3.36Å
77	N	90.8	Very high	92.5	Very high	76 Å²	76	58.6 Å²	58.6	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-69.2	-39.2	176.8	-71.8	-22.1	0	0	0	111.8	T73 Y74 V75 A81	T73-N77 WeakPolarHBondContact O-CB 3.42Å; T73-N77 PolarHBondContact O-N 3.13Å; T73-N77 PolarHBondContact O-ND2 3.31Å; Y74-N77 PolarHBondContact O-N 3.16Å; V75-N77 VanDerWaalsContact C-N 3.28Å; V75-N77 PolarHBondContact O-N 3.05Å; N77-A81 WeakPolarHBondContact O-CB 3.32Å; N77-A81 PolarHBondContact O-N 3.43Å
78	K	93.6	Very high	92.8	Very high	24 Å²	24	55 Å²	55	10%	0.104	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-49.7	175.5	-70.3	172.2	173.9	-175.4	0	111.4	Y74 V75 R80 A81 A82 L120 L310 M311	Y74-K78 WeakPolarHBondContact O-CG 3.12Å; Y74-K78 PolarHBondContact O-N 3.4Å; V75-K78 WeakPolarHBondContact O-CB 3.26Å; V75-K78 PolarHBondContact O-N 3.13Å; V75-K78 VanDerWaalsContact O-N 3.12Å; K78-R80 PolarHBondContact O-N 3.09Å; K78-A81 PolarHBondContact O-N 3.14Å; K78-A82 PolarHBondContact O-N 2.83Å; K78-L120 HydrophobicContact CD-CD2 4.32Å; K78-L310 HydrophobicContact CB-CD2 4.39Å; K78-L310 HydrophobicContact CD-CD2 3.58Å; K78-L310 HydrophobicContact CG-CD2 3.74Å; K78-M311 HydrophobicContact CB-CE 4.16Å; K78-M311 VanDerWaalsContact O-CE 3.25Å; K78-M311 WeakPolarHBondContact O-CE 3.35Å
79	T	93.3	Very high	93.1	Very high	29 Å²	29	52.8 Å²	52.8	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-37.7	-180	55.8	0	0	0	0	112.5	V75 K76 A82 T83 T91	V75-T79 HydrophobicContact CG1-CG2 4.37Å; V75-T79 PolarHBondContact O-N 3.07Å; V75-T79 PolarHBondContact O-OG1 3.41Å; K76-T79 PolarHBondContact O-OG1 3.22Å; T79-A82 PolarHBondContact O-N 2.88Å; T79-T83 PolarHBondContact O-N 2.87Å; T79-T83 PolarHBondContact O-OG1 3.13Å; T79-T91 WeakPolarHBondContact CG2-OG1 3.41Å
80	R	94.3	Very high	93.5	Very high	167 Å²	167	53.2 Å²	53.2	63%	0.63	28%	0.277	S	S	*	.	H	α-helix	trans	-61.5	-44	172	-177.2	178.7	179.9	177.6	2.2	111.6	K76 K78 T83 I84	K76-R80 VanDerWaalsContact O-CB 3.22Å; K76-R80 WeakPolarHBondContact O-CB 3.23Å; K76-R80 PolarHBondContact O-N 3.36Å; K78-R80 PolarHBondContact O-N 3.09Å; R80-T83 PolarHBondContact O-N 2.76Å; R80-I84 HydrophobicContact CG-CD1 3.92Å; R80-I84 VanDerWaalsContact O-CG1 3.29Å; R80-I84 WeakPolarHBondContact O-CG1 3.45Å; R80-I84 PolarHBondContact O-N 3.38Å
81	A	95.1	Very high	94	Very high	11 Å²	11	55.1 Å²	55.1	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-47.4	176.5	0	0	0	0	0	111	N77 K78 T83 I84 L85 V307 M311	N77-A81 WeakPolarHBondContact O-CB 3.32Å; N77-A81 PolarHBondContact O-N 3.43Å; K78-A81 PolarHBondContact O-N 3.14Å; A81-T83 VanDerWaalsContact C-N 3.32Å; A81-T83 PolarHBondContact O-N 3.29Å; A81-I84 PolarHBondContact O-N 2.84Å; A81-L85 WeakPolarHBondContact O-CB 3.32Å; A81-L85 WeakPolarHBondContact O-CG 3.4Å; A81-L85 PolarHBondContact O-N 2.9Å; A81-V307 HydrophobicContact CB-CG1 3.59Å; A81-M311 HydrophobicContact CB-CE 4.41Å; A81-M311 HydrophobicContact CB-CG 4.39Å
82	A	97.1	Very high	94.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-52	-51.5	175.7	0	0	0	0	0	111.4	K78 T79 I84 L85 G86 I87 M311	K78-A82 PolarHBondContact O-N 2.83Å; T79-A82 PolarHBondContact O-N 2.88Å; A82-I84 PolarHBondContact O-N 2.95Å; A82-L85 CarbonylContact O-C 3.43Å; A82-L85 PolarHBondContact O-N 3.46Å; A82-G86 PolarHBondContact O-N 3.44Å; A82-G86 VanDerWaalsContact O-N 3.16Å; A82-I87 CarbonylContact C-O 3.49Å; A82-I87 HydrophobicContact CB-CB 3.99Å; A82-I87 HydrophobicContact CB-CG2 4.04Å; A82-I87 WeakPolarHBondContact O-CB 2.86Å; A82-I87 PolarHBondContact O-N 2.9Å; A82-M311 VanDerWaalsContact CA-SD 3.57Å; A82-M311 HydrophobicContact CB-CE 4.3Å; A82-M311 HydrophobicContact CB-SD 3.71Å
83	T	95.8	Very high	94.8	Very high	99 Å²	99	56.8 Å²	56.8	61%	0.607	30%	0.302	S	S	*	.	H	α-helix	trans	-57.9	-47.3	179.6	-56.3	0	0	0	0	112.2	T79 R80 A81 L85 G86	T79-T83 PolarHBondContact O-N 2.87Å; T79-T83 PolarHBondContact O-OG1 3.13Å; R80-T83 PolarHBondContact O-N 2.76Å; A81-T83 VanDerWaalsContact C-N 3.32Å; A81-T83 PolarHBondContact O-N 3.29Å; T83-L85 PolarHBondContact O-N 3.25Å; T83-G86 PolarHBondContact O-N 3.05Å
84	I	95.4	Very high	95.3	Very high	96 Å²	96	57 Å²	57	49%	0.492	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-33.7	178.8	-70.5	166.8	0	0	0	111.3	Q44 R80 A81 A82 G86	Q44-I84 PolarHBondContact NE2-O 3Å; R80-I84 HydrophobicContact CG-CD1 3.92Å; R80-I84 VanDerWaalsContact O-CG1 3.29Å; R80-I84 WeakPolarHBondContact O-CG1 3.45Å; R80-I84 PolarHBondContact O-N 3.38Å; A81-I84 PolarHBondContact O-N 2.84Å; A82-I84 PolarHBondContact O-N 2.95Å; I84-G86 VanDerWaalsContact C-N 3.3Å
85	L	97.8	Very high	95.8	Very high	2 Å²	2	56 Å²	56	1%	0.01	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.3	-177.4	-59.5	175	0	0	0	113.4	H40 I43 Q44 A81 A82 T83 I87 M311	H40-L85 HydrophobicContact CB-CD2 3.5Å; H40-L85 VanDerWaalsContact CB-CD2 3.5Å; H40-L85 WeakPolarHBondContact O-CD2 3.45Å; I43-L85 HydrophobicContact CD1-CD1 4.24Å; I43-L85 HydrophobicContact CG2-CB 4.07Å; I43-L85 HydrophobicContact CG2-CD1 4.03Å; I43-L85 HydrophobicContact CG2-CG 4.45Å; Q44-L85 HydrophobicContact CG-CB 4.35Å; Q44-L85 HydrophobicContact CG-CD2 3.74Å; A81-L85 WeakPolarHBondContact O-CB 3.32Å; A81-L85 WeakPolarHBondContact O-CG 3.4Å; A81-L85 PolarHBondContact O-N 2.9Å; A82-L85 CarbonylContact O-C 3.43Å; A82-L85 PolarHBondContact O-N 3.46Å; T83-L85 PolarHBondContact O-N 3.25Å; L85-I87 VanDerWaalsContact C-N 3.27Å; L85-I87 HydrophobicContact CB-CD1 4.29Å; L85-I87 HydrophobicContact CB-CG1 4.38Å; L85-I87 PolarHBondContact O-N 3.28Å; L85-M311 HydrophobicContact CD1-CB 3.67Å; L85-M311 HydrophobicContact CD1-CG 3.65Å
86	G	97.3	Very high	96	Very high	24 Å²	24	58.8 Å²	58.8	25%	0.247	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	13.5	-178.8	0	0	0	0	0	114.3	V47 R57 A82 T83 I84	V47-G86 WeakPolarHBondContact CG1-O 3.45Å; R57-G86 PolarHBondContact NH1-O 2.75Å; A82-G86 PolarHBondContact O-N 3.44Å; A82-G86 VanDerWaalsContact O-N 3.16Å; T83-G86 PolarHBondContact O-N 3.05Å; I84-G86 VanDerWaalsContact C-N 3.3Å
87	I	98.4	Very high	96.3	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	32%	0.318	C	S	.	.			trans	-89.1	128.5	173.5	-59.6	171.6	0	0	0	107.6	I43 V47 P58 L60 A82 L85 M311 T314 V315	I43-I87 HydrophobicContact CG2-CD1 4.08Å; V47-I87 HydrophobicContact CG2-CG1 3.92Å; P58-I87 HydrophobicContact CB-CG1 4.45Å; P58-I87 HydrophobicContact CB-CG2 4.31Å; L60-I87 HydrophobicContact CB-CG2 4.29Å; A82-I87 CarbonylContact C-O 3.49Å; A82-I87 HydrophobicContact CB-CB 3.99Å; A82-I87 HydrophobicContact CB-CG2 4.04Å; A82-I87 WeakPolarHBondContact O-CB 2.86Å; A82-I87 PolarHBondContact O-N 2.9Å; L85-I87 VanDerWaalsContact C-N 3.27Å; L85-I87 HydrophobicContact CB-CD1 4.29Å; L85-I87 HydrophobicContact CB-CG1 4.38Å; L85-I87 PolarHBondContact O-N 3.28Å; I87-M311 HydrophobicContact CD1-CB 3.91Å; I87-M311 HydrophobicContact CD1-CG 4.47Å; I87-M311 HydrophobicContact CD1-SD 4.02Å; I87-T314 HydrophobicContact CG2-CG2 4.01Å; I87-V315 HydrophobicContact CD1-CG2 3.84Å; I87-V315 HydrophobicContact CG1-CG2 4.28Å
88	S	97.4	Very high	96.6	Very high	45 Å²	45	52.7 Å²	52.7	32%	0.315	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	148.9	172.8	59.6	0	0	0	0	110.2	P58 H59 L60	P58-S88 PolarHBondContact O-N 3.32Å; P58-S88 PolarHBondContact O-OG 3.07Å; H59-S88 CarbonylContact C-O 3.53Å; H59-S88 VanDerWaalsContact CA-O 3.3Å; H59-S88 WeakPolarHBondContact CA-O 3.32Å; H59-S88 WeakPolarHBondContact CA-OG 3.32Å; H59-S88 WeakPolarHBondContact CB-OG 3.03Å; H59-S88 PolarHBondContact ND1-OG 2.86Å; L60-S88 PolarHBondContact N-O 3.45Å
89	S	97.1	Very high	96.9	Very high	23 Å²	23	53.1 Å²	53.1	16%	0.161	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	140.3	179.4	65.8	0	0	0	0	112.3	L60	L60-S89 WeakPolarHBondContact O-CA 3.28Å; L60-S89 WeakPolarHBondContact O-CB 3.35Å
90	D	94.8	Very high	97.1	Very high	99 Å²	99	54.8 Å²	54.8	53%	0.529	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	141.9	171.9	-68.9	-40.3	0	0	0	110.5	H59 L60 V62	H59-D90 IonicContact CE1-OD2 2.86Å; H59-D90 PolarHBondContact CE1-OD2 3.16Å; H59-D90 IonicContact NE2-OD2 2.65Å; H59-D90 PolarHBondContact NE2-OD2 3.33Å; L60-D90 PolarHBondContact O-N 2.89Å; L60-D90 VanDerWaalsContact O-N 3.13Å; V62-D90 PolarHBondContact N-O 3.2Å
91	T	97	Very high	97.3	Very high	55 Å²	55	53.5 Å²	53.5	34%	0.337	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.3	173.8	-58.7	0	0	0	0	109.8	V62 L64 V75 T79 V93	V62-T91 HydrophobicContact CG1-CG2 4.43Å; V62-T91 CarbonylContact O-C 3.52Å; V62-T91 VanDerWaalsContact O-CA 3.31Å; V62-T91 WeakPolarHBondContact O-CA 3.08Å; L64-T91 HydrophobicContact CB-CG2 4.25Å; V75-T91 HydrophobicContact CG1-CG2 3.73Å; T79-T91 WeakPolarHBondContact CG2-OG1 3.41Å; T91-V93 HydrophobicContact CG2-CG2 4.04Å
92	V	97.6	Very high	97.5	Very high	35 Å²	35	58 Å²	58	21%	0.212	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	112.5	171.6	-174.5	0	0	0	0	108.7	V62 I63 L64 L106 M110	V62-V92 PolarHBondContact O-N 3.01Å; I63-V92 WeakPolarHBondContact CA-O 3.37Å; L64-V92 PolarHBondContact N-O 2.83Å; V92-L106 HydrophobicContact CB-CD2 4.36Å; V92-L106 HydrophobicContact CG1-CD1 4.23Å; V92-L106 HydrophobicContact CG1-CD2 3.71Å; V92-M110 HydrophobicContact CG2-CE 4.49Å; V92-M110 HydrophobicContact CG2-SD 4.38Å
93	V	97.7	Very high	97.6	Very high	75 Å²	75	58 Å²	58	46%	0.455	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.7	176.9	-173	0	0	0	0	109.7	L64 T91	L64-V93 HydrophobicContact CD2-CG2 4.47Å; L64-V93 CarbonylContact O-C 3.54Å; L64-V93 WeakPolarHBondContact O-CA 3.33Å; T91-V93 HydrophobicContact CG2-CG2 4.04Å
94	R	98.2	Very high	97.7	Very high	85 Å²	85	55.7 Å²	55.7	32%	0.321	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.6	172.9	-70	-67	-178.5	-93.3	1.5	110	L64 V65 G66 V98 L106	L64-R94 PolarHBondContact O-N 2.93Å; V65-R94 WeakPolarHBondContact CA-O 3.4Å; V65-R94 HydrophobicContact CG2-CB 4.36Å; G66-R94 PolarHBondContact N-O 3.32Å; R94-V98 HydrophobicContact CB-CB 4.13Å; R94-V98 HydrophobicContact CB-CG1 4.13Å; R94-V98 HydrophobicContact CB-CG2 4.23Å; R94-V98 HydrophobicContact CG-CG2 4.33Å; R94-L106 HydrophobicContact CG-CD2 4.23Å
95	P	97.9	Very high	97.8	Very high	71 Å²	71	57.5 Å²	57.5	46%	0.461	32%	0.322	S	S	.	.			trans	-64.8	158.1	177.2	29.8	-35.7	0	0	0	110.6	S97 V98	P95-S97 PolarHBondContact O-N 2.92Å; P95-S97 VanDerWaalsContact O-N 3.07Å; P95-V98 WeakPolarHBondContact O-CB 3.43Å; P95-V98 WeakPolarHBondContact O-CG1 3.43Å; P95-V98 PolarHBondContact O-N 3.4Å; P95-V98 VanDerWaalsContact O-N 3.08Å
96	S	97.3	Very high	97.9	Very high	65 Å²	65	58 Å²	58	46%	0.455	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17	174.3	56.4	0	0	0	0	113.2	H128	S96-H128 PolarHBondContact O-CE1 3.26Å
97	S	97.8	Very high	98	Very high	93 Å²	93	56.8 Å²	56.8	65%	0.65	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.1	177.4	62.8	0	0	0	0	114.7	P95	P95-S97 PolarHBondContact O-N 2.92Å; P95-S97 VanDerWaalsContact O-N 3.07Å
98	V	98.4	Very high	98	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.024	33%	0.328	C	S	.	.			trans	-54.8	139.2	179.6	69	0	0	0	0	110.7	V65 R94 P95 E102 H128 I129	V65-V98 HydrophobicContact CG1-CG1 3.57Å; V65-V98 HydrophobicContact CG2-CG1 4.29Å; R94-V98 HydrophobicContact CB-CB 4.13Å; R94-V98 HydrophobicContact CB-CG1 4.13Å; R94-V98 HydrophobicContact CB-CG2 4.23Å; R94-V98 HydrophobicContact CG-CG2 4.33Å; P95-V98 WeakPolarHBondContact O-CB 3.43Å; P95-V98 WeakPolarHBondContact O-CG1 3.43Å; P95-V98 PolarHBondContact O-N 3.4Å; P95-V98 VanDerWaalsContact O-N 3.08Å; V98-E102 HydrophobicContact CG2-CB 3.79Å; V98-E102 WeakPolarHBondContact CG2-OE2 3.35Å; V98-H128 PolarHBondContact O-NE2 3.42Å; V98-I129 HydrophobicContact CG1-CD1 3.96Å
99	S	98.5	Very high	98	Very high	33 Å²	33	63.8 Å²	63.8	23%	0.231	34%	0.342	C	S	.	.			trans	-74.9	160.3	176.7	94.9	0	0	0	0	111	E101 E102 L103	S99-E101 VanDerWaalsContact C-N 3.28Å; S99-E101 PolarHBondContact O-N 2.82Å; S99-E101 PolarHBondContact OG-N 3.49Å; S99-E102 PolarHBondContact N-OE2 3.18Å; S99-E102 WeakPolarHBondContact OG-CG 3.49Å; S99-E102 PolarHBondContact OG-N 3.38Å; S99-L103 PolarHBondContact O-N 3.34Å; S99-L103 VanDerWaalsContact O-N 3.17Å
100	Q	98.6	Very high	98.1	Very high	65 Å²	65	63.5 Å²	63.5	30%	0.304	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-38.1	172.5	-176.1	177.5	-82.4	0	0	111.2	L103 L104 I129	Q100-L103 PolarHBondContact O-N 2.95Å; Q100-L104 HydrophobicContact CG-CD1 3.99Å; Q100-L104 HydrophobicContact CG-CG 4.27Å; Q100-L104 VanDerWaalsContact O-CG 3.22Å; Q100-L104 WeakPolarHBondContact O-CG 3.5Å; Q100-L104 PolarHBondContact O-N 3.12Å; Q100-I129 HydrophobicContact CG-CG2 4.44Å
101	E	98.6	Very high	98.3	Very high	139 Å²	139	60.1 Å²	60.1	65%	0.65	32%	0.321	S	S	*	.	H	α-helix	trans	-62.6	-49.1	179.3	-66.5	127.8	-174.3	0	0	111.2	S99 L103 L104 E105	S99-E101 VanDerWaalsContact C-N 3.28Å; S99-E101 PolarHBondContact O-N 2.82Å; S99-E101 PolarHBondContact OG-N 3.49Å; E101-L103 VanDerWaalsContact C-N 3.26Å; E101-L103 PolarHBondContact O-N 2.59Å; E101-L104 PolarHBondContact O-N 2.89Å; E101-L104 VanDerWaalsContact O-N 3.09Å; E101-E105 WeakPolarHBondContact O-CG 3.41Å; E101-E105 PolarHBondContact O-N 3.15Å
102	E	98.5	Very high	98.3	Very high	105 Å²	105	66 Å²	66	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-38	177.4	-69.4	175.2	139.6	0	0	112	V98 S99 L106	V98-E102 HydrophobicContact CG2-CB 3.79Å; V98-E102 WeakPolarHBondContact CG2-OE2 3.35Å; S99-E102 PolarHBondContact N-OE2 3.18Å; S99-E102 WeakPolarHBondContact OG-CG 3.49Å; S99-E102 PolarHBondContact OG-N 3.38Å; E102-L106 PolarHBondContact O-N 3.07Å; E102-L106 VanDerWaalsContact O-N 3.15Å
103	L	98.6	Very high	98.3	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-69.2	-40.2	176.9	-179.4	59.7	0	0	0	111.9	I63 V65 S99 Q100 E101 L106 I107 L125 I129 V134	I63-L103 HydrophobicContact CD1-CD1 4.48Å; I63-L103 HydrophobicContact CG2-CD1 3.73Å; V65-L103 HydrophobicContact CG2-CD1 4.17Å; V65-L103 HydrophobicContact CG2-CD2 4.29Å; S99-L103 PolarHBondContact O-N 3.34Å; S99-L103 VanDerWaalsContact O-N 3.17Å; Q100-L103 PolarHBondContact O-N 2.95Å; E101-L103 VanDerWaalsContact C-N 3.26Å; E101-L103 PolarHBondContact O-N 2.59Å; L103-L106 PolarHBondContact O-N 3.35Å; L103-I107 HydrophobicContact CD1-CD1 4.36Å; L103-I107 HydrophobicContact CG-CD1 4.14Å; L103-I107 WeakPolarHBondContact O-CD1 3.43Å; L103-I107 VanDerWaalsContact O-CG1 3.28Å; L103-I107 WeakPolarHBondContact O-CG1 3.38Å; L103-I107 PolarHBondContact O-N 3.26Å; L103-I107 VanDerWaalsContact O-N 3.09Å; L103-L125 HydrophobicContact CD2-CD1 4.2Å; L103-I129 HydrophobicContact CD2-CD1 4.07Å; L103-I129 HydrophobicContact CD2-CG2 4.04Å; L103-V134 HydrophobicContact CD2-CG1 4.12Å; L103-V134 HydrophobicContact CD2-CG2 3.66Å; L103-V134 HydrophobicContact CG-CG2 4.39Å
104	L	98.8	Very high	98.1	Very high	51 Å²	51	72 Å²	72	27%	0.267	35%	0.35	S	S	.	.	H	α-helix	trans	-67.7	-39	177.5	-69.4	174.1	0	0	0	111.8	Q100 E101 I107 D108 A137	Q100-L104 HydrophobicContact CG-CD1 3.99Å; Q100-L104 HydrophobicContact CG-CG 4.27Å; Q100-L104 VanDerWaalsContact O-CG 3.22Å; Q100-L104 WeakPolarHBondContact O-CG 3.5Å; Q100-L104 PolarHBondContact O-N 3.12Å; E101-L104 PolarHBondContact O-N 2.89Å; E101-L104 VanDerWaalsContact O-N 3.09Å; L104-I107 PolarHBondContact O-N 3.45Å; L104-D108 WeakPolarHBondContact O-CB 3.45Å; L104-D108 PolarHBondContact O-N 2.93Å; L104-A137 HydrophobicContact CD2-CB 3.37Å
105	E	98.7	Very high	98	Very high	135 Å²	135	74.5 Å²	74.5	63%	0.631	36%	0.36	S	S	*	.	H	α-helix	trans	-61.5	-43.8	174.2	-73.5	176.1	179.3	0	0	111.9	E101 I107 D108 E109	E101-E105 WeakPolarHBondContact O-CG 3.41Å; E101-E105 PolarHBondContact O-N 3.15Å; E105-I107 VanDerWaalsContact C-N 3.35Å; E105-I107 PolarHBondContact O-N 3.25Å; E105-D108 PolarHBondContact O-N 3.13Å; E105-E109 PolarHBondContact O-N 2.94Å
106	L	98.6	Very high	98	Very high	11 Å²	11	71.4 Å²	71.4	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-43.1	174.8	174.3	62.8	0	0	0	112	I63 V92 R94 E102 L103 D108 E109 M110	I63-L106 HydrophobicContact CD1-CD2 3.78Å; I63-L106 HydrophobicContact CD1-CG 3.86Å; I63-L106 HydrophobicContact CG1-CD2 4.02Å; I63-L106 HydrophobicContact CG1-CG 4.47Å; I63-L106 HydrophobicContact CG2-CD2 3.98Å; V92-L106 HydrophobicContact CB-CD2 4.36Å; V92-L106 HydrophobicContact CG1-CD1 4.23Å; V92-L106 HydrophobicContact CG1-CD2 3.71Å; R94-L106 HydrophobicContact CG-CD2 4.23Å; E102-L106 PolarHBondContact O-N 3.07Å; E102-L106 VanDerWaalsContact O-N 3.15Å; L103-L106 PolarHBondContact O-N 3.35Å; L106-D108 VanDerWaalsContact C-N 3.3Å; L106-D108 PolarHBondContact O-N 3.46Å; L106-E109 PolarHBondContact O-N 3.09Å; L106-M110 HydrophobicContact CD1-CG 4.29Å; L106-M110 HydrophobicContact CD1-SD 4.25Å; L106-M110 HydrophobicContact CG-SD 4.37Å; L106-M110 WeakPolarHBondContact O-CG 3.43Å; L106-M110 PolarHBondContact O-N 3.14Å
107	I	98.7	Very high	98	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-42.3	177.6	-70.8	162.1	0	0	0	110.4	I63 L103 L104 E105 M110 N111 L119 V121 V134 A137 I138	I63-I107 HydrophobicContact CD1-CG1 3.57Å; L103-I107 HydrophobicContact CD1-CD1 4.36Å; L103-I107 HydrophobicContact CG-CD1 4.14Å; L103-I107 WeakPolarHBondContact O-CD1 3.43Å; L103-I107 VanDerWaalsContact O-CG1 3.28Å; L103-I107 WeakPolarHBondContact O-CG1 3.38Å; L103-I107 PolarHBondContact O-N 3.26Å; L103-I107 VanDerWaalsContact O-N 3.09Å; L104-I107 PolarHBondContact O-N 3.45Å; E105-I107 VanDerWaalsContact C-N 3.35Å; E105-I107 PolarHBondContact O-N 3.25Å; I107-M110 PolarHBondContact O-N 2.9Å; I107-N111 WeakPolarHBondContact O-CB 3.23Å; I107-N111 PolarHBondContact O-N 3.05Å; I107-N111 PolarHBondContact O-ND2 3.21Å; I107-L119 HydrophobicContact CG2-CD2 4.08Å; I107-V121 HydrophobicContact CD1-CG2 3.89Å; I107-V121 HydrophobicContact CG1-CG2 4.18Å; I107-V134 HydrophobicContact CD1-CG1 3.65Å; I107-A137 HydrophobicContact CD1-CB 4.38Å; I107-A137 HydrophobicContact CG2-CB 3.89Å; I107-A137 WeakPolarHBondContact CG2-O 3.31Å; I107-I138 HydrophobicContact CG2-CG1 4.09Å
108	D	98.6	Very high	98.1	Very high	63 Å²	63	64.8 Å²	64.8	34%	0.337	29%	0.294	S	S	.	.	H	α-helix	trans	-64.4	-39.8	178	-172.4	43.9	0	0	0	112.3	L104 E105 L106 N111 R112	L104-D108 WeakPolarHBondContact O-CB 3.45Å; L104-D108 PolarHBondContact O-N 2.93Å; E105-D108 PolarHBondContact O-N 3.13Å; L106-D108 VanDerWaalsContact C-N 3.3Å; L106-D108 PolarHBondContact O-N 3.46Å; D108-N111 PolarHBondContact O-N 2.69Å; D108-R112 VanDerWaalsContact CG-CZ 3.41Å; D108-R112 WeakPolarHBondContact O-CG 3.34Å; D108-R112 PolarHBondContact O-N 3.38Å; D108-R112 VanDerWaalsContact O-N 3.13Å; D108-R112 IonicContact OD1-CZ 3.34Å; D108-R112 VanDerWaalsContact OD1-CZ 3.23Å; D108-R112 IonicContact OD1-NE 2.98Å; D108-R112 IonicContact OD1-NH1 3.96Å; D108-R112 IonicContact OD1-NH2 3.16Å; D108-R112 PolarHBondContact OD1-NH2 3.17Å; D108-R112 IonicContact OD2-CZ 2.73Å; D108-R112 IonicContact OD2-NH1 2.98Å; D108-R112 PolarHBondContact OD2-NH1 2.65Å; D108-R112 IonicContact OD2-NH2 3.85Å; D108-R112 PolarHBondContact OD2-NH2 3.01Å
109	E	98.4	Very high	98.1	Very high	132 Å²	132	64.6 Å²	64.6	62%	0.617	29%	0.292	S	S	*	.	H	α-helix	trans	-57.9	-51	170.4	-174.6	-173.3	169.2	0	0	111.5	E105 L106 N111 R112 D113	E105-E109 PolarHBondContact O-N 2.94Å; L106-E109 PolarHBondContact O-N 3.09Å; E109-N111 VanDerWaalsContact C-N 3.31Å; E109-N111 PolarHBondContact O-N 3.48Å; E109-R112 PolarHBondContact O-N 3.33Å; E109-R112 VanDerWaalsContact O-N 3.14Å; E109-D113 PolarHBondContact O-N 3.36Å; E109-D113 VanDerWaalsContact O-N 3.09Å
110	M	98.4	Very high	98	Very high	17 Å²	17	63 Å²	63	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-68.3	-29.6	-179.3	-65.6	-174.5	80.3	0	0	112.9	I63 V92 L106 I107 R112 D113 L119 K142	I63-M110 HydrophobicContact CD1-SD 3.77Å; I63-M110 HydrophobicContact CG1-SD 3.73Å; V92-M110 HydrophobicContact CG2-CE 4.49Å; V92-M110 HydrophobicContact CG2-SD 4.38Å; L106-M110 HydrophobicContact CD1-CG 4.29Å; L106-M110 HydrophobicContact CD1-SD 4.25Å; L106-M110 HydrophobicContact CG-SD 4.37Å; L106-M110 WeakPolarHBondContact O-CG 3.43Å; L106-M110 PolarHBondContact O-N 3.14Å; I107-M110 PolarHBondContact O-N 2.9Å; M110-R112 VanDerWaalsContact C-N 3.34Å; M110-D113 PolarHBondContact O-N 3.32Å; M110-L119 HydrophobicContact CB-CD1 4.16Å; M110-L119 HydrophobicContact CB-CD2 3.89Å; M110-L119 HydrophobicContact CE-CD1 3.61Å; M110-L119 HydrophobicContact SD-CD1 3.68Å; M110-K142 PolarHBondContact O-NZ 3.1Å
111	N	98.4	Very high	98	Very high	29 Å²	29	60.3 Å²	60.3	16%	0.155	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-40.1	171.7	-75.9	-26.8	0	0	0	111.3	I107 D108 E109 A137 A139 K142	I107-N111 WeakPolarHBondContact O-CB 3.23Å; I107-N111 PolarHBondContact O-N 3.05Å; I107-N111 PolarHBondContact O-ND2 3.21Å; D108-N111 PolarHBondContact O-N 2.69Å; E109-N111 VanDerWaalsContact C-N 3.31Å; E109-N111 PolarHBondContact O-N 3.48Å; N111-A137 PolarHBondContact ND2-O 2.89Å; N111-A139 HydrophobicContact CB-CB 4.24Å; N111-A139 PolarHBondContact ND2-N 2.85Å; N111-A139 WeakPolarHBondContact OD1-CB 3.31Å; N111-A139 PolarHBondContact OD1-N 2.9Å; N111-K142 WeakPolarHBondContact O-CE 3.37Å; N111-K142 PolarHBondContact O-NZ 3.21Å
112	R	97.8	Very high	97.9	Very high	178 Å²	178	54.6 Å²	54.6	67%	0.672	24%	0.243	S	C	*	.	H	α-helix	trans	-78.2	-19.8	179.2	-67.3	-172.2	-171.1	107.1	10.8	114	D108 E109 M110 W114	D108-R112 VanDerWaalsContact CG-CZ 3.41Å; D108-R112 WeakPolarHBondContact O-CG 3.34Å; D108-R112 PolarHBondContact O-N 3.38Å; D108-R112 VanDerWaalsContact O-N 3.13Å; D108-R112 IonicContact OD1-CZ 3.34Å; D108-R112 VanDerWaalsContact OD1-CZ 3.23Å; D108-R112 IonicContact OD1-NE 2.98Å; D108-R112 IonicContact OD1-NH1 3.96Å; D108-R112 IonicContact OD1-NH2 3.16Å; D108-R112 PolarHBondContact OD1-NH2 3.17Å; D108-R112 IonicContact OD2-CZ 2.73Å; D108-R112 IonicContact OD2-NH1 2.98Å; D108-R112 PolarHBondContact OD2-NH1 2.65Å; D108-R112 IonicContact OD2-NH2 3.85Å; D108-R112 PolarHBondContact OD2-NH2 3.01Å; E109-R112 PolarHBondContact O-N 3.33Å; E109-R112 VanDerWaalsContact O-N 3.14Å; M110-R112 VanDerWaalsContact C-N 3.34Å; R112-W114 PolarHBondContact O-N 3.47Å; R112-W114 VanDerWaalsContact O-N 3.08Å
113	D	97.4	Very high	97.6	Very high	38 Å²	38	51.5 Å²	51.5	20%	0.203	23%	0.229	C	C	.	.			trans	-71.3	104.6	176.2	-169.5	-12.4	0	0	0	111.1	E109 M110 R115 V116 K142	E109-D113 PolarHBondContact O-N 3.36Å; E109-D113 VanDerWaalsContact O-N 3.09Å; M110-D113 PolarHBondContact O-N 3.32Å; D113-R115 PolarHBondContact O-N 2.83Å; D113-R115 VanDerWaalsContact O-N 3.09Å; D113-R115 VanDerWaalsContact OD1-CB 3.23Å; D113-R115 WeakPolarHBondContact OD1-CB 3.2Å; D113-R115 WeakPolarHBondContact OD1-CG 3.24Å; D113-R115 IonicContact OD1-CZ 2.87Å; D113-R115 PolarHBondContact OD1-N 3.11Å; D113-R115 IonicContact OD1-NE 3.8Å; D113-R115 PolarHBondContact OD1-NE 3.33Å; D113-R115 IonicContact OD1-NH2 3.11Å; D113-R115 IonicContact OD2-CZ 3.27Å; D113-R115 IonicContact OD2-NE 2.76Å; D113-R115 PolarHBondContact OD2-NE 2.94Å; D113-R115 VanDerWaalsContact OD2-NE 3.16Å; D113-R115 IonicContact OD2-NH2 3.42Å; D113-R115 PolarHBondContact OD2-NH2 3.3Å; D113-V116 HydrophobicContact CB-CG2 3.95Å; D113-V116 PolarHBondContact O-N 3.14Å; D113-K142 PolarHBondContact O-NZ 3.07Å
114	W	94.9	Very high	97.4	Very high	198 Å²	198	55.7 Å²	55.7	75%	0.75	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.4	178.3	67.1	-86.8	0	0	0	113.6	M56 R112 V116	M56-W114 HydrophobicContact CE-CH2 4.42Å; M56-W114 HydrophobicContact CE-CZ3 4.35Å; M56-W114 HydrophobicContact CG-CZ3 4.46Å; M56-W114 HydrophobicContact SD-CE3 3.99Å; M56-W114 HydrophobicContact SD-CH2 3.43Å; M56-W114 WeakPolarHBondContact SD-CH2 3.33Å; M56-W114 HydrophobicContact SD-CZ3 3.06Å; M56-W114 WeakPolarHBondContact SD-CZ3 3.49Å; R112-W114 PolarHBondContact O-N 3.47Å; R112-W114 VanDerWaalsContact O-N 3.08Å; W114-V116 VanDerWaalsContact C-N 3.35Å
115	R	95.4	Very high	97.2	Very high	137 Å²	137	54 Å²	54	52%	0.517	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-27.7	175.6	-56.9	172.8	-65.5	175.9	4.1	111.8	M56 H59 D113 S117	M56-R115 HydrophobicContact CE-CB 4.37Å; M56-R115 HydrophobicContact CE-CG 4.22Å; H59-R115 WeakPolarHBondContact CB-O 3.31Å; D113-R115 PolarHBondContact O-N 2.83Å; D113-R115 VanDerWaalsContact O-N 3.09Å; D113-R115 VanDerWaalsContact OD1-CB 3.23Å; D113-R115 WeakPolarHBondContact OD1-CB 3.2Å; D113-R115 WeakPolarHBondContact OD1-CG 3.24Å; D113-R115 IonicContact OD1-CZ 2.87Å; D113-R115 PolarHBondContact OD1-N 3.11Å; D113-R115 IonicContact OD1-NE 3.8Å; D113-R115 PolarHBondContact OD1-NE 3.33Å; D113-R115 IonicContact OD1-NH2 3.11Å; D113-R115 IonicContact OD2-CZ 3.27Å; D113-R115 IonicContact OD2-NE 2.76Å; D113-R115 PolarHBondContact OD2-NE 2.94Å; D113-R115 VanDerWaalsContact OD2-NE 3.16Å; D113-R115 IonicContact OD2-NH2 3.42Å; D113-R115 PolarHBondContact OD2-NH2 3.3Å; R115-S117 PolarHBondContact O-N 2.86Å
116	V	97.8	Very high	97.1	Very high	6 Å²	6	49 Å²	49	4%	0.036	23%	0.226	C	C	.	.			trans	-79.6	110.2	179	179.6	0	0	0	0	109.4	D113 W114 G118 L119 K142	D113-V116 HydrophobicContact CB-CG2 3.95Å; D113-V116 PolarHBondContact O-N 3.14Å; W114-V116 VanDerWaalsContact C-N 3.35Å; V116-G118 WeakPolarHBondContact CG1-O 3.43Å; V116-L119 HydrophobicContact CG1-CB 4.4Å; V116-K142 HydrophobicContact CG1-CD 4.38Å; V116-K142 WeakPolarHBondContact O-CD 3.29Å; V116-K142 WeakPolarHBondContact O-CE 3.06Å; V116-K142 PolarHBondContact O-NZ 3.35Å
117	S	97.9	Very high	97	Very high	20 Å²	20	58 Å²	58	14%	0.14	27%	0.268	C	S	.	.			trans	-81.7	-40.6	177.7	-43.1	0	0	0	0	112.1	H59 R115 A317	H59-S117 PolarHBondContact N-OG 3.28Å; H59-S117 WeakPolarHBondContact O-CB 3.29Å; H59-S117 PolarHBondContact O-N 2.65Å; R115-S117 PolarHBondContact O-N 2.86Å; S117-A317 VanDerWaalsContact O-CB 3.23Å; S117-A317 WeakPolarHBondContact O-CB 3.44Å
118	G	98.3	Very high	96.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.7	-179.7	0	0	0	0	0	111.3	H59 L60 G61 V116 K142	H59-G118 PolarHBondContact O-N 2.86Å; L60-G118 WeakPolarHBondContact CA-O 3.13Å; G61-G118 PolarHBondContact N-O 2.89Å; V116-G118 WeakPolarHBondContact CG1-O 3.43Å; G118-K142 CarbonylContact C-O 3.52Å; G118-K142 WeakPolarHBondContact CA-O 3.16Å
119	L	98.5	Very high	96.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137	-178.2	179.5	59.6	0	0	0	109.8	G61 I63 I107 M110 V116 I138 K142	G61-L119 WeakPolarHBondContact O-CA 3.35Å; I63-L119 HydrophobicContact CD1-CD1 4.26Å; I63-L119 HydrophobicContact CG1-CD1 4.31Å; I107-L119 HydrophobicContact CG2-CD2 4.08Å; M110-L119 HydrophobicContact CB-CD1 4.16Å; M110-L119 HydrophobicContact CB-CD2 3.89Å; M110-L119 HydrophobicContact CE-CD1 3.61Å; M110-L119 HydrophobicContact SD-CD1 3.68Å; V116-L119 HydrophobicContact CG1-CB 4.4Å; L119-I138 HydrophobicContact CB-CG2 4.01Å; L119-I138 HydrophobicContact CD2-CG1 4.26Å; L119-I138 HydrophobicContact CD2-CG2 4.15Å; L119-I138 HydrophobicContact CG-CG1 4.39Å; L119-I138 HydrophobicContact CG-CG2 4.19Å; L119-K142 HydrophobicContact CB-CB 4.29Å; L119-K142 PolarHBondContact N-O 3.2Å
120	L	97.5	Very high	96.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.2	167.6	73.7	90.3	0	0	0	112.1	L60 G61 V62 I63 K78 Q122 V144 D145 L310	L60-L120 HydrophobicContact CD1-CD2 4.15Å; G61-L120 PolarHBondContact O-N 2.74Å; V62-L120 HydrophobicContact CG1-CD1 3.78Å; V62-L120 HydrophobicContact CG1-CG 4.36Å; V62-L120 HydrophobicContact CG2-CD1 4.42Å; V62-L120 HydrophobicContact CG2-CD2 4.31Å; V62-L120 HydrophobicContact CG2-CG 4.17Å; I63-L120 PolarHBondContact N-O 3.43Å; K78-L120 HydrophobicContact CD-CD2 4.32Å; L120-Q122 HydrophobicContact CD1-CB 4.46Å; L120-V144 HydrophobicContact CB-CG2 4.23Å; L120-V144 HydrophobicContact CD2-CG2 4.33Å; L120-D145 WeakPolarHBondContact CB-OD2 3.3Å; L120-L310 HydrophobicContact CD2-CD1 3.85Å; L120-L310 HydrophobicContact CD2-CD2 3.76Å; L120-L310 HydrophobicContact CD2-CG 4.34Å
121	V	97.7	Very high	96.8	Very high	7 Å²	7	61 Å²	61	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.9	165.9	-174.9	0	0	0	0	108.6	I63 I107 L123 L125 V134 I138	I63-V121 HydrophobicContact CB-CG1 4.34Å; I63-V121 HydrophobicContact CB-CG2 4.08Å; I63-V121 HydrophobicContact CD1-CG2 4.04Å; I63-V121 HydrophobicContact CG1-CG2 4.49Å; I63-V121 HydrophobicContact CG2-CG1 4.45Å; I107-V121 HydrophobicContact CD1-CG2 3.89Å; I107-V121 HydrophobicContact CG1-CG2 4.18Å; V121-L123 PolarHBondContact O-N 3.36Å; V121-L125 HydrophobicContact CG1-CD1 4.27Å; V121-L125 HydrophobicContact CG1-CD2 3.86Å; V121-V134 HydrophobicContact CB-CG1 3.93Å; V121-V134 HydrophobicContact CG1-CG1 3.96Å; V121-V134 HydrophobicContact CG2-CG1 3.7Å; V121-I138 HydrophobicContact CG2-CD1 4.19Å
122	Q	96.2	Very high	96.6	Very high	20 Å²	20	64.7 Å²	64.7	9%	0.093	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-69.6	120.3	-179.1	-178.5	61.2	51.2	0	0	110.4	I63 L64 V75 L120	I63-Q122 PolarHBondContact O-N 2.75Å; L64-Q122 HydrophobicContact CD1-CB 4.04Å; L64-Q122 HydrophobicContact CD1-CG 3.99Å; V75-Q122 HydrophobicContact CG2-CB 3.9Å; V75-Q122 HydrophobicContact CG2-CG 3.74Å; L120-Q122 HydrophobicContact CD1-CB 4.46Å
123	L	93.7	Very high	96.6	Very high	39 Å²	39	57.9 Å²	57.9	20%	0.204	28%	0.276	C	S	.	.	S	Bend	trans	-92.9	157.4	174.7	-59.6	-174.8	0	0	0	111.7	V121 L125 E131 F147	V121-L123 PolarHBondContact O-N 3.36Å; L123-L125 HydrophobicContact CD2-CD1 4Å; L123-L125 HydrophobicContact CD2-CG 3.78Å; L123-E131 HydrophobicContact CD2-CB 4.36Å; L123-E131 HydrophobicContact CD2-CG 4.04Å; L123-F147 HydrophobicContact CD1-CD2 4.31Å; L123-F147 HydrophobicContact CD1-CE2 4.18Å
124	P	93.1	Very high	96.6	Very high	88 Å²	88	56 Å²	56	57%	0.571	27%	0.266	S	S	*	.	P	Polyproline II helix	cis	-75.1	158.3	-2.6	33	-36	0	0	0	113	E131	P124-E131 VanDerWaalsContact CA-OE1 3.25Å; P124-E131 WeakPolarHBondContact CA-OE1 3.25Å
125	L	95.4	Very high	96.8	Very high	16 Å²	16	47.1 Å²	47.1	8%	0.084	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-96.1	161.3	171.6	-66.6	173.9	0	0	0	111.4	V65 L103 V121 L123 I129 E131 V134	V65-L125 HydrophobicContact CB-CD2 3.73Å; V65-L125 HydrophobicContact CG1-CD2 4.46Å; V65-L125 HydrophobicContact CG2-CD2 3.67Å; L103-L125 HydrophobicContact CD2-CD1 4.2Å; V121-L125 HydrophobicContact CG1-CD1 4.27Å; V121-L125 HydrophobicContact CG1-CD2 3.86Å; L123-L125 HydrophobicContact CD2-CD1 4Å; L123-L125 HydrophobicContact CD2-CG 3.78Å; L125-I129 HydrophobicContact CB-CB 4.34Å; L125-I129 HydrophobicContact CB-CG2 4.41Å; L125-I129 HydrophobicContact CD1-CG2 3.79Å; L125-E131 HydrophobicContact CB-CG 3.95Å; L125-E131 HydrophobicContact CD1-CG 4.12Å; L125-E131 HydrophobicContact CG-CG 4.23Å; L125-E131 PolarHBondContact N-OE1 2.9Å; L125-V134 HydrophobicContact CD1-CB 4.02Å; L125-V134 HydrophobicContact CD1-CG1 3.92Å; L125-V134 HydrophobicContact CD1-CG2 3.82Å
126	P	96.3	Very high	96.9	Very high	29 Å²	29	43 Å²	43	19%	0.188	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-51.5	146.5	168.3	-28.5	36.5	0	0	0	113	V65 H128 I129	V65-P126 HydrophobicContact CG1-CG 3.76Å; P126-H128 WeakPolarHBondContact CB-CE1 3.37Å; P126-H128 WeakPolarHBondContact CB-ND1 3.26Å; P126-H128 PolarHBondContact O-N 3.46Å; P126-H128 VanDerWaalsContact O-N 3.09Å; P126-I129 PolarHBondContact O-N 3.4Å
127	E	96.3	Very high	96.9	Very high	202 Å²	202	44.1 Å²	44.1	94%	0.944	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.5	-172.3	-65.7	-171.6	164.3	0	0	114.5	I129	E127-I129 PolarHBondContact O-N 3.38Å
128	H	97.4	Very high	97	Very high	108 Å²	108	43.4 Å²	43.4	50%	0.5	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-7	178.9	68.8	-76	0	0	0	113.7	S96 V98 P126	S96-H128 PolarHBondContact O-CE1 3.26Å; V98-H128 PolarHBondContact O-NE2 3.42Å; P126-H128 WeakPolarHBondContact CB-CE1 3.37Å; P126-H128 WeakPolarHBondContact CB-ND1 3.26Å; P126-H128 PolarHBondContact O-N 3.46Å; P126-H128 VanDerWaalsContact O-N 3.09Å
129	I	98.1	Very high	97	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.041	23%	0.233	C	C	.	.	S	Bend	trans	-105	130.4	179.5	-61.4	178.8	0	0	0	110	V98 Q100 L103 L125 P126 E127 E131 V134	V98-I129 HydrophobicContact CG1-CD1 3.96Å; Q100-I129 HydrophobicContact CG-CG2 4.44Å; L103-I129 HydrophobicContact CD2-CD1 4.07Å; L103-I129 HydrophobicContact CD2-CG2 4.04Å; L125-I129 HydrophobicContact CB-CB 4.34Å; L125-I129 HydrophobicContact CB-CG2 4.41Å; L125-I129 HydrophobicContact CD1-CG2 3.79Å; P126-I129 PolarHBondContact O-N 3.4Å; E127-I129 PolarHBondContact O-N 3.38Å; I129-E131 PolarHBondContact O-N 2.9Å; I129-E131 VanDerWaalsContact O-N 3.14Å; I129-V134 HydrophobicContact CG2-CG2 3.57Å
130	N	97.9	Very high	97	Very high	87 Å²	87	45.7 Å²	45.7	47%	0.465	24%	0.243	S	C	.	.			trans	-78.2	99.9	174.4	-173.1	-32.6	0	0	0	111	R132 A133 V134	N130-R132 PolarHBondContact O-N 3.46Å; N130-R132 VanDerWaalsContact O-N 3.12Å; N130-R132 WeakPolarHBondContact OD1-CB 3.48Å; N130-R132 PolarHBondContact OD1-N 3.41Å; N130-A133 HydrophobicContact CB-CB 3.97Å; N130-A133 WeakPolarHBondContact O-CB 3.32Å; N130-A133 PolarHBondContact O-N 3.1Å; N130-A133 PolarHBondContact OD1-N 3.28Å; N130-A133 VanDerWaalsContact OD1-N 3.14Å; N130-V134 PolarHBondContact O-N 3.46Å; N130-V134 VanDerWaalsContact O-N 3.11Å
131	E	95.9	Very high	97	Very high	72 Å²	72	51.5 Å²	51.5	34%	0.336	27%	0.27	S	S	.	.	H	α-helix	trans	-52.6	-35.2	177.9	-66.2	-171.6	161.1	0	0	113.7	L123 P124 L125 I129 V134 C135	L123-E131 HydrophobicContact CD2-CB 4.36Å; L123-E131 HydrophobicContact CD2-CG 4.04Å; P124-E131 VanDerWaalsContact CA-OE1 3.25Å; P124-E131 WeakPolarHBondContact CA-OE1 3.25Å; L125-E131 HydrophobicContact CB-CG 3.95Å; L125-E131 HydrophobicContact CD1-CG 4.12Å; L125-E131 HydrophobicContact CG-CG 4.23Å; L125-E131 PolarHBondContact N-OE1 2.9Å; I129-E131 PolarHBondContact O-N 2.9Å; I129-E131 VanDerWaalsContact O-N 3.14Å; E131-V134 PolarHBondContact O-N 3.49Å; E131-C135 WeakPolarHBondContact O-CB 3.39Å; E131-C135 PolarHBondContact O-N 3.17Å; E131-C135 PolarHBondContact O-SG 3.3Å
132	R	95.3	Very high	97	Very high	106 Å²	106	52.1 Å²	52.1	40%	0.4	27%	0.272	S	S	.	.	H	α-helix	trans	-70.3	-38.9	180	-178.7	55.6	57.2	-174.5	-5.2	111.4	N130 V134 N136 F147	N130-R132 PolarHBondContact O-N 3.46Å; N130-R132 VanDerWaalsContact O-N 3.12Å; N130-R132 WeakPolarHBondContact OD1-CB 3.48Å; N130-R132 PolarHBondContact OD1-N 3.41Å; R132-V134 VanDerWaalsContact C-N 3.34Å; R132-N136 WeakPolarHBondContact O-CB 3.48Å; R132-N136 VanDerWaalsContact O-CG 3.31Å; R132-N136 PolarHBondContact O-N 3.07Å; R132-N136 PolarHBondContact O-ND2 3.38Å; R132-F147 PolarHBondContact NH1-O 3.38Å
133	A	97.8	Very high	97.1	Very high	34 Å²	34	51.2 Å²	51.2	28%	0.281	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-44.8	174.5	0	0	0	0	0	110.3	N130 N136 A137	N130-A133 HydrophobicContact CB-CB 3.97Å; N130-A133 WeakPolarHBondContact O-CB 3.32Å; N130-A133 PolarHBondContact O-N 3.1Å; N130-A133 PolarHBondContact OD1-N 3.28Å; N130-A133 VanDerWaalsContact OD1-N 3.14Å; A133-N136 CarbonylContact O-C 3.57Å; A133-N136 PolarHBondContact O-N 2.88Å; A133-A137 PolarHBondContact O-N 3.16Å
134	V	98.1	Very high	97.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-49.6	176.5	175.6	0	0	0	0	112	L103 I107 V121 L125 I129 N130 E131 R132 N136 A137	L103-V134 HydrophobicContact CD2-CG1 4.12Å; L103-V134 HydrophobicContact CD2-CG2 3.66Å; L103-V134 HydrophobicContact CG-CG2 4.39Å; I107-V134 HydrophobicContact CD1-CG1 3.65Å; V121-V134 HydrophobicContact CB-CG1 3.93Å; V121-V134 HydrophobicContact CG1-CG1 3.96Å; V121-V134 HydrophobicContact CG2-CG1 3.7Å; L125-V134 HydrophobicContact CD1-CB 4.02Å; L125-V134 HydrophobicContact CD1-CG1 3.92Å; L125-V134 HydrophobicContact CD1-CG2 3.82Å; I129-V134 HydrophobicContact CG2-CG2 3.57Å; N130-V134 PolarHBondContact O-N 3.46Å; N130-V134 VanDerWaalsContact O-N 3.11Å; E131-V134 PolarHBondContact O-N 3.49Å; R132-V134 VanDerWaalsContact C-N 3.34Å; V134-N136 PolarHBondContact O-N 3.02Å; V134-A137 WeakPolarHBondContact O-CB 3.38Å; V134-A137 PolarHBondContact O-N 3.09Å
135	C	97.4	Very high	97.5	Very high	10 Å²	10	46 Å²	46	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-35.5	178	-66.3	0	0	0	0	112.3	E131 A137 F147	E131-C135 WeakPolarHBondContact O-CB 3.39Å; E131-C135 PolarHBondContact O-N 3.17Å; E131-C135 PolarHBondContact O-SG 3.3Å; C135-A137 VanDerWaalsContact C-N 3.29Å; C135-F147 HydrophobicContact CB-CB 3.97Å
136	N	98.3	Very high	97.6	Very high	50 Å²	50	45.3 Å²	45.3	27%	0.267	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.9	178.3	-73.4	-15.2	0	0	0	113.6	R132 A133 V134 H148 I149	R132-N136 WeakPolarHBondContact O-CB 3.48Å; R132-N136 VanDerWaalsContact O-CG 3.31Å; R132-N136 PolarHBondContact O-N 3.07Å; R132-N136 PolarHBondContact O-ND2 3.38Å; A133-N136 CarbonylContact O-C 3.57Å; A133-N136 PolarHBondContact O-N 2.88Å; V134-N136 PolarHBondContact O-N 3.02Å; N136-H148 VanDerWaalsContact CA-CD2 3.44Å; N136-H148 WeakPolarHBondContact CA-CD2 3.29Å; N136-H148 PolarHBondContact O-CD2 2.96Å; N136-H148 PolarHBondContact O-NE2 3.11Å; N136-I149 WeakPolarHBondContact OD1-CB 3.31Å; N136-I149 PolarHBondContact OD1-N 3.22Å
137	A	98.6	Very high	97.6	Very high	30 Å²	30	45.4 Å²	45.4	25%	0.248	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-21.8	174.6	0	0	0	0	0	112.2	L104 I107 N111 A133 V134 C135 A139	L104-A137 HydrophobicContact CD2-CB 3.37Å; I107-A137 HydrophobicContact CD1-CB 4.38Å; I107-A137 HydrophobicContact CG2-CB 3.89Å; I107-A137 WeakPolarHBondContact CG2-O 3.31Å; N111-A137 PolarHBondContact ND2-O 2.89Å; A133-A137 PolarHBondContact O-N 3.16Å; V134-A137 WeakPolarHBondContact O-CB 3.38Å; V134-A137 PolarHBondContact O-N 3.09Å; C135-A137 VanDerWaalsContact C-N 3.29Å; A137-A139 PolarHBondContact O-N 3.35Å
138	I	98.8	Very high	97.7	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.031	19%	0.189	C	C	.	.	S	Bend	trans	-68.2	130.6	175	-58.7	173.9	0	0	0	108.9	I107 L119 V121 D143 H148	I107-I138 HydrophobicContact CG2-CG1 4.09Å; L119-I138 HydrophobicContact CB-CG2 4.01Å; L119-I138 HydrophobicContact CD2-CG1 4.26Å; L119-I138 HydrophobicContact CD2-CG2 4.15Å; L119-I138 HydrophobicContact CG-CG1 4.39Å; L119-I138 HydrophobicContact CG-CG2 4.19Å; V121-I138 HydrophobicContact CG2-CD1 4.19Å; I138-D143 HydrophobicContact CG2-CB 3.85Å; I138-H148 PolarHBondContact O-CD2 3.38Å
139	A	98.5	Very high	97.8	Very high	16 Å²	16	36.6 Å²	36.6	13%	0.132	19%	0.191	C	C	.	.			trans	-55.8	129.2	176.3	0	0	0	0	0	110.4	N111 A137 E141 K142 D143	N111-A139 HydrophobicContact CB-CB 4.24Å; N111-A139 PolarHBondContact ND2-N 2.85Å; N111-A139 WeakPolarHBondContact OD1-CB 3.31Å; N111-A139 PolarHBondContact OD1-N 2.9Å; A137-A139 PolarHBondContact O-N 3.35Å; A139-E141 HydrophobicContact CB-CG 4.42Å; A139-E141 PolarHBondContact O-N 2.81Å; A139-E141 VanDerWaalsContact O-N 3.09Å; A139-K142 HydrophobicContact CB-CB 4.41Å; A139-K142 HydrophobicContact CB-CG 4.3Å; A139-K142 CarbonylContact O-C 3.55Å; A139-K142 WeakPolarHBondContact O-CA 3.35Å; A139-K142 PolarHBondContact O-N 3.24Å; A139-D143 PolarHBondContact O-N 2.94Å
140	P	98.3	Very high	97.8	Very high	32 Å²	32	39 Å²	39	21%	0.208	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-35.8	-174.5	-25.9	30.6	0	0	0	114.6	K142 D143 V150 N151	P140-K142 VanDerWaalsContact C-N 3.3Å; P140-D143 PolarHBondContact O-N 3.47Å; P140-V150 HydrophobicContact CB-CB 4.14Å; P140-V150 HydrophobicContact CB-CG1 4.12Å; P140-V150 HydrophobicContact CG-CB 4.09Å; P140-V150 HydrophobicContact CG-CG1 4.36Å; P140-V150 HydrophobicContact CG-CG2 4.23Å; P140-N151 PolarHBondContact O-ND2 3.3Å
141	E	97.8	Very high	97.8	Very high	122 Å²	122	35.2 Å²	35.2	57%	0.57	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-23	178.4	59.7	-87.8	-156.7	0	0	113.5	A139 A317	A139-E141 HydrophobicContact CB-CG 4.42Å; A139-E141 PolarHBondContact O-N 2.81Å; A139-E141 VanDerWaalsContact O-N 3.09Å; E141-A317 WeakPolarHBondContact O-CB 3.46Å
142	K	98.5	Very high	97.9	Very high	20 Å²	20	33 Å²	33	9%	0.087	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-8.9	176.1	-57.3	-165.8	-174.5	-166.8	0	113.4	M110 N111 D113 V116 G118 L119 A139 P140 V144	M110-K142 PolarHBondContact O-NZ 3.1Å; N111-K142 WeakPolarHBondContact O-CE 3.37Å; N111-K142 PolarHBondContact O-NZ 3.21Å; D113-K142 PolarHBondContact O-NZ 3.07Å; V116-K142 HydrophobicContact CG1-CD 4.38Å; V116-K142 WeakPolarHBondContact O-CD 3.29Å; V116-K142 WeakPolarHBondContact O-CE 3.06Å; V116-K142 PolarHBondContact O-NZ 3.35Å; G118-K142 CarbonylContact C-O 3.52Å; G118-K142 WeakPolarHBondContact CA-O 3.16Å; L119-K142 HydrophobicContact CB-CB 4.29Å; L119-K142 PolarHBondContact N-O 3.2Å; A139-K142 HydrophobicContact CB-CB 4.41Å; A139-K142 HydrophobicContact CB-CG 4.3Å; A139-K142 CarbonylContact O-C 3.55Å; A139-K142 WeakPolarHBondContact O-CA 3.35Å; A139-K142 PolarHBondContact O-N 3.24Å; P140-K142 VanDerWaalsContact C-N 3.3Å; K142-V144 VanDerWaalsContact C-N 3.32Å; K142-V144 PolarHBondContact O-N 3.42Å
143	D	98.4	Very high	98.1	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-71.3	80.2	-177.3	168.3	39.2	0	0	0	112.2	I138 A139 P140 D145 G146 F147 H148 N151 M162	I138-D143 HydrophobicContact CG2-CB 3.85Å; A139-D143 PolarHBondContact O-N 2.94Å; P140-D143 PolarHBondContact O-N 3.47Å; D143-D145 VanDerWaalsContact C-N 3.25Å; D143-D145 PolarHBondContact O-N 3.28Å; D143-G146 PolarHBondContact O-N 3.4Å; D143-G146 VanDerWaalsContact O-N 3.08Å; D143-G146 PolarHBondContact OD1-N 3.31Å; D143-G146 WeakPolarHBondContact OD2-CA 3.47Å; D143-G146 PolarHBondContact OD2-N 3.33Å; D143-F147 PolarHBondContact OD1-N 2.84Å; D143-F147 VanDerWaalsContact OD1-N 3.09Å; D143-F147 PolarHBondContact OD2-N 2.98Å; D143-H148 HydrophobicContact CB-CB 4.06Å; D143-H148 WeakPolarHBondContact OD2-CB 3.47Å; D143-H148 PolarHBondContact OD2-N 2.88Å; D143-N151 WeakPolarHBondContact CB-ND2 3.31Å; D143-N151 PolarHBondContact OD2-ND2 3.04Å; D143-M162 WeakPolarHBondContact O-CB 3.46Å; D143-M162 WeakPolarHBondContact O-CG 3.41Å
144	V	98.2	Very high	98.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-16	-176.9	-67.6	0	0	0	0	113.7	L60 L120 K142 L310 N313 A317	L60-V144 HydrophobicContact CD1-CG2 3.82Å; L120-V144 HydrophobicContact CB-CG2 4.23Å; L120-V144 HydrophobicContact CD2-CG2 4.33Å; K142-V144 VanDerWaalsContact C-N 3.32Å; K142-V144 PolarHBondContact O-N 3.42Å; V144-L310 HydrophobicContact CB-CD1 4.04Å; V144-L310 HydrophobicContact CG2-CD1 3.73Å; V144-N313 HydrophobicContact CB-CB 4Å; V144-N313 HydrophobicContact CG1-CB 4.26Å; V144-N313 WeakPolarHBondContact O-CB 3.22Å; V144-N313 PolarHBondContact O-ND2 3.37Å; V144-A317 HydrophobicContact CG1-CB 4.21Å
145	D	95.8	Very high	98.1	Very high	18 Å²	18	31.7 Å²	31.7	10%	0.096	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-11.9	170.4	-94.8	-29.9	0	0	0	112.1	L120 D143 F147 P164	L120-D145 WeakPolarHBondContact CB-OD2 3.3Å; D143-D145 VanDerWaalsContact C-N 3.25Å; D143-D145 PolarHBondContact O-N 3.28Å; D145-F147 VanDerWaalsContact C-N 3.32Å; D145-F147 HydrophobicContact CB-CD2 3.75Å; D145-F147 HydrophobicContact CB-CE2 3.65Å; D145-F147 HydrophobicContact CB-CG 4.22Å; D145-F147 HydrophobicContact CB-CZ 4.06Å; D145-F147 VanDerWaalsContact O-CD1 3.25Å; D145-F147 WeakPolarHBondContact O-CD1 3.38Å; D145-F147 VanDerWaalsContact O-CE1 3.26Å; D145-F147 WeakPolarHBondContact O-CE1 3.26Å; D145-F147 PolarHBondContact O-N 3.3Å; D145-P164 WeakPolarHBondContact O-CA 3.28Å; D145-P164 VanDerWaalsContact O-CB 3.29Å; D145-P164 WeakPolarHBondContact O-CB 3.47Å
146	G	97.4	Very high	98.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.			trans	69.2	24.8	174.4	0	0	0	0	0	114.1	D143 I152 M162	D143-G146 PolarHBondContact O-N 3.4Å; D143-G146 VanDerWaalsContact O-N 3.08Å; D143-G146 PolarHBondContact OD1-N 3.31Å; D143-G146 WeakPolarHBondContact OD2-CA 3.47Å; D143-G146 PolarHBondContact OD2-N 3.33Å; G146-I152 WeakPolarHBondContact O-CD1 3.11Å; G146-I152 WeakPolarHBondContact O-CG1 3.38Å; G146-M162 VanDerWaalsContact CA-O 3.25Å; G146-M162 WeakPolarHBondContact CA-O 3.32Å
147	F	97.6	Very high	98.2	Very high	31 Å²	31	37.4 Å²	37.4	14%	0.136	21%	0.208	C	C	.	.			trans	-94.1	-14	-174.4	-61.8	-25.9	0	0	0	114.5	L123 R132 C135 D143 D145 P164 N194	L123-F147 HydrophobicContact CD1-CD2 4.31Å; L123-F147 HydrophobicContact CD1-CE2 4.18Å; R132-F147 PolarHBondContact NH1-O 3.38Å; C135-F147 HydrophobicContact CB-CB 3.97Å; D143-F147 PolarHBondContact OD1-N 2.84Å; D143-F147 VanDerWaalsContact OD1-N 3.09Å; D143-F147 PolarHBondContact OD2-N 2.98Å; D145-F147 VanDerWaalsContact C-N 3.32Å; D145-F147 HydrophobicContact CB-CD2 3.75Å; D145-F147 HydrophobicContact CB-CE2 3.65Å; D145-F147 HydrophobicContact CB-CG 4.22Å; D145-F147 HydrophobicContact CB-CZ 4.06Å; D145-F147 VanDerWaalsContact O-CD1 3.25Å; D145-F147 WeakPolarHBondContact O-CD1 3.38Å; D145-F147 VanDerWaalsContact O-CE1 3.26Å; D145-F147 WeakPolarHBondContact O-CE1 3.26Å; D145-F147 PolarHBondContact O-N 3.3Å; F147-P164 HydrophobicContact CD1-CB 4.31Å; F147-P164 HydrophobicContact CD1-CG 4.28Å; F147-P164 HydrophobicContact CE1-CB 3.85Å; F147-P164 HydrophobicContact CE1-CG 4.29Å; F147-N194 HydrophobicContact CD1-CB 4.11Å; F147-N194 HydrophobicContact CE1-CB 3.34Å; F147-N194 HydrophobicContact CZ-CB 3.64Å
148	H	98.5	Very high	98.1	Very high	19 Å²	19	36.6 Å²	36.6	9%	0.088	20%	0.2	C	C	.	.	S	Bend	trans	-60.8	138.1	176.2	-170.8	-79.5	0	0	0	110	N136 I138 D143 V150 N151 I152	N136-H148 VanDerWaalsContact CA-CD2 3.44Å; N136-H148 WeakPolarHBondContact CA-CD2 3.29Å; N136-H148 PolarHBondContact O-CD2 2.96Å; N136-H148 PolarHBondContact O-NE2 3.11Å; I138-H148 PolarHBondContact O-CD2 3.38Å; D143-H148 HydrophobicContact CB-CB 4.06Å; D143-H148 WeakPolarHBondContact OD2-CB 3.47Å; D143-H148 PolarHBondContact OD2-N 2.88Å; H148-V150 VanDerWaalsContact CE1-CG2 3.49Å; H148-V150 WeakPolarHBondContact CE1-CG2 3.45Å; H148-V150 WeakPolarHBondContact ND1-CB 3.3Å; H148-V150 PolarHBondContact ND1-N 3.06Å; H148-V150 PolarHBondContact O-N 3.18Å; H148-V150 VanDerWaalsContact O-N 3.11Å; H148-N151 PolarHBondContact O-N 3.45Å; H148-I152 PolarHBondContact O-N 3.41Å
149	I	97.9	Very high	98.1	Very high	106 Å²	106	40.2 Å²	40.2	54%	0.544	22%	0.217	S	C	.	.	H	α-helix	trans	-55	-34.5	-176.3	-169.4	168.6	0	0	0	113.3	N136 G153	N136-I149 WeakPolarHBondContact OD1-CB 3.31Å; N136-I149 PolarHBondContact OD1-N 3.22Å; I149-G153 WeakPolarHBondContact O-CA 3.39Å; I149-G153 PolarHBondContact O-N 3.28Å
150	V	98.5	Very high	98	Very high	59 Å²	59	48 Å²	48	36%	0.358	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-45	174.3	172.8	0	0	0	0	111.7	P140 H148 G153 K154	P140-V150 HydrophobicContact CB-CB 4.14Å; P140-V150 HydrophobicContact CB-CG1 4.12Å; P140-V150 HydrophobicContact CG-CB 4.09Å; P140-V150 HydrophobicContact CG-CG1 4.36Å; P140-V150 HydrophobicContact CG-CG2 4.23Å; H148-V150 VanDerWaalsContact CE1-CG2 3.49Å; H148-V150 WeakPolarHBondContact CE1-CG2 3.45Å; H148-V150 WeakPolarHBondContact ND1-CB 3.3Å; H148-V150 PolarHBondContact ND1-N 3.06Å; H148-V150 PolarHBondContact O-N 3.18Å; H148-V150 VanDerWaalsContact O-N 3.11Å; V150-G153 PolarHBondContact O-N 2.91Å; V150-K154 HydrophobicContact CG1-CD 4.11Å; V150-K154 HydrophobicContact CG1-CG 4.49Å; V150-K154 WeakPolarHBondContact O-CB 3.41Å; V150-K154 VanDerWaalsContact O-CG 3.27Å; V150-K154 WeakPolarHBondContact O-CG 3.43Å; V150-K154 PolarHBondContact O-N 3.34Å
151	N	98.6	Very high	97.9	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-68.3	-40.3	179.3	-80.1	-41.9	0	0	0	112	P140 D143 H148 L155 S161 M162	P140-N151 PolarHBondContact O-ND2 3.3Å; D143-N151 WeakPolarHBondContact CB-ND2 3.31Å; D143-N151 PolarHBondContact OD2-ND2 3.04Å; H148-N151 PolarHBondContact O-N 3.45Å; N151-L155 WeakPolarHBondContact O-CB 3.32Å; N151-L155 PolarHBondContact O-N 3.38Å; N151-S161 WeakPolarHBondContact O-CB 3.37Å; N151-S161 PolarHBondContact O-OG 3.47Å; N151-M162 PolarHBondContact OD1-N 2.91Å
152	I	98.2	Very high	97.9	Very high	25 Å²	25	42.5 Å²	42.5	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-42.8	173.6	-65.9	-62.7	0	0	0	111.3	G146 H148 L155 C156 P164 M197 P198	G146-I152 WeakPolarHBondContact O-CD1 3.11Å; G146-I152 WeakPolarHBondContact O-CG1 3.38Å; H148-I152 PolarHBondContact O-N 3.41Å; I152-L155 WeakPolarHBondContact O-CB 3.49Å; I152-L155 PolarHBondContact O-N 3.5Å; I152-C156 PolarHBondContact O-N 2.93Å; I152-C156 PolarHBondContact O-SG 3.19Å; I152-P164 HydrophobicContact CD1-CG 4.04Å; I152-M197 HydrophobicContact CD1-CE 4.39Å; I152-M197 HydrophobicContact CG2-CE 3.76Å; I152-P198 HydrophobicContact CD1-CG 4.37Å
153	G	98.4	Very high	97.9	Very high	30 Å²	30	42.6 Å²	42.6	31%	0.309	22%	0.219	S	C	.	.	H	α-helix	trans	-60.5	-48.2	177.2	0	0	0	0	0	111.7	I149 V150 L155 C156 L157	I149-G153 WeakPolarHBondContact O-CA 3.39Å; I149-G153 PolarHBondContact O-N 3.28Å; V150-G153 PolarHBondContact O-N 2.91Å; G153-L155 VanDerWaalsContact C-N 3.34Å; G153-L155 PolarHBondContact O-N 2.77Å; G153-C156 PolarHBondContact O-N 3.47Å; G153-L157 WeakPolarHBondContact O-CG 3.5Å; G153-L157 PolarHBondContact O-N 3.49Å; G153-L157 VanDerWaalsContact O-N 3.07Å
154	K	98.5	Very high	97.9	Very high	83 Å²	83	42.6 Å²	42.6	36%	0.361	22%	0.219	S	C	.	.	H	α-helix	trans	-59.4	-42.5	173.8	-74	177.3	176.2	-173.8	0	112.1	V150 C156 L157 D158 Q159	V150-K154 HydrophobicContact CG1-CD 4.11Å; V150-K154 HydrophobicContact CG1-CG 4.49Å; V150-K154 WeakPolarHBondContact O-CB 3.41Å; V150-K154 VanDerWaalsContact O-CG 3.27Å; V150-K154 WeakPolarHBondContact O-CG 3.43Å; V150-K154 PolarHBondContact O-N 3.34Å; K154-C156 VanDerWaalsContact C-N 3.34Å; K154-C156 PolarHBondContact O-N 2.81Å; K154-L157 CarbonylContact O-C 3.15Å; K154-L157 PolarHBondContact O-N 3.16Å; K154-L157 VanDerWaalsContact O-N 3.13Å; K154-D158 PolarHBondContact O-N 3.42Å; K154-D158 VanDerWaalsContact O-N 3.15Å; K154-Q159 HydrophobicContact CB-CB 4Å; K154-Q159 HydrophobicContact CG-CB 4.3Å; K154-Q159 PolarHBondContact O-N 2.86Å
155	L	98.3	Very high	97.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-44.9	175	173.6	65	0	0	0	111.7	N151 I152 G153 L157 D158 V163 P198 M201 L202	N151-L155 WeakPolarHBondContact O-CB 3.32Å; N151-L155 PolarHBondContact O-N 3.38Å; I152-L155 WeakPolarHBondContact O-CB 3.49Å; I152-L155 PolarHBondContact O-N 3.5Å; G153-L155 VanDerWaalsContact C-N 3.34Å; G153-L155 PolarHBondContact O-N 2.77Å; L155-L157 PolarHBondContact O-N 2.9Å; L155-D158 PolarHBondContact O-N 3.36Å; L155-V163 HydrophobicContact CD1-CG2 4.24Å; L155-P198 HydrophobicContact CD2-CB 3.71Å; L155-P198 HydrophobicContact CD2-CG 4.43Å; L155-M201 HydrophobicContact CG-CB 4.47Å; L155-L202 HydrophobicContact CD1-CD2 3.64Å; L155-L202 HydrophobicContact CD1-CG 4.16Å
156	C	98.3	Very high	98	Very high	58 Å²	58	43.2 Å²	43.2	39%	0.392	22%	0.224	S	C	.	.	H	α-helix	trans	-68.4	-19.5	178.2	-67.3	0	0	0	0	113.5	I152 G153 K154	I152-C156 PolarHBondContact O-N 2.93Å; I152-C156 PolarHBondContact O-SG 3.19Å; G153-C156 PolarHBondContact O-N 3.47Å; K154-C156 VanDerWaalsContact C-N 3.34Å; K154-C156 PolarHBondContact O-N 2.81Å
157	L	98.4	Very high	98	Very high	122 Å²	122	43.2 Å²	43.2	64%	0.639	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	11.5	177.2	-65.1	175.6	0	0	0	112.6	G153 K154 L155 Q159	G153-L157 WeakPolarHBondContact O-CG 3.5Å; G153-L157 PolarHBondContact O-N 3.49Å; G153-L157 VanDerWaalsContact O-N 3.07Å; K154-L157 CarbonylContact O-C 3.15Å; K154-L157 PolarHBondContact O-N 3.16Å; K154-L157 VanDerWaalsContact O-N 3.13Å; L155-L157 PolarHBondContact O-N 2.9Å; L157-Q159 HydrophobicContact CB-CG 4.22Å; L157-Q159 PolarHBondContact O-N 2.87Å; L157-Q159 VanDerWaalsContact O-N 3.16Å
158	D	98	Very high	98.1	Very high	14 Å²	14	42.1 Å²	42.1	8%	0.075	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	28	-177.5	-60.3	-40.2	0	0	0	115.5	K154 L155 T205 H209 R211	K154-D158 PolarHBondContact O-N 3.42Å; K154-D158 VanDerWaalsContact O-N 3.15Å; L155-D158 PolarHBondContact O-N 3.36Å; D158-T205 WeakPolarHBondContact OD1-CB 3.27Å; D158-T205 WeakPolarHBondContact OD1-CG2 3.49Å; D158-T205 PolarHBondContact OD1-OG1 3.43Å; D158-T205 WeakPolarHBondContact OD2-CB 3.38Å; D158-T205 VanDerWaalsContact OD2-CG2 3.32Å; D158-T205 WeakPolarHBondContact OD2-CG2 3.33Å; D158-H209 HydrophobicContact CB-CB 3.51Å; D158-H209 WeakPolarHBondContact CB-ND1 3.43Å; D158-H209 IonicContact OD2-CE1 3.56Å; D158-H209 IonicContact OD2-CG 3.84Å; D158-H209 IonicContact OD2-ND1 2.75Å; D158-H209 PolarHBondContact OD2-ND1 2.87Å; D158-R211 WeakPolarHBondContact O-CB 3.45Å; D158-R211 PolarHBondContact O-N 3.08Å; D158-R211 IonicContact OD1-CZ 3.69Å; D158-R211 IonicContact OD1-NE 3.59Å; D158-R211 IonicContact OD1-NH2 2.73Å; D158-R211 PolarHBondContact OD1-NH2 3.36Å
159	Q	98.2	Very high	98.1	Very high	82 Å²	82	41.2 Å²	41.2	38%	0.383	22%	0.217	S	C	.	.			trans	-90.4	160.7	174.4	-65.1	179	-26.6	0	0	110.7	K154 L157 S161 E210	K154-Q159 HydrophobicContact CB-CB 4Å; K154-Q159 HydrophobicContact CG-CB 4.3Å; K154-Q159 PolarHBondContact O-N 2.86Å; L157-Q159 HydrophobicContact CB-CG 4.22Å; L157-Q159 PolarHBondContact O-N 2.87Å; L157-Q159 VanDerWaalsContact O-N 3.16Å; Q159-S161 PolarHBondContact O-N 3.18Å; Q159-E210 WeakPolarHBondContact CA-OE2 3.48Å
160	R	96	Very high	98.1	Very high	179 Å²	179	36.3 Å²	36.3	68%	0.675	19%	0.192	S	C	*	.			trans	-62.6	126.9	172.8	-72.7	174.4	-173.4	-178.7	1.8	110.8	E210	R160-E210 WeakPolarHBondContact CB-OE1 3.18Å; R160-E210 WeakPolarHBondContact CD-OE1 3.28Å; R160-E210 HydrophobicContact CG-CG 4.02Å; R160-E210 WeakPolarHBondContact CG-OE1 3.48Å; R160-E210 PolarHBondContact N-OE2 2.84Å; R160-E210 IonicContact NE-OE1 3.56Å
161	S	96.8	Very high	98.1	Very high	29 Å²	29	35.3 Å²	35.3	20%	0.203	18%	0.182	C	C	.	.			trans	-152.9	169.5	177.7	68.6	0	0	0	0	112.2	N151 Q159 V163	N151-S161 WeakPolarHBondContact O-CB 3.37Å; N151-S161 PolarHBondContact O-OG 3.47Å; Q159-S161 PolarHBondContact O-N 3.18Å; S161-V163 PolarHBondContact O-N 2.81Å
162	M	97.8	Very high	98.1	Very high	9 Å²	9	35.9 Å²	35.9	4%	0.044	18%	0.184	C	C	.	.			trans	-71.5	106.2	164.1	-62.5	-61.3	175.3	0	0	108.7	D143 G146 N151 N313 T316 A317	D143-M162 WeakPolarHBondContact O-CB 3.46Å; D143-M162 WeakPolarHBondContact O-CG 3.41Å; G146-M162 VanDerWaalsContact CA-O 3.25Å; G146-M162 WeakPolarHBondContact CA-O 3.32Å; N151-M162 PolarHBondContact OD1-N 2.91Å; M162-N313 HydrophobicContact SD-CB 4.29Å; M162-T316 HydrophobicContact CE-CG2 4.23Å; M162-T316 HydrophobicContact SD-CG2 4.46Å; M162-A317 HydrophobicContact CE-CB 3.6Å
163	V	98.3	Very high	98.2	Very high	22 Å²	22	34.7 Å²	34.7	13%	0.133	18%	0.178	C	C	.	.			trans	-79.3	135.9	177	-178.1	0	0	0	0	108.8	L155 S161 A165 P167 A168 L202 N313	L155-V163 HydrophobicContact CD1-CG2 4.24Å; S161-V163 PolarHBondContact O-N 2.81Å; V163-A165 PolarHBondContact O-N 3.41Å; V163-P167 HydrophobicContact CG1-CB 4.37Å; V163-A168 HydrophobicContact CB-CB 4.24Å; V163-A168 HydrophobicContact CG1-CB 3.95Å; V163-L202 HydrophobicContact CG1-CD1 3.77Å; V163-L202 HydrophobicContact CG1-CD2 4.11Å; V163-L202 HydrophobicContact CG1-CG 4.38Å; V163-L202 HydrophobicContact CG2-CD2 4.46Å; V163-N313 PolarHBondContact O-ND2 3.45Å
164	P	98.4	Very high	98.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	16%	0.164	C	C	.	.			trans	-57.7	140.7	179	-22.7	30.7	0	0	0	113.1	D145 F147 I152 T166 P167 A168 P198	D145-P164 WeakPolarHBondContact O-CA 3.28Å; D145-P164 VanDerWaalsContact O-CB 3.29Å; D145-P164 WeakPolarHBondContact O-CB 3.47Å; F147-P164 HydrophobicContact CD1-CB 4.31Å; F147-P164 HydrophobicContact CD1-CG 4.28Å; F147-P164 HydrophobicContact CE1-CB 3.85Å; F147-P164 HydrophobicContact CE1-CG 4.29Å; I152-P164 HydrophobicContact CD1-CG 4.04Å; P164-T166 PolarHBondContact O-N 3.43Å; P164-P167 HydrophobicContact CB-CG 3.9Å; P164-P167 HydrophobicContact CG-CG 4.46Å; P164-P167 WeakPolarHBondContact O-CD 3.5Å; P164-A168 WeakPolarHBondContact O-CB 3.49Å; P164-A168 PolarHBondContact O-N 3.19Å; P164-P198 HydrophobicContact CG-CB 4.3Å; P164-P198 HydrophobicContact CG-CG 4.13Å
165	A	97.4	Very high	98.2	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-40.3	-164.3	0	0	0	0	0	113.7	V163 A168 A169 T306 M309 L310	V163-A165 PolarHBondContact O-N 3.41Å; A165-A168 PolarHBondContact O-N 2.9Å; A165-A169 VanDerWaalsContact O-CB 3.24Å; A165-A169 WeakPolarHBondContact O-CB 3.32Å; A165-A169 PolarHBondContact O-N 2.9Å; A165-T306 HydrophobicContact CB-CG2 3.98Å; A165-T306 WeakPolarHBondContact CB-O 3.28Å; A165-M309 HydrophobicContact CB-CB 4.34Å; A165-L310 HydrophobicContact CB-CB 4.14Å
166	T	97.8	Very high	98.2	Very high	27 Å²	27	37.5 Å²	37.5	17%	0.166	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-49.4	177.5	-63.5	0	0	0	0	112.5	P164 A168 A169 V170 V195 V264 V302 T306	P164-T166 PolarHBondContact O-N 3.43Å; T166-A168 VanDerWaalsContact C-N 3.33Å; T166-A168 PolarHBondContact O-N 3.43Å; T166-A169 WeakPolarHBondContact O-CB 3.49Å; T166-A169 PolarHBondContact O-N 3.43Å; T166-V170 PolarHBondContact O-N 2.97Å; T166-V195 HydrophobicContact CG2-CG1 3.88Å; T166-V195 HydrophobicContact CG2-CG2 4.13Å; T166-V264 HydrophobicContact CG2-CG1 3.41Å; T166-V264 VanDerWaalsContact CG2-CG1 3.41Å; T166-V302 HydrophobicContact CG2-CG1 3.97Å; T166-T306 WeakPolarHBondContact OG1-CG2 3.42Å; T166-T306 PolarHBondContact OG1-OG1 2.99Å
167	P	98.7	Very high	98.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-53	-45.7	169	-29.4	33	0	0	0	114.3	V163 P164 A169 V170 W171 N194 P198 I199 L202	V163-P167 HydrophobicContact CG1-CB 4.37Å; P164-P167 HydrophobicContact CB-CG 3.9Å; P164-P167 HydrophobicContact CG-CG 4.46Å; P164-P167 WeakPolarHBondContact O-CD 3.5Å; P167-A169 VanDerWaalsContact C-N 3.3Å; P167-A169 PolarHBondContact O-N 3.32Å; P167-V170 PolarHBondContact O-N 3.24Å; P167-W171 PolarHBondContact O-N 2.8Å; P167-N194 WeakPolarHBondContact CD-O 3.49Å; P167-N194 WeakPolarHBondContact CG-O 3.35Å; P167-P198 HydrophobicContact CB-CB 3.8Å; P167-P198 HydrophobicContact CG-CB 3.52Å; P167-P198 HydrophobicContact CG-CG 4.14Å; P167-I199 HydrophobicContact CB-CG1 3.78Å; P167-I199 HydrophobicContact CG-CG1 4.03Å; P167-L202 HydrophobicContact CB-CD1 3.77Å
168	A	98.6	Very high	98.1	Very high	9 Å²	9	33.5 Å²	33.5	7%	0.074	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-38.2	177	0	0	0	0	0	111.7	V163 P164 A165 T166 W171 E172 M309	V163-A168 HydrophobicContact CB-CB 4.24Å; V163-A168 HydrophobicContact CG1-CB 3.95Å; P164-A168 WeakPolarHBondContact O-CB 3.49Å; P164-A168 PolarHBondContact O-N 3.19Å; A165-A168 PolarHBondContact O-N 2.9Å; T166-A168 VanDerWaalsContact C-N 3.33Å; T166-A168 PolarHBondContact O-N 3.43Å; A168-W171 PolarHBondContact O-N 3.49Å; A168-E172 VanDerWaalsContact O-CB 3.31Å; A168-E172 WeakPolarHBondContact O-CB 3.48Å; A168-E172 PolarHBondContact O-N 2.93Å; A168-M309 HydrophobicContact CB-CB 4.27Å; A168-M309 HydrophobicContact CB-CE 3.76Å; A168-M309 HydrophobicContact CB-CG 4.31Å
169	A	98.6	Very high	98.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-48.1	175.1	0	0	0	0	0	112	A165 T166 P167 W171 E172 M173 V302 M305 M309	A165-A169 VanDerWaalsContact O-CB 3.24Å; A165-A169 WeakPolarHBondContact O-CB 3.32Å; A165-A169 PolarHBondContact O-N 2.9Å; T166-A169 WeakPolarHBondContact O-CB 3.49Å; T166-A169 PolarHBondContact O-N 3.43Å; P167-A169 VanDerWaalsContact C-N 3.3Å; P167-A169 PolarHBondContact O-N 3.32Å; A169-W171 VanDerWaalsContact C-N 3.33Å; A169-W171 PolarHBondContact O-N 3.26Å; A169-E172 PolarHBondContact O-N 2.89Å; A169-M173 VanDerWaalsContact O-CG 3.24Å; A169-M173 WeakPolarHBondContact O-CG 3.34Å; A169-M173 PolarHBondContact O-N 2.92Å; A169-V302 HydrophobicContact CB-CG1 4.4Å; A169-M305 HydrophobicContact CB-CB 3.53Å; A169-M309 HydrophobicContact CB-CG 3.97Å
170	V	98.8	Very high	98.1	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-47.1	176.4	168.9	0	0	0	0	110.8	T166 P167 E172 M173 I174 I199 I241 I262 V264 V302	T166-V170 PolarHBondContact O-N 2.97Å; P167-V170 PolarHBondContact O-N 3.24Å; V170-E172 PolarHBondContact O-N 3.17Å; V170-M173 PolarHBondContact O-N 3.33Å; V170-I174 HydrophobicContact CG1-CD1 3.96Å; V170-I174 WeakPolarHBondContact O-CG1 3.39Å; V170-I174 PolarHBondContact O-N 3.49Å; V170-I199 HydrophobicContact CB-CD1 4.28Å; V170-I199 HydrophobicContact CB-CG1 4.4Å; V170-I199 HydrophobicContact CG1-CD1 4.45Å; V170-I199 HydrophobicContact CG1-CG2 4.38Å; V170-I199 HydrophobicContact CG2-CD1 3.9Å; V170-I241 HydrophobicContact CG1-CD1 3.73Å; V170-I241 HydrophobicContact CG1-CG2 4.47Å; V170-I262 HydrophobicContact CG1-CG2 4.23Å; V170-I262 HydrophobicContact CG2-CG2 4.09Å; V170-V264 HydrophobicContact CG2-CG2 3.74Å; V170-V302 HydrophobicContact CG2-CG1 4.05Å; V170-V302 HydrophobicContact CG2-CG2 4.28Å
171	W	98.6	Very high	98.3	Very high	38 Å²	38	27.1 Å²	27.1	14%	0.144	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-43.7	178	-173.7	-125.3	0	0	0	112.4	P167 A168 A169 I174 K175 T181 L202 L203	P167-W171 PolarHBondContact O-N 2.8Å; A168-W171 PolarHBondContact O-N 3.49Å; A169-W171 VanDerWaalsContact C-N 3.33Å; A169-W171 PolarHBondContact O-N 3.26Å; W171-I174 PolarHBondContact O-N 2.89Å; W171-K175 HydrophobicContact CZ2-CD 4.43Å; W171-K175 WeakPolarHBondContact O-CG 3.2Å; W171-K175 PolarHBondContact O-N 3.02Å; W171-K175 VanDerWaalsContact O-N 3.1Å; W171-T181 HydrophobicContact CH2-CG2 4.49Å; W171-T181 HydrophobicContact CZ3-CG2 4.02Å; W171-L202 HydrophobicContact CB-CD1 4.16Å; W171-L203 HydrophobicContact CE3-CD2 3.58Å; W171-L203 HydrophobicContact CE3-CG 4.38Å; W171-L203 HydrophobicContact CZ3-CD2 3.41Å; W171-L203 VanDerWaalsContact CZ3-CD2 3.41Å; W171-L203 HydrophobicContact CZ3-CG 4.44Å
172	E	98.7	Very high	98.3	Very high	19 Å²	19	28 Å²	28	9%	0.089	16%	0.157	C	C	.	.	H	α-helix	trans	-65.8	-39.2	178.1	-167.2	66	-169.4	0	0	112.4	I39 A168 A169 V170 K175 R176 M305 M309	I39-E172 HydrophobicContact CD1-CG 3.84Å; A168-E172 VanDerWaalsContact O-CB 3.31Å; A168-E172 WeakPolarHBondContact O-CB 3.48Å; A168-E172 PolarHBondContact O-N 2.93Å; A169-E172 PolarHBondContact O-N 2.89Å; V170-E172 PolarHBondContact O-N 3.17Å; E172-K175 PolarHBondContact O-N 3.06Å; E172-K175 WeakPolarHBondContact OE2-CE 3.44Å; E172-K175 IonicContact OE2-NZ 2.71Å; E172-K175 PolarHBondContact OE2-NZ 3.32Å; E172-R176 HydrophobicContact CG-CG 4.44Å; E172-R176 WeakPolarHBondContact O-CB 3.48Å; E172-R176 WeakPolarHBondContact O-CG 3.42Å; E172-R176 PolarHBondContact O-N 3.23Å; E172-R176 IonicContact OE1-CZ 3.32Å; E172-R176 VanDerWaalsContact OE1-CZ 3.27Å; E172-R176 IonicContact OE1-NE 2.8Å; E172-R176 PolarHBondContact OE1-NE 3.48Å; E172-R176 IonicContact OE1-NH2 2.96Å; E172-R176 PolarHBondContact OE1-NH2 2.85Å; E172-M305 HydrophobicContact CB-CE 3.93Å; E172-M305 HydrophobicContact CG-CE 3.9Å; E172-M309 HydrophobicContact CB-SD 4.38Å; E172-M309 HydrophobicContact CG-SD 4.37Å
173	M	98.7	Very high	98.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-43.7	175.3	-69.4	179.9	78.4	0	0	111.9	I30 L35 A169 V170 A177 T296 V302 M305	I30-M173 HydrophobicContact CB-CE 4.31Å; I30-M173 HydrophobicContact CG2-CE 3.58Å; L35-M173 HydrophobicContact CD1-CB 4.35Å; L35-M173 HydrophobicContact CD1-CG 4.01Å; A169-M173 VanDerWaalsContact O-CG 3.24Å; A169-M173 WeakPolarHBondContact O-CG 3.34Å; A169-M173 PolarHBondContact O-N 2.92Å; V170-M173 PolarHBondContact O-N 3.33Å; M173-A177 WeakPolarHBondContact O-CB 3.15Å; M173-A177 PolarHBondContact O-N 2.83Å; M173-T296 HydrophobicContact CE-CG2 3.37Å; M173-T296 HydrophobicContact SD-CG2 4.44Å; M173-V302 HydrophobicContact SD-CG2 3.99Å; M173-M305 HydrophobicContact CG-CB 4.5Å; M173-M305 HydrophobicContact CG-CE 3.82Å; M173-M305 HydrophobicContact CG-CG 3.85Å; M173-M305 HydrophobicContact CG-SD 4.4Å; M173-M305 HydrophobicContact SD-CB 4.27Å; M173-M305 HydrophobicContact SD-CG 3.81Å
174	I	98.7	Very high	98.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-59.1	-50.2	177.1	-71.9	168.8	0	0	0	110.3	V170 W171 A177 G178 I179 T181 L203 I241 I262	V170-I174 HydrophobicContact CG1-CD1 3.96Å; V170-I174 WeakPolarHBondContact O-CG1 3.39Å; V170-I174 PolarHBondContact O-N 3.49Å; W171-I174 PolarHBondContact O-N 2.89Å; I174-A177 PolarHBondContact O-N 3.41Å; I174-G178 PolarHBondContact O-N 2.97Å; I174-I179 HydrophobicContact CG2-CB 4.02Å; I174-I179 HydrophobicContact CG2-CG2 4.28Å; I174-I179 PolarHBondContact O-N 2.91Å; I174-I179 VanDerWaalsContact O-N 3.09Å; I174-T181 HydrophobicContact CG2-CG2 3.51Å; I174-L203 HydrophobicContact CD1-CD2 3.87Å; I174-I241 HydrophobicContact CD1-CD1 4.23Å; I174-I262 HydrophobicContact CG1-CG1 4.47Å
175	K	98.3	Very high	98.4	Very high	103 Å²	103	35.9 Å²	35.9	45%	0.448	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-50.2	179	-70	-176.6	-63.4	163.4	0	112.4	W171 E172 A177 G178	W171-K175 HydrophobicContact CZ2-CD 4.43Å; W171-K175 WeakPolarHBondContact O-CG 3.2Å; W171-K175 PolarHBondContact O-N 3.02Å; W171-K175 VanDerWaalsContact O-N 3.1Å; E172-K175 PolarHBondContact O-N 3.06Å; E172-K175 WeakPolarHBondContact OE2-CE 3.44Å; E172-K175 IonicContact OE2-NZ 2.71Å; E172-K175 PolarHBondContact OE2-NZ 3.32Å; K175-A177 VanDerWaalsContact C-N 3.26Å; K175-A177 PolarHBondContact O-N 3.07Å; K175-G178 PolarHBondContact O-N 3.5Å
176	R	98.3	Very high	98.5	Very high	69 Å²	69	35.8 Å²	35.8	26%	0.26	21%	0.208	S	C	.	.	H	α-helix	trans	-68	-26.5	-177.7	-70.1	-171.9	-173.6	-127.6	-4.6	113	L35 E42 E172 G178	L35-R176 HydrophobicContact CD1-CB 4.35Å; L35-R176 HydrophobicContact CD2-CB 3.93Å; E42-R176 VanDerWaalsContact CD-NH2 3.33Å; E42-R176 IonicContact OE1-CZ 2.9Å; E42-R176 IonicContact OE1-NH1 3.52Å; E42-R176 PolarHBondContact OE1-NH1 3.37Å; E42-R176 IonicContact OE1-NH2 3.91Å; E42-R176 PolarHBondContact OE1-NH2 3.36Å; E42-R176 IonicContact OE2-CZ 2.72Å; E42-R176 IonicContact OE2-NH2 3.83Å; E42-R176 PolarHBondContact OE2-NH2 3.41Å; E172-R176 HydrophobicContact CG-CG 4.44Å; E172-R176 WeakPolarHBondContact O-CB 3.48Å; E172-R176 WeakPolarHBondContact O-CG 3.42Å; E172-R176 PolarHBondContact O-N 3.23Å; E172-R176 IonicContact OE1-CZ 3.32Å; E172-R176 VanDerWaalsContact OE1-CZ 3.27Å; E172-R176 IonicContact OE1-NE 2.8Å; E172-R176 PolarHBondContact OE1-NE 3.48Å; E172-R176 IonicContact OE1-NH2 2.96Å; E172-R176 PolarHBondContact OE1-NH2 2.85Å; R176-G178 VanDerWaalsContact C-N 3.26Å
177	A	97.6	Very high	98.6	Very high	29 Å²	29	34.6 Å²	34.6	24%	0.24	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-6.3	173.1	0	0	0	0	0	113.5	I30 M173 I174 K175 I179	I30-A177 HydrophobicContact CD1-CB 3.75Å; I30-A177 HydrophobicContact CG1-CB 4.27Å; M173-A177 WeakPolarHBondContact O-CB 3.15Å; M173-A177 PolarHBondContact O-N 2.83Å; I174-A177 PolarHBondContact O-N 3.41Å; K175-A177 VanDerWaalsContact C-N 3.26Å; K175-A177 PolarHBondContact O-N 3.07Å; A177-I179 VanDerWaalsContact C-N 3.3Å; A177-I179 HydrophobicContact CB-CD1 3.82Å; A177-I179 HydrophobicContact CB-CG1 3.96Å; A177-I179 PolarHBondContact O-N 3.44Å
178	G	97.8	Very high	98.6	Very high	66 Å²	66	34.6 Å²	34.6	68%	0.68	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.2	28.4	-177.7	0	0	0	0	0	113.3	I174 K175 R176 E180	I174-G178 PolarHBondContact O-N 2.97Å; K175-G178 PolarHBondContact O-N 3.5Å; R176-G178 VanDerWaalsContact C-N 3.26Å; G178-E180 PolarHBondContact O-N 3.33Å
179	I	98.4	Very high	98.6	Very high	21 Å²	21	34.3 Å²	34.3	11%	0.108	20%	0.198	C	C	.	.			trans	-81.2	115.4	178.2	-63.8	164.1	0	0	0	108.4	I30 I174 A177 I239 A260 F294	I30-I179 HydrophobicContact CD1-CD1 3.85Å; I174-I179 HydrophobicContact CG2-CB 4.02Å; I174-I179 HydrophobicContact CG2-CG2 4.28Å; I174-I179 PolarHBondContact O-N 2.91Å; I174-I179 VanDerWaalsContact O-N 3.09Å; A177-I179 VanDerWaalsContact C-N 3.3Å; A177-I179 HydrophobicContact CB-CD1 3.82Å; A177-I179 HydrophobicContact CB-CG1 3.96Å; A177-I179 PolarHBondContact O-N 3.44Å; I179-I239 HydrophobicContact CG2-CD1 3.68Å; I179-I239 HydrophobicContact CG2-CG1 4.09Å; I179-A260 HydrophobicContact CD1-CB 3.75Å; I179-A260 HydrophobicContact CG1-CB 4.38Å; I179-A260 HydrophobicContact CG2-CB 4.09Å; I179-F294 HydrophobicContact CD1-CB 4.16Å; I179-F294 HydrophobicContact CD1-CD1 4.38Å; I179-F294 HydrophobicContact CD1-CD2 4.22Å; I179-F294 HydrophobicContact CD1-CG 4.01Å; I179-F294 HydrophobicContact CG1-CD1 4.47Å; I179-F294 HydrophobicContact CG1-CD2 3.98Å; I179-F294 HydrophobicContact CG1-CE2 4.09Å; I179-F294 HydrophobicContact CG1-CG 4.18Å; I179-F294 HydrophobicContact CG1-CZ 4.38Å
180	E	98.4	Very high	98.5	Very high	109 Å²	109	34.6 Å²	34.6	51%	0.509	20%	0.201	S	C	.	.			trans	-64.3	135.6	175.5	-177.2	56.8	-102.9	0	0	111	G178 V182 K184	G178-E180 PolarHBondContact O-N 3.33Å; E180-V182 VanDerWaalsContact OE1-CB 3.23Å; E180-V182 WeakPolarHBondContact OE1-CB 3.32Å; E180-V182 VanDerWaalsContact OE1-CG2 3.27Å; E180-V182 WeakPolarHBondContact OE1-CG2 3.24Å; E180-V182 PolarHBondContact OE1-N 3.39Å; E180-K184 VanDerWaalsContact O-CG 3.29Å; E180-K184 WeakPolarHBondContact O-CG 3.46Å
181	T	98.8	Very high	98.5	Very high	12 Å²	12	40 Å²	40	7%	0.074	22%	0.221	C	C	.	.			trans	-116.8	-24.3	179.4	60.9	0	0	0	0	113	W171 I174 G183 K184 L203 G214 A216 I239	W171-T181 HydrophobicContact CH2-CG2 4.49Å; W171-T181 HydrophobicContact CZ3-CG2 4.02Å; I174-T181 HydrophobicContact CG2-CG2 3.51Å; T181-G183 PolarHBondContact O-N 2.95Å; T181-K184 WeakPolarHBondContact O-CB 3.36Å; T181-K184 PolarHBondContact O-N 2.77Å; T181-L203 HydrophobicContact CG2-CD2 4.28Å; T181-G214 CarbonylContact C-O 3.23Å; T181-G214 VanDerWaalsContact C-O 3.24Å; T181-G214 WeakPolarHBondContact CB-O 3.48Å; T181-G214 WeakPolarHBondContact OG1-CA 3.36Å; T181-G214 PolarHBondContact OG1-O 3.05Å; T181-A216 WeakPolarHBondContact O-CA 3.37Å; T181-A216 WeakPolarHBondContact O-CB 3.36Å; T181-I239 HydrophobicContact CG2-CD1 3.84Å
182	V	98.7	Very high	98.4	Very high	46 Å²	46	40.3 Å²	40.3	28%	0.279	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	123.1	-176.1	172.4	0	0	0	0	110.3	E180 K184 G214 D215	E180-V182 VanDerWaalsContact OE1-CB 3.23Å; E180-V182 WeakPolarHBondContact OE1-CB 3.32Å; E180-V182 VanDerWaalsContact OE1-CG2 3.27Å; E180-V182 WeakPolarHBondContact OE1-CG2 3.24Å; E180-V182 PolarHBondContact OE1-N 3.39Å; V182-K184 PolarHBondContact O-N 3.24Å; V182-K184 VanDerWaalsContact O-N 3.14Å; V182-G214 PolarHBondContact N-O 3.3Å; V182-D215 HydrophobicContact CB-CB 4.44Å; V182-D215 HydrophobicContact CG1-CB 4.35Å; V182-D215 HydrophobicContact CG2-CB 4.19Å
183	G	98.5	Very high	98.2	Very high	58 Å²	58	45.8 Å²	45.8	60%	0.598	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	11.4	-179.8	0	0	0	0	0	114	T181 D215	T181-G183 PolarHBondContact O-N 2.95Å; G183-D215 PolarHBondContact N-O 3.33Å
184	K	98.8	Very high	97.9	Very high	75 Å²	75	48.9 Å²	48.9	33%	0.326	27%	0.27	S	S	.	.			trans	-87	150.9	178.6	-62.2	-49.4	-175.6	-178.6	0	111.6	E180 T181 V182 A216 T217 D238	E180-K184 VanDerWaalsContact O-CG 3.29Å; E180-K184 WeakPolarHBondContact O-CG 3.46Å; T181-K184 WeakPolarHBondContact O-CB 3.36Å; T181-K184 PolarHBondContact O-N 2.77Å; V182-K184 PolarHBondContact O-N 3.24Å; V182-K184 VanDerWaalsContact O-N 3.14Å; K184-A216 WeakPolarHBondContact O-CA 3.45Å; K184-T217 PolarHBondContact O-N 2.83Å; K184-D238 HydrophobicContact CB-CB 3.92Å; K184-D238 HydrophobicContact CD-CB 4.25Å; K184-D238 HydrophobicContact CG-CB 4.32Å
185	N	98.9	Very high	97.8	Very high	65 Å²	65	49.8 Å²	49.8	35%	0.348	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119.7	171.8	-67.5	-28.2	0	0	0	109.3	T217 L236 A237 D238 I239	N185-T217 WeakPolarHBondContact CA-O 3.12Å; N185-L236 PolarHBondContact ND2-O 2.91Å; N185-A237 CarbonylContact O-C 3.54Å; N185-A237 WeakPolarHBondContact O-CA 3.41Å; N185-D238 PolarHBondContact N-OD2 3.34Å; N185-D238 PolarHBondContact O-N 2.87Å; N185-I239 PolarHBondContact O-N 2.86Å; N185-I239 VanDerWaalsContact O-N 3.15Å
186	V	98.9	Very high	97.8	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.3	175.7	171.3	0	0	0	0	108.6	V188 L203 A216 T217 V218 T219 I239	V186-V188 HydrophobicContact CG1-CG2 4.04Å; V186-L203 HydrophobicContact CG1-CD1 3.73Å; V186-A216 HydrophobicContact CB-CB 4.29Å; V186-A216 HydrophobicContact CG2-CB 3.46Å; V186-A216 VanDerWaalsContact CG2-CB 3.46Å; V186-T217 PolarHBondContact N-O 2.85Å; V186-V218 HydrophobicContact CB-CG2 3.96Å; V186-V218 HydrophobicContact CG1-CG1 4.31Å; V186-V218 HydrophobicContact CG1-CG2 4.19Å; V186-V218 CarbonylContact O-C 3.54Å; V186-V218 WeakPolarHBondContact O-CA 3.41Å; V186-T219 PolarHBondContact O-N 2.8Å; V186-I239 CarbonylContact C-O 3.53Å; V186-I239 WeakPolarHBondContact CA-O 3.44Å; V186-I239 HydrophobicContact CG2-CB 4.03Å; V186-I239 HydrophobicContact CG2-CD1 4.15Å; V186-I239 HydrophobicContact CG2-CG1 4.41Å
187	L	98.9	Very high	97.8	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.8	165.7	-179.2	129.3	0	0	0	110.7	A189 T219 A221 L230 L233 T234 A237 I239 I240 I241	L187-A189 HydrophobicContact CD2-CB 4.11Å; L187-T219 WeakPolarHBondContact CA-O 3.48Å; L187-T219 HydrophobicContact CD1-CG2 4.11Å; L187-A221 HydrophobicContact CD1-CB 4.46Å; L187-L230 HydrophobicContact CD1-CD1 4.47Å; L187-L230 HydrophobicContact CD2-CD1 4.12Å; L187-L233 HydrophobicContact CD1-CB 3.37Å; L187-L233 HydrophobicContact CD1-CD1 4.37Å; L187-L233 HydrophobicContact CD1-CG 4.49Å; L187-T234 HydrophobicContact CD1-CG2 4.15Å; L187-T234 HydrophobicContact CD2-CG2 3.44Å; L187-T234 VanDerWaalsContact CD2-CG2 3.44Å; L187-T234 HydrophobicContact CG-CG2 4.31Å; L187-A237 HydrophobicContact CB-CB 3.9Å; L187-I239 PolarHBondContact N-O 3.47Å; L187-I240 HydrophobicContact CD2-CG2 4.3Å; L187-I240 WeakPolarHBondContact O-CA 3.2Å; L187-I241 PolarHBondContact O-N 2.97Å
188	V	98.9	Very high	97.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	109.4	171.5	-173.6	0	0	0	0	108.7	V186 G190 I199 A200 V218 T219 A221 I241	V186-V188 HydrophobicContact CG1-CG2 4.04Å; V188-G190 PolarHBondContact O-N 2.98Å; V188-I199 HydrophobicContact CG1-CG2 4.34Å; V188-I199 HydrophobicContact CG2-CG2 3.93Å; V188-A200 HydrophobicContact CG2-CB 4.24Å; V188-V218 HydrophobicContact CG2-CG1 4.03Å; V188-T219 PolarHBondContact N-O 2.93Å; V188-A221 PolarHBondContact O-N 3.07Å; V188-I241 HydrophobicContact CG1-CB 4.42Å; V188-I241 HydrophobicContact CG2-CB 4.33Å; V188-I241 HydrophobicContact CG2-CG1 4.28Å
189	A	98.7	Very high	97.9	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.025	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	89.8	173.9	0	0	0	0	0	109.4	L187 I241 A243 A244 L249	L187-A189 HydrophobicContact CD2-CB 4.11Å; A189-I241 PolarHBondContact N-O 3.38Å; A189-A243 CarbonylContact O-C 3.13Å; A189-A243 WeakPolarHBondContact O-CA 3.42Å; A189-A243 PolarHBondContact O-N 2.89Å; A189-A244 PolarHBondContact O-N 2.96Å; A189-L249 HydrophobicContact CB-CD2 4.4Å
190	G	98	Very high	97.9	Very high	6 Å²	6	37.7 Å²	37.7	6%	0.062	20%	0.201	C	C	.	.			trans	142.7	139.9	-173.7	0	0	0	0	0	110.9	V188 G196 A221	V188-G190 PolarHBondContact O-N 2.98Å; G190-G196 WeakPolarHBondContact O-CA 3.35Å; G190-A221 PolarHBondContact N-O 3.09Å
191	R	97.8	Very high	97.9	Very high	115 Å²	115	34.3 Å²	34.3	43%	0.434	19%	0.185	S	C	.	.			trans	-132.9	21	-178.4	68.9	171.4	176.3	-168.5	0.4	114	I220 H222	R191-I220 HydrophobicContact CB-CG2 3.96Å; R191-H222 HydrophobicContact CB-CB 4.46Å; R191-H222 HydrophobicContact CG-CB 3.81Å; R191-H222 PolarHBondContact NH1-CD2 2.8Å; R191-H222 PolarHBondContact NH1-NE2 2.73Å; R191-H222 VanDerWaalsContact NH1-NE2 3.16Å
192	S	96.1	Very high	97.9	Very high	46 Å²	46	33.9 Å²	33.9	32%	0.322	18%	0.183	S	C	.	.			trans	-60.1	151.1	177.6	71.1	0	0	0	0	110.2	N194 V195 G196 M197	S192-N194 VanDerWaalsContact C-N 3.27Å; S192-N194 WeakPolarHBondContact CB-OD1 3.42Å; S192-N194 PolarHBondContact O-N 3.05Å; S192-N194 PolarHBondContact OG-OD1 3.2Å; S192-V195 WeakPolarHBondContact OG-CB 3.23Å; S192-V195 PolarHBondContact OG-N 3.48Å; S192-G196 PolarHBondContact O-N 3.16Å; S192-G196 PolarHBondContact OG-N 3.34Å; S192-M197 PolarHBondContact O-N 3.16Å
193	K	94.3	Very high	97.9	Very high	133 Å²	133	31.8 Å²	31.8	58%	0.578	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.2	-175.4	-58.4	-55.7	-175	177	0	113	P198	K193-P198 WeakPolarHBondContact O-CD 3.26Å; K193-P198 WeakPolarHBondContact O-CG 3.21Å
194	N	92.1	Very high	97.9	Very high	66 Å²	66	32.9 Å²	32.9	35%	0.353	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-19.4	179.8	58.9	-19.5	0	0	0	114.1	F147 P167 S192	F147-N194 HydrophobicContact CD1-CB 4.11Å; F147-N194 HydrophobicContact CE1-CB 3.34Å; F147-N194 HydrophobicContact CZ-CB 3.64Å; P167-N194 WeakPolarHBondContact CD-O 3.49Å; P167-N194 WeakPolarHBondContact CG-O 3.35Å; S192-N194 VanDerWaalsContact C-N 3.27Å; S192-N194 WeakPolarHBondContact CB-OD1 3.42Å; S192-N194 PolarHBondContact O-N 3.05Å; S192-N194 PolarHBondContact OG-OD1 3.2Å
195	V	97.3	Very high	97.9	Very high	20 Å²	20	29.7 Å²	29.7	12%	0.121	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-70.5	-174.6	-177	0	0	0	0	111.7	T166 S192 M197 P198 I199 A243 V264	T166-V195 HydrophobicContact CG2-CG1 3.88Å; T166-V195 HydrophobicContact CG2-CG2 4.13Å; S192-V195 WeakPolarHBondContact OG-CB 3.23Å; S192-V195 PolarHBondContact OG-N 3.48Å; V195-M197 PolarHBondContact O-N 3.33Å; V195-P198 WeakPolarHBondContact O-CD 3.39Å; V195-I199 HydrophobicContact CG1-CD1 3.61Å; V195-I199 WeakPolarHBondContact O-CB 3.25Å; V195-I199 WeakPolarHBondContact O-CD1 3.37Å; V195-I199 WeakPolarHBondContact O-CG1 3.37Å; V195-I199 PolarHBondContact O-N 2.87Å; V195-A243 HydrophobicContact CG1-CB 3.84Å; V195-V264 HydrophobicContact CG1-CG1 3.73Å
196	G	98.3	Very high	97.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-47.5	-169.3	0	0	0	0	0	114	G190 S192 I199 A200	G190-G196 WeakPolarHBondContact O-CA 3.35Å; S192-G196 PolarHBondContact O-N 3.16Å; S192-G196 PolarHBondContact OG-N 3.34Å; G196-I199 PolarHBondContact O-N 3.47Å; G196-A200 PolarHBondContact O-N 3.21Å; G196-A200 VanDerWaalsContact O-N 3.09Å
197	M	98.4	Very high	97.8	Very high	31 Å²	31	35 Å²	35	15%	0.153	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-51.3	179.8	177.3	-74.6	-68.5	0	0	111.9	I152 S192 V195 I199 A200 M201	I152-M197 HydrophobicContact CD1-CE 4.39Å; I152-M197 HydrophobicContact CG2-CE 3.76Å; S192-M197 PolarHBondContact O-N 3.16Å; V195-M197 PolarHBondContact O-N 3.33Å; M197-I199 VanDerWaalsContact C-N 3.32Å; M197-I199 PolarHBondContact O-N 3.01Å; M197-A200 WeakPolarHBondContact O-CB 3.45Å; M197-A200 PolarHBondContact O-N 3.06Å; M197-A200 VanDerWaalsContact O-N 3.14Å; M197-M201 HydrophobicContact CG-CG 4.5Å; M197-M201 WeakPolarHBondContact O-CG 3.22Å; M197-M201 PolarHBondContact O-N 3.47Å; M197-M201 HydrophobicContact SD-CG 3.59Å; M197-M201 VanDerWaalsContact SD-CG 3.59Å
198	P	98.6	Very high	97.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-35.5	178	-26.9	35.9	0	0	0	114	I152 L155 P164 P167 K193 V195 M201 L202	I152-P198 HydrophobicContact CD1-CG 4.37Å; L155-P198 HydrophobicContact CD2-CB 3.71Å; L155-P198 HydrophobicContact CD2-CG 4.43Å; P164-P198 HydrophobicContact CG-CB 4.3Å; P164-P198 HydrophobicContact CG-CG 4.13Å; P167-P198 HydrophobicContact CB-CB 3.8Å; P167-P198 HydrophobicContact CG-CB 3.52Å; P167-P198 HydrophobicContact CG-CG 4.14Å; K193-P198 WeakPolarHBondContact O-CD 3.26Å; K193-P198 WeakPolarHBondContact O-CG 3.21Å; V195-P198 WeakPolarHBondContact O-CD 3.39Å; P198-M201 PolarHBondContact O-N 3.19Å; P198-L202 WeakPolarHBondContact O-CG 3.43Å; P198-L202 PolarHBondContact O-N 3.41Å
199	I	98.9	Very high	97.7	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-47.1	174.1	-73.9	168.7	0	0	0	110.6	P167 V170 V188 V195 G196 M197 M201 L202 L203 I241 V264	P167-I199 HydrophobicContact CB-CG1 3.78Å; P167-I199 HydrophobicContact CG-CG1 4.03Å; V170-I199 HydrophobicContact CB-CD1 4.28Å; V170-I199 HydrophobicContact CB-CG1 4.4Å; V170-I199 HydrophobicContact CG1-CD1 4.45Å; V170-I199 HydrophobicContact CG1-CG2 4.38Å; V170-I199 HydrophobicContact CG2-CD1 3.9Å; V188-I199 HydrophobicContact CG1-CG2 4.34Å; V188-I199 HydrophobicContact CG2-CG2 3.93Å; V195-I199 HydrophobicContact CG1-CD1 3.61Å; V195-I199 WeakPolarHBondContact O-CB 3.25Å; V195-I199 WeakPolarHBondContact O-CD1 3.37Å; V195-I199 WeakPolarHBondContact O-CG1 3.37Å; V195-I199 PolarHBondContact O-N 2.87Å; G196-I199 PolarHBondContact O-N 3.47Å; M197-I199 VanDerWaalsContact C-N 3.32Å; M197-I199 PolarHBondContact O-N 3.01Å; I199-M201 VanDerWaalsContact C-N 3.28Å; I199-M201 PolarHBondContact O-N 3.05Å; I199-L202 PolarHBondContact O-N 3.22Å; I199-L203 HydrophobicContact CG2-CD1 3.56Å; I199-L203 WeakPolarHBondContact O-CB 3.45Å; I199-L203 WeakPolarHBondContact O-CG 3.22Å; I199-L203 PolarHBondContact O-N 3.17Å; I199-L203 VanDerWaalsContact O-N 3.1Å; I199-I241 HydrophobicContact CD1-CG2 4.04Å; I199-I241 HydrophobicContact CG2-CB 4.38Å; I199-I241 HydrophobicContact CG2-CG1 4Å; I199-I241 HydrophobicContact CG2-CG2 4.14Å; I199-V264 HydrophobicContact CD1-CG2 4.39Å
200	A	98.9	Very high	97.7	Very high	1 Å²	1	50 Å²	50	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-41	176.6	0	0	0	0	0	111.3	V188 G196 M197 L203 H204 V218 I220	V188-A200 HydrophobicContact CG2-CB 4.24Å; G196-A200 PolarHBondContact O-N 3.21Å; G196-A200 VanDerWaalsContact O-N 3.09Å; M197-A200 WeakPolarHBondContact O-CB 3.45Å; M197-A200 PolarHBondContact O-N 3.06Å; M197-A200 VanDerWaalsContact O-N 3.14Å; A200-L203 PolarHBondContact O-N 3.18Å; A200-H204 PolarHBondContact O-N 3.31Å; A200-H204 VanDerWaalsContact O-N 3.1Å; A200-H204 PolarHBondContact O-ND1 3.31Å; A200-V218 HydrophobicContact CB-CG1 3.84Å; A200-I220 HydrophobicContact CB-CD1 3.67Å; A200-I220 HydrophobicContact CB-CG1 3.87Å
201	M	98.7	Very high	97.6	Very high	38 Å²	38	50.9 Å²	50.9	19%	0.187	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-50.3	177.3	-65.2	-58.3	93.3	0	0	112.1	L155 M197 P198 I199 L203 H204 T205	L155-M201 HydrophobicContact CG-CB 4.47Å; M197-M201 HydrophobicContact CG-CG 4.5Å; M197-M201 WeakPolarHBondContact O-CG 3.22Å; M197-M201 PolarHBondContact O-N 3.47Å; M197-M201 HydrophobicContact SD-CG 3.59Å; M197-M201 VanDerWaalsContact SD-CG 3.59Å; P198-M201 PolarHBondContact O-N 3.19Å; I199-M201 VanDerWaalsContact C-N 3.28Å; I199-M201 PolarHBondContact O-N 3.05Å; M201-L203 VanDerWaalsContact C-N 3.27Å; M201-L203 PolarHBondContact O-N 3.19Å; M201-H204 VanDerWaalsContact CA-ND1 3.33Å; M201-H204 WeakPolarHBondContact CA-ND1 3.42Å; M201-H204 WeakPolarHBondContact CE-CE1 3.38Å; M201-H204 PolarHBondContact O-CE1 3.41Å; M201-H204 PolarHBondContact O-ND1 3.05Å; M201-H204 PolarHBondContact SD-CE1 3.03Å; M201-T205 VanDerWaalsContact O-CG2 3.28Å; M201-T205 WeakPolarHBondContact O-CG2 3.41Å; M201-T205 PolarHBondContact O-OG1 3.14Å
202	L	98.7	Very high	97.6	Very high	4 Å²	4	49 Å²	49	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-58	-39.1	177.8	-70	168.7	0	0	0	112.9	L155 V163 P167 W171 P198 I199 T205 G213 G214	L155-L202 HydrophobicContact CD1-CD2 3.64Å; L155-L202 HydrophobicContact CD1-CG 4.16Å; V163-L202 HydrophobicContact CG1-CD1 3.77Å; V163-L202 HydrophobicContact CG1-CD2 4.11Å; V163-L202 HydrophobicContact CG1-CG 4.38Å; V163-L202 HydrophobicContact CG2-CD2 4.46Å; P167-L202 HydrophobicContact CB-CD1 3.77Å; W171-L202 HydrophobicContact CB-CD1 4.16Å; P198-L202 WeakPolarHBondContact O-CG 3.43Å; P198-L202 PolarHBondContact O-N 3.41Å; I199-L202 PolarHBondContact O-N 3.22Å; L202-T205 PolarHBondContact O-OG1 3.5Å; L202-G213 WeakPolarHBondContact O-CA 3.47Å; L202-G214 PolarHBondContact O-N 3.49Å; L202-G214 VanDerWaalsContact O-N 3.1Å
203	L	98.8	Very high	97.7	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-79.8	-34.6	-172.4	-71.7	167.1	0	0	0	113.5	W171 I174 T181 V186 I199 A200 M201 G214 D215 A216 V218 I241	W171-L203 HydrophobicContact CE3-CD2 3.58Å; W171-L203 HydrophobicContact CE3-CG 4.38Å; W171-L203 HydrophobicContact CZ3-CD2 3.41Å; W171-L203 VanDerWaalsContact CZ3-CD2 3.41Å; W171-L203 HydrophobicContact CZ3-CG 4.44Å; I174-L203 HydrophobicContact CD1-CD2 3.87Å; T181-L203 HydrophobicContact CG2-CD2 4.28Å; V186-L203 HydrophobicContact CG1-CD1 3.73Å; I199-L203 HydrophobicContact CG2-CD1 3.56Å; I199-L203 WeakPolarHBondContact O-CB 3.45Å; I199-L203 WeakPolarHBondContact O-CG 3.22Å; I199-L203 PolarHBondContact O-N 3.17Å; I199-L203 VanDerWaalsContact O-N 3.1Å; A200-L203 PolarHBondContact O-N 3.18Å; M201-L203 VanDerWaalsContact C-N 3.27Å; M201-L203 PolarHBondContact O-N 3.19Å; L203-G214 CarbonylContact O-C 3.45Å; L203-G214 VanDerWaalsContact O-C 3.23Å; L203-G214 VanDerWaalsContact O-CA 3.28Å; L203-G214 WeakPolarHBondContact O-CA 3.43Å; L203-D215 PolarHBondContact O-N 2.88Å; L203-A216 VanDerWaalsContact O-CB 3.23Å; L203-A216 WeakPolarHBondContact O-CB 3.16Å; L203-A216 PolarHBondContact O-N 3.42Å; L203-V218 HydrophobicContact CB-CG2 3.83Å; L203-I241 HydrophobicContact CD1-CG1 4.13Å
204	H	98.8	Very high	97.9	Very high	80 Å²	80	40.8 Å²	40.8	37%	0.37	20%	0.204	S	C	.	.	H	α-helix	trans	-87.5	-21.6	-173.4	83.7	-61.7	0	0	0	115.7	A200 M201 A216 V218	A200-H204 PolarHBondContact O-N 3.31Å; A200-H204 VanDerWaalsContact O-N 3.1Å; A200-H204 PolarHBondContact O-ND1 3.31Å; M201-H204 VanDerWaalsContact CA-ND1 3.33Å; M201-H204 WeakPolarHBondContact CA-ND1 3.42Å; M201-H204 WeakPolarHBondContact CE-CE1 3.38Å; M201-H204 PolarHBondContact O-CE1 3.41Å; M201-H204 PolarHBondContact O-ND1 3.05Å; M201-H204 PolarHBondContact SD-CE1 3.03Å; H204-A216 VanDerWaalsContact CA-O 3.31Å; H204-A216 WeakPolarHBondContact CA-O 3.5Å; H204-V218 HydrophobicContact CB-CB 3.98Å; H204-V218 HydrophobicContact CB-CG2 3.5Å; H204-V218 VanDerWaalsContact CB-CG2 3.5Å
205	T	98.6	Very high	98.2	Very high	9 Å²	9	39.7 Å²	39.7	6%	0.055	20%	0.198	C	C	.	.	S	Bend	trans	-78.1	163.2	-168.5	40.6	0	0	0	0	113	D158 M201 L202 R211 G213 G214 D215	D158-T205 WeakPolarHBondContact OD1-CB 3.27Å; D158-T205 WeakPolarHBondContact OD1-CG2 3.49Å; D158-T205 PolarHBondContact OD1-OG1 3.43Å; D158-T205 WeakPolarHBondContact OD2-CB 3.38Å; D158-T205 VanDerWaalsContact OD2-CG2 3.32Å; D158-T205 WeakPolarHBondContact OD2-CG2 3.33Å; M201-T205 VanDerWaalsContact O-CG2 3.28Å; M201-T205 WeakPolarHBondContact O-CG2 3.41Å; M201-T205 PolarHBondContact O-OG1 3.14Å; L202-T205 PolarHBondContact O-OG1 3.5Å; T205-R211 PolarHBondContact OG1-NH2 2.85Å; T205-G213 CarbonylContact O-C 3.6Å; T205-G213 VanDerWaalsContact O-C 3.31Å; T205-G213 VanDerWaalsContact O-CA 3.26Å; T205-G213 WeakPolarHBondContact O-CA 3.23Å; T205-G213 WeakPolarHBondContact OG1-CA 3.5Å; T205-G214 PolarHBondContact O-N 3.44Å; T205-G214 VanDerWaalsContact O-N 3.1Å; T205-D215 PolarHBondContact O-N 3.16Å
206	D	98.4	Very high	98.3	Very high	56 Å²	56	39 Å²	39	30%	0.299	20%	0.195	S	C	.	.			trans	-67	131.1	-173.7	-166.7	-33.7	0	0	0	111.2	N208 H209 G213 D215	D206-N208 PolarHBondContact O-N 2.93Å; D206-N208 VanDerWaalsContact OD1-CB 3.32Å; D206-N208 WeakPolarHBondContact OD1-CB 3.34Å; D206-N208 PolarHBondContact OD1-N 3.19Å; D206-N208 PolarHBondContact OD1-ND2 2.92Å; D206-H209 PolarHBondContact O-N 3.01Å; D206-G213 PolarHBondContact O-N 2.99Å; D206-D215 WeakPolarHBondContact CA-OD1 3.26Å
207	R	97.4	Very high	98.3	Very high	121 Å²	121	43 Å²	43	46%	0.457	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.7	177.1	84.9	-175	89.1	165.4	15	113.4	P212 D215	R207-P212 WeakPolarHBondContact O-CA 3.32Å; R207-P212 VanDerWaalsContact O-CB 3.25Å; R207-P212 WeakPolarHBondContact O-CB 3.33Å; R207-D215 WeakPolarHBondContact CB-OD2 3.47Å; R207-D215 WeakPolarHBondContact CG-OD2 3.23Å; R207-D215 IonicContact CZ-OD2 3.4Å; R207-D215 PolarHBondContact N-OD2 3.01Å; R207-D215 IonicContact NE-OD2 2.67Å; R207-D215 PolarHBondContact NE-OD2 3.4Å; R207-D215 IonicContact NH2-OD2 3.3Å; R207-D215 PolarHBondContact NH2-OD2 3.3Å
208	N	97.8	Very high	98.3	Very high	127 Å²	127	43.2 Å²	43.2	68%	0.679	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-2.5	-175.2	-55.4	-61.8	0	0	0	113.8	D206	D206-N208 PolarHBondContact O-N 2.93Å; D206-N208 VanDerWaalsContact OD1-CB 3.32Å; D206-N208 WeakPolarHBondContact OD1-CB 3.34Å; D206-N208 PolarHBondContact OD1-N 3.19Å; D206-N208 PolarHBondContact OD1-ND2 2.92Å
209	H	97.7	Very high	98.3	Very high	90 Å²	90	45.8 Å²	45.8	42%	0.417	24%	0.238	S	C	.	.	S	Bend	trans	-74.9	170.1	175.8	-72.8	174.3	0	0	0	113	D158 D206 R211	D158-H209 HydrophobicContact CB-CB 3.51Å; D158-H209 WeakPolarHBondContact CB-ND1 3.43Å; D158-H209 IonicContact OD2-CE1 3.56Å; D158-H209 IonicContact OD2-CG 3.84Å; D158-H209 IonicContact OD2-ND1 2.75Å; D158-H209 PolarHBondContact OD2-ND1 2.87Å; D206-H209 PolarHBondContact O-N 3.01Å; H209-R211 CarbonylContact O-C 3.47Å; H209-R211 PolarHBondContact O-N 3.49Å
210	E	97.2	Very high	98.3	Very high	105 Å²	105	49.1 Å²	49.1	49%	0.491	26%	0.255	S	S	.	.	S	Bend	trans	-52.1	-41.8	-176.5	-168.9	-160.9	163.4	0	0	112.3	Q159 R160	Q159-E210 WeakPolarHBondContact CA-OE2 3.48Å; R160-E210 WeakPolarHBondContact CB-OE1 3.18Å; R160-E210 WeakPolarHBondContact CD-OE1 3.28Å; R160-E210 HydrophobicContact CG-CG 4.02Å; R160-E210 WeakPolarHBondContact CG-OE1 3.48Å; R160-E210 PolarHBondContact N-OE2 2.84Å; R160-E210 IonicContact NE-OE1 3.56Å
211	R	97.1	Very high	98.3	Very high	24 Å²	24	49.2 Å²	49.2	9%	0.091	26%	0.255	C	S	.	.	S	Bend	trans	-104.6	107.8	163.5	-178	-140.8	61.8	71.4	7.9	108.2	D158 T205 H209 G213	D158-R211 WeakPolarHBondContact O-CB 3.45Å; D158-R211 PolarHBondContact O-N 3.08Å; D158-R211 IonicContact OD1-CZ 3.69Å; D158-R211 IonicContact OD1-NE 3.59Å; D158-R211 IonicContact OD1-NH2 2.73Å; D158-R211 PolarHBondContact OD1-NH2 3.36Å; T205-R211 PolarHBondContact OG1-NH2 2.85Å; H209-R211 CarbonylContact O-C 3.47Å; H209-R211 PolarHBondContact O-N 3.49Å; R211-G213 PolarHBondContact O-N 2.98Å
212	P	97.1	Very high	98.3	Very high	74 Å²	74	50.5 Å²	50.5	48%	0.481	26%	0.261	S	S	.	.			trans	-58.6	121.6	-179.9	-30.6	38	0	0	0	113.8	R207	R207-P212 WeakPolarHBondContact O-CA 3.32Å; R207-P212 VanDerWaalsContact O-CB 3.25Å; R207-P212 WeakPolarHBondContact O-CB 3.33Å
213	G	98.1	Very high	98.3	Very high	6 Å²	6	61.3 Å²	61.3	6%	0.062	30%	0.301	C	S	.	.			trans	-83.1	-167.5	169	0	0	0	0	0	114.3	L202 T205 D206 R211	L202-G213 WeakPolarHBondContact O-CA 3.47Å; T205-G213 CarbonylContact O-C 3.6Å; T205-G213 VanDerWaalsContact O-C 3.31Å; T205-G213 VanDerWaalsContact O-CA 3.26Å; T205-G213 WeakPolarHBondContact O-CA 3.23Å; T205-G213 WeakPolarHBondContact OG1-CA 3.5Å; D206-G213 PolarHBondContact O-N 2.99Å; R211-G213 PolarHBondContact O-N 2.98Å
214	G	98.6	Very high	98.2	Very high	2 Å²	2	65.4 Å²	65.4	2%	0.021	33%	0.329	C	S	.	.			trans	-107.6	-4.2	-175.6	0	0	0	0	0	116.7	T181 V182 L202 L203 T205 A216	T181-G214 CarbonylContact C-O 3.23Å; T181-G214 VanDerWaalsContact C-O 3.24Å; T181-G214 WeakPolarHBondContact CB-O 3.48Å; T181-G214 WeakPolarHBondContact OG1-CA 3.36Å; T181-G214 PolarHBondContact OG1-O 3.05Å; V182-G214 PolarHBondContact N-O 3.3Å; L202-G214 PolarHBondContact O-N 3.49Å; L202-G214 VanDerWaalsContact O-N 3.1Å; L203-G214 CarbonylContact O-C 3.45Å; L203-G214 VanDerWaalsContact O-C 3.23Å; L203-G214 VanDerWaalsContact O-CA 3.28Å; L203-G214 WeakPolarHBondContact O-CA 3.43Å; T205-G214 PolarHBondContact O-N 3.44Å; T205-G214 VanDerWaalsContact O-N 3.1Å; G214-A216 PolarHBondContact O-N 3.02Å; G214-A216 VanDerWaalsContact O-N 3.11Å
215	D	98.8	Very high	98.2	Very high	42 Å²	42	63 Å²	63	23%	0.225	32%	0.32	C	S	.	.			trans	50.4	31.6	-178.3	-76.4	-50.1	0	0	0	114.3	V182 G183 L203 T205 D206 R207	V182-D215 HydrophobicContact CB-CB 4.44Å; V182-D215 HydrophobicContact CG1-CB 4.35Å; V182-D215 HydrophobicContact CG2-CB 4.19Å; G183-D215 PolarHBondContact N-O 3.33Å; L203-D215 PolarHBondContact O-N 2.88Å; T205-D215 PolarHBondContact O-N 3.16Å; D206-D215 WeakPolarHBondContact CA-OD1 3.26Å; R207-D215 WeakPolarHBondContact CB-OD2 3.47Å; R207-D215 WeakPolarHBondContact CG-OD2 3.23Å; R207-D215 IonicContact CZ-OD2 3.4Å; R207-D215 PolarHBondContact N-OD2 3.01Å; R207-D215 IonicContact NE-OD2 2.67Å; R207-D215 PolarHBondContact NE-OD2 3.4Å; R207-D215 IonicContact NH2-OD2 3.3Å; R207-D215 PolarHBondContact NH2-OD2 3.3Å
216	A	98.9	Very high	98.2	Very high	7 Å²	7	66 Å²	66	6%	0.058	34%	0.34	C	S	.	.			trans	-90.8	149.2	178.8	0	0	0	0	0	112.3	T181 K184 V186 L203 H204 G214 V218	T181-A216 WeakPolarHBondContact O-CA 3.37Å; T181-A216 WeakPolarHBondContact O-CB 3.36Å; K184-A216 WeakPolarHBondContact O-CA 3.45Å; V186-A216 HydrophobicContact CB-CB 4.29Å; V186-A216 HydrophobicContact CG2-CB 3.46Å; V186-A216 VanDerWaalsContact CG2-CB 3.46Å; L203-A216 VanDerWaalsContact O-CB 3.23Å; L203-A216 WeakPolarHBondContact O-CB 3.16Å; L203-A216 PolarHBondContact O-N 3.42Å; H204-A216 VanDerWaalsContact CA-O 3.31Å; H204-A216 WeakPolarHBondContact CA-O 3.5Å; G214-A216 PolarHBondContact O-N 3.02Å; G214-A216 VanDerWaalsContact O-N 3.11Å; A216-V218 HydrophobicContact CB-CG2 4.15Å; A216-V218 PolarHBondContact O-N 3.09Å
217	T	98.9	Very high	98.2	Very high	84 Å²	84	68.7 Å²	68.7	52%	0.515	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	102	165.7	-59.2	0	0	0	0	108.5	K184 N185 V186	K184-T217 PolarHBondContact O-N 2.83Å; N185-T217 WeakPolarHBondContact CA-O 3.12Å; V186-T217 PolarHBondContact N-O 2.85Å
218	V	98.9	Very high	98.2	Very high	35 Å²	35	67.1 Å²	67.1	21%	0.212	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.3	-174.1	-177.8	0	0	0	0	112.3	V186 V188 A200 L203 H204 A216 I220	V186-V218 HydrophobicContact CB-CG2 3.96Å; V186-V218 HydrophobicContact CG1-CG1 4.31Å; V186-V218 HydrophobicContact CG1-CG2 4.19Å; V186-V218 CarbonylContact O-C 3.54Å; V186-V218 WeakPolarHBondContact O-CA 3.41Å; V188-V218 HydrophobicContact CG2-CG1 4.03Å; A200-V218 HydrophobicContact CB-CG1 3.84Å; L203-V218 HydrophobicContact CB-CG2 3.83Å; H204-V218 HydrophobicContact CB-CB 3.98Å; H204-V218 HydrophobicContact CB-CG2 3.5Å; H204-V218 VanDerWaalsContact CB-CG2 3.5Å; A216-V218 HydrophobicContact CB-CG2 4.15Å; A216-V218 PolarHBondContact O-N 3.09Å; V218-I220 HydrophobicContact CG1-CG1 4.35Å
219	T	98.9	Very high	98.3	Very high	54 Å²	54	64.8 Å²	64.8	33%	0.331	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.5	167	-61.4	0	0	0	0	110.2	V186 L187 V188 L233	V186-T219 PolarHBondContact O-N 2.8Å; L187-T219 WeakPolarHBondContact CA-O 3.48Å; L187-T219 HydrophobicContact CD1-CG2 4.11Å; V188-T219 PolarHBondContact N-O 2.93Å; T219-L233 HydrophobicContact CG2-CD1 3.89Å; T219-L233 HydrophobicContact CG2-CD2 4.1Å; T219-L233 HydrophobicContact CG2-CG 4.38Å
220	I	98.9	Very high	98.3	Very high	71 Å²	71	61 Å²	61	36%	0.364	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.1	176.2	-56.3	174.3	0	0	0	109.4	R191 A200 V218	R191-I220 HydrophobicContact CB-CG2 3.96Å; A200-I220 HydrophobicContact CB-CD1 3.67Å; A200-I220 HydrophobicContact CB-CG1 3.87Å; V218-I220 HydrophobicContact CG1-CG1 4.35Å
221	A	98.7	Very high	98.4	Very high	2 Å²	2	60.1 Å²	60.1	2%	0.017	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	157.3	170.4	0	0	0	0	0	110.9	L187 V188 G190 T225 L230	L187-A221 HydrophobicContact CD1-CB 4.46Å; V188-A221 PolarHBondContact O-N 3.07Å; G190-A221 PolarHBondContact N-O 3.09Å; A221-T225 HydrophobicContact CB-CG2 4.17Å; A221-L230 HydrophobicContact CB-CD1 3.68Å
222	H	98.5	Very high	98.4	Very high	65 Å²	65	64.4 Å²	64.4	30%	0.301	33%	0.328	S	S	.	.			trans	-156.7	-178.9	-175.6	53.7	50.4	0	0	0	111.7	R191 C224 T225	R191-H222 HydrophobicContact CB-CB 4.46Å; R191-H222 HydrophobicContact CG-CB 3.81Å; R191-H222 PolarHBondContact NH1-CD2 2.8Å; R191-H222 PolarHBondContact NH1-NE2 2.73Å; R191-H222 VanDerWaalsContact NH1-NE2 3.16Å; H222-C224 PolarHBondContact ND1-N 3.19Å; H222-C224 PolarHBondContact O-N 2.84Å; H222-T225 PolarHBondContact N-OG1 3.09Å; H222-T225 PolarHBondContact ND1-OG1 2.81Å; H222-T225 VanDerWaalsContact O-CB 3.26Å; H222-T225 WeakPolarHBondContact O-CB 3.2Å; H222-T225 PolarHBondContact O-N 3.24Å; H222-T225 PolarHBondContact O-OG1 3.26Å
223	R	97.7	Very high	98.5	Very high	231 Å²	231	62.8 Å²	62.8	87%	0.872	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-28.2	-177.3	61.2	172.1	156.7	-122.8	0.4	116.4
224	C	98.2	Very high	98.5	Very high	88 Å²	88	62.5 Å²	62.5	60%	0.595	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	0.5	177.5	-51.2	0	0	0	0	114	H222 P226	H222-C224 PolarHBondContact ND1-N 3.19Å; H222-C224 PolarHBondContact O-N 2.84Å; C224-P226 WeakPolarHBondContact O-CD 3.26Å
225	T	98.6	Very high	98.5	Very high	29 Å²	29	65.6 Å²	65.6	18%	0.178	33%	0.328	C	S	.	.	S	Bend	trans	-78.9	117.5	175.9	-55.9	0	0	0	0	108.2	A221 H222 Q229 L230 L233	A221-T225 HydrophobicContact CB-CG2 4.17Å; H222-T225 PolarHBondContact N-OG1 3.09Å; H222-T225 PolarHBondContact ND1-OG1 2.81Å; H222-T225 VanDerWaalsContact O-CB 3.26Å; H222-T225 WeakPolarHBondContact O-CB 3.2Å; H222-T225 PolarHBondContact O-N 3.24Å; H222-T225 PolarHBondContact O-OG1 3.26Å; T225-Q229 HydrophobicContact CG2-CB 4.27Å; T225-Q229 HydrophobicContact CG2-CG 4.23Å; T225-L230 HydrophobicContact CG2-CB 4.23Å; T225-L233 HydrophobicContact CG2-CD1 4.48Å
226	P	98.5	Very high	98.5	Very high	74 Å²	74	68.7 Å²	68.7	48%	0.481	34%	0.344	S	S	.	.			trans	-57.3	148.7	178.4	-27	37.2	0	0	0	112.1	C224 D228 Q229 L230	C224-P226 WeakPolarHBondContact O-CD 3.26Å; P226-D228 VanDerWaalsContact C-N 3.3Å; P226-D228 VanDerWaalsContact CB-OD1 3.23Å; P226-D228 WeakPolarHBondContact CB-OD1 3.29Å; P226-D228 PolarHBondContact O-N 2.8Å; P226-Q229 HydrophobicContact CB-CB 4.18Å; P226-Q229 HydrophobicContact CG-CB 4.49Å; P226-Q229 WeakPolarHBondContact O-CB 3.25Å; P226-Q229 PolarHBondContact O-N 3.42Å; P226-Q229 VanDerWaalsContact O-N 3.11Å; P226-L230 PolarHBondContact O-N 3.23Å
227	R	97.6	Very high	98.5	Very high	112 Å²	112	68.4 Å²	68.4	42%	0.423	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-37.9	-174.4	-171.7	69.4	179.3	83.6	-3.1	112.8	L230 K231 L249 T251 M254	R227-L230 PolarHBondContact O-N 3.25Å; R227-K231 PolarHBondContact O-N 3.04Å; R227-L249 PolarHBondContact NH2-O 3.02Å; R227-T251 PolarHBondContact NH2-OG1 2.73Å; R227-M254 PolarHBondContact NH1-SD 2.9Å; R227-M254 PolarHBondContact NH2-SD 2.78Å
228	D	98	Very high	98.5	Very high	88 Å²	88	66.5 Å²	66.5	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-68.4	-39.7	176.5	73.1	-57.3	0	0	0	111.1	P226 K231 K232	P226-D228 VanDerWaalsContact C-N 3.3Å; P226-D228 VanDerWaalsContact CB-OD1 3.23Å; P226-D228 WeakPolarHBondContact CB-OD1 3.29Å; P226-D228 PolarHBondContact O-N 2.8Å; D228-K231 PolarHBondContact O-N 2.95Å; D228-K232 WeakPolarHBondContact O-CG 3.45Å; D228-K232 PolarHBondContact O-N 3.04Å; D228-K232 IonicContact OD2-NZ 2.83Å; D228-K232 PolarHBondContact OD2-NZ 3.25Å
229	Q	98.7	Very high	98.5	Very high	77 Å²	77	64.9 Å²	64.9	36%	0.36	32%	0.318	S	S	.	.	H	α-helix	trans	-65.2	-43.3	174	-172.6	61.4	19.2	0	0	111.2	T225 P226 K231 K232 L233	T225-Q229 HydrophobicContact CG2-CB 4.27Å; T225-Q229 HydrophobicContact CG2-CG 4.23Å; P226-Q229 HydrophobicContact CB-CB 4.18Å; P226-Q229 HydrophobicContact CG-CB 4.49Å; P226-Q229 WeakPolarHBondContact O-CB 3.25Å; P226-Q229 PolarHBondContact O-N 3.42Å; P226-Q229 VanDerWaalsContact O-N 3.11Å; Q229-K231 VanDerWaalsContact C-N 3.28Å; Q229-K231 PolarHBondContact O-N 3.11Å; Q229-K232 PolarHBondContact O-N 3.42Å; Q229-L233 HydrophobicContact CG-CD1 4.09Å; Q229-L233 HydrophobicContact CG-CG 4.49Å; Q229-L233 VanDerWaalsContact O-CG 3.29Å; Q229-L233 WeakPolarHBondContact O-CG 3.36Å; Q229-L233 PolarHBondContact O-N 2.97Å
230	L	98.7	Very high	98.5	Very high	10 Å²	10	62.3 Å²	62.3	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-43	174.8	179.5	63.7	0	0	0	111.2	L187 A221 T225 P226 R227 L233 T234 L249 M254	L187-L230 HydrophobicContact CD1-CD1 4.47Å; L187-L230 HydrophobicContact CD2-CD1 4.12Å; A221-L230 HydrophobicContact CB-CD1 3.68Å; T225-L230 HydrophobicContact CG2-CB 4.23Å; P226-L230 PolarHBondContact O-N 3.23Å; R227-L230 PolarHBondContact O-N 3.25Å; L230-L233 PolarHBondContact O-N 3.37Å; L230-T234 HydrophobicContact CD1-CG2 4Å; L230-T234 HydrophobicContact CG-CG2 4.3Å; L230-T234 WeakPolarHBondContact O-CB 3.29Å; L230-T234 VanDerWaalsContact O-CG2 3.3Å; L230-T234 WeakPolarHBondContact O-CG2 3.48Å; L230-T234 PolarHBondContact O-N 3.07Å; L230-T234 PolarHBondContact O-OG1 3.3Å; L230-L249 HydrophobicContact CD2-CD1 3.78Å; L230-L249 HydrophobicContact CD2-CD2 4.44Å; L230-L249 HydrophobicContact CD2-CG 4.09Å; L230-M254 HydrophobicContact CD2-CE 3.86Å; L230-M254 HydrophobicContact CG-CE 3.7Å
231	K	98.6	Very high	98.5	Very high	88 Å²	88	59 Å²	59	38%	0.383	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-44.2	175.5	-179.2	170.5	175.1	172.2	0	112.4	R227 D228 Q229 L233 T234 I235 D253 M254	R227-K231 PolarHBondContact O-N 3.04Å; D228-K231 PolarHBondContact O-N 2.95Å; Q229-K231 VanDerWaalsContact C-N 3.28Å; Q229-K231 PolarHBondContact O-N 3.11Å; K231-L233 VanDerWaalsContact C-N 3.27Å; K231-L233 PolarHBondContact O-N 2.99Å; K231-T234 VanDerWaalsContact CA-OG1 3.26Å; K231-T234 WeakPolarHBondContact CA-OG1 3.47Å; K231-T234 PolarHBondContact O-N 3.38Å; K231-T234 PolarHBondContact O-OG1 2.86Å; K231-T234 VanDerWaalsContact O-OG1 3.05Å; K231-I235 PolarHBondContact O-N 3.03Å; K231-I235 VanDerWaalsContact O-N 3.12Å; K231-D253 WeakPolarHBondContact CD-OD2 3.28Å; K231-D253 WeakPolarHBondContact CE-OD2 3.3Å; K231-D253 IonicContact NZ-OD2 2.62Å; K231-D253 PolarHBondContact NZ-OD2 3.09Å; K231-M254 HydrophobicContact CB-CG 4.29Å; K231-M254 HydrophobicContact CD-CG 4.49Å; K231-M254 HydrophobicContact CG-CG 4.08Å
232	K	98.5	Very high	98.5	Very high	113 Å²	113	58.9 Å²	58.9	49%	0.491	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-35.4	176.5	-70	164.8	-175	156	0	112.5	D228 Q229 I235	D228-K232 WeakPolarHBondContact O-CG 3.45Å; D228-K232 PolarHBondContact O-N 3.04Å; D228-K232 IonicContact OD2-NZ 2.83Å; D228-K232 PolarHBondContact OD2-NZ 3.25Å; Q229-K232 PolarHBondContact O-N 3.42Å; K232-I235 WeakPolarHBondContact O-CG2 3.17Å
233	L	98.6	Very high	98.4	Very high	41 Å²	41	56.5 Å²	56.5	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-79.3	-43.6	179.6	-63.5	169.5	0	0	0	112	L187 T219 T225 Q229 L230 K231 I235 L236	L187-L233 HydrophobicContact CD1-CB 3.37Å; L187-L233 HydrophobicContact CD1-CD1 4.37Å; L187-L233 HydrophobicContact CD1-CG 4.49Å; T219-L233 HydrophobicContact CG2-CD1 3.89Å; T219-L233 HydrophobicContact CG2-CD2 4.1Å; T219-L233 HydrophobicContact CG2-CG 4.38Å; T225-L233 HydrophobicContact CG2-CD1 4.48Å; Q229-L233 HydrophobicContact CG-CD1 4.09Å; Q229-L233 HydrophobicContact CG-CG 4.49Å; Q229-L233 VanDerWaalsContact O-CG 3.29Å; Q229-L233 WeakPolarHBondContact O-CG 3.36Å; Q229-L233 PolarHBondContact O-N 2.97Å; L230-L233 PolarHBondContact O-N 3.37Å; K231-L233 VanDerWaalsContact C-N 3.27Å; K231-L233 PolarHBondContact O-N 2.99Å; L233-I235 VanDerWaalsContact C-N 3.33Å; L233-I235 PolarHBondContact O-N 2.81Å; L233-L236 PolarHBondContact O-N 3.2Å
234	T	98.4	Very high	98.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-34.8	-179.7	42.9	0	0	0	0	112.9	L187 L230 K231 L236 A237 I240 I250 M254	L187-T234 HydrophobicContact CD1-CG2 4.15Å; L187-T234 HydrophobicContact CD2-CG2 3.44Å; L187-T234 VanDerWaalsContact CD2-CG2 3.44Å; L187-T234 HydrophobicContact CG-CG2 4.31Å; L230-T234 HydrophobicContact CD1-CG2 4Å; L230-T234 HydrophobicContact CG-CG2 4.3Å; L230-T234 WeakPolarHBondContact O-CB 3.29Å; L230-T234 VanDerWaalsContact O-CG2 3.3Å; L230-T234 WeakPolarHBondContact O-CG2 3.48Å; L230-T234 PolarHBondContact O-N 3.07Å; L230-T234 PolarHBondContact O-OG1 3.3Å; K231-T234 VanDerWaalsContact CA-OG1 3.26Å; K231-T234 WeakPolarHBondContact CA-OG1 3.47Å; K231-T234 PolarHBondContact O-N 3.38Å; K231-T234 PolarHBondContact O-OG1 2.86Å; K231-T234 VanDerWaalsContact O-OG1 3.05Å; T234-L236 PolarHBondContact O-N 3.47Å; T234-A237 WeakPolarHBondContact O-CB 3.18Å; T234-A237 PolarHBondContact O-N 2.9Å; T234-A237 VanDerWaalsContact O-N 3.12Å; T234-I240 HydrophobicContact CG2-CD1 4.36Å; T234-I250 HydrophobicContact CG2-CD1 4.15Å; T234-M254 CarbonylContact C-O 3.54Å; T234-M254 WeakPolarHBondContact CB-O 3.29Å; T234-M254 HydrophobicContact CG2-CE 3.84Å; T234-M254 WeakPolarHBondContact OG1-CB 3.49Å; T234-M254 WeakPolarHBondContact OG1-CE 3.1Å; T234-M254 PolarHBondContact OG1-O 2.78Å
235	I	97.9	Very high	98.3	Very high	67 Å²	67	45.6 Å²	45.6	34%	0.344	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.7	179.4	-155	65.6	0	0	0	113.2	K231 K232 L233 M254 K256	K231-I235 PolarHBondContact O-N 3.03Å; K231-I235 VanDerWaalsContact O-N 3.12Å; K232-I235 WeakPolarHBondContact O-CG2 3.17Å; L233-I235 VanDerWaalsContact C-N 3.33Å; L233-I235 PolarHBondContact O-N 2.81Å; I235-M254 WeakPolarHBondContact CA-O 3.38Å; I235-M254 PolarHBondContact N-O 3.06Å; I235-K256 HydrophobicContact CD1-CB 4.44Å; I235-K256 WeakPolarHBondContact O-CB 3.41Å
236	L	98.1	Very high	98.2	Very high	106 Å²	106	47.4 Å²	47.4	56%	0.555	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-21.7	176.3	-60.5	175.8	0	0	0	112.2	N185 L233 T234 K256	N185-L236 PolarHBondContact ND2-O 2.91Å; L233-L236 PolarHBondContact O-N 3.2Å; T234-L236 PolarHBondContact O-N 3.47Å; L236-K256 PolarHBondContact O-NZ 2.81Å
237	A	98.8	Very high	98.1	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	26%	0.256	C	S	.	.			trans	-73	129.1	-171.5	0	0	0	0	0	112.3	N185 L187 T234 I239 I240 K256	N185-A237 CarbonylContact O-C 3.54Å; N185-A237 WeakPolarHBondContact O-CA 3.41Å; L187-A237 HydrophobicContact CB-CB 3.9Å; T234-A237 WeakPolarHBondContact O-CB 3.18Å; T234-A237 PolarHBondContact O-N 2.9Å; T234-A237 VanDerWaalsContact O-N 3.12Å; A237-I239 VanDerWaalsContact C-N 3.34Å; A237-I240 HydrophobicContact CB-CG1 3.77Å; A237-K256 VanDerWaalsContact C-CE 3.48Å; A237-K256 WeakPolarHBondContact O-CD 3.37Å; A237-K256 WeakPolarHBondContact O-CE 3.06Å; A237-K256 WeakPolarHBondContact O-CG 3.48Å
238	D	98.9	Very high	98	Very high	44 Å²	44	43.7 Å²	43.7	24%	0.235	25%	0.253	C	S	.	.	S	Bend	trans	-72.2	-32.2	164.8	-61.1	-70.6	0	0	0	111.4	K184 N185 K256 A259 A260	K184-D238 HydrophobicContact CB-CB 3.92Å; K184-D238 HydrophobicContact CD-CB 4.25Å; K184-D238 HydrophobicContact CG-CB 4.32Å; N185-D238 PolarHBondContact N-OD2 3.34Å; N185-D238 PolarHBondContact O-N 2.87Å; D238-K256 VanDerWaalsContact OD1-CE 3.23Å; D238-K256 WeakPolarHBondContact OD1-CE 3.43Å; D238-K256 IonicContact OD1-NZ 2.67Å; D238-K256 PolarHBondContact OD1-NZ 2.89Å; D238-K256 IonicContact OD2-NZ 3.45Å; D238-K256 PolarHBondContact OD2-NZ 3.49Å; D238-A259 CarbonylContact O-C 3.53Å; D238-A259 VanDerWaalsContact O-CA 3.27Å; D238-A259 WeakPolarHBondContact O-CA 3.42Å; D238-A259 WeakPolarHBondContact O-CB 3.3Å; D238-A260 PolarHBondContact O-N 3.26Å
239	I	98.9	Very high	98	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	126.4	179.6	-49.4	176.9	0	0	0	109.1	I179 T181 N185 V186 L187 A237 I241 A260	I179-I239 HydrophobicContact CG2-CD1 3.68Å; I179-I239 HydrophobicContact CG2-CG1 4.09Å; T181-I239 HydrophobicContact CG2-CD1 3.84Å; N185-I239 PolarHBondContact O-N 2.86Å; N185-I239 VanDerWaalsContact O-N 3.15Å; V186-I239 CarbonylContact C-O 3.53Å; V186-I239 WeakPolarHBondContact CA-O 3.44Å; V186-I239 HydrophobicContact CG2-CB 4.03Å; V186-I239 HydrophobicContact CG2-CD1 4.15Å; V186-I239 HydrophobicContact CG2-CG1 4.41Å; L187-I239 PolarHBondContact N-O 3.47Å; A237-I239 VanDerWaalsContact C-N 3.34Å; I239-I241 HydrophobicContact CG2-CD1 3.84Å; I239-I241 HydrophobicContact CG2-CG1 4.5Å; I239-A260 CarbonylContact C-O 3.24Å; I239-A260 WeakPolarHBondContact CA-O 3.17Å; I239-A260 HydrophobicContact CG1-CB 4.37Å; I239-A260 HydrophobicContact CG2-CB 4.37Å
240	I	98.9	Very high	98	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.4	174.7	-60.9	167.3	0	0	0	108	L187 T234 A237 I250 V255 A260 V261 I262	L187-I240 HydrophobicContact CD2-CG2 4.3Å; L187-I240 WeakPolarHBondContact O-CA 3.2Å; T234-I240 HydrophobicContact CG2-CD1 4.36Å; A237-I240 HydrophobicContact CB-CG1 3.77Å; I240-I250 HydrophobicContact CG2-CD1 4.33Å; I240-I250 HydrophobicContact CG2-CG1 4.29Å; I240-I250 HydrophobicContact CG2-CG2 4.37Å; I240-V255 HydrophobicContact CD1-CB 4.4Å; I240-V255 HydrophobicContact CD1-CG1 4.39Å; I240-V255 HydrophobicContact CD1-CG2 3.9Å; I240-A260 PolarHBondContact N-O 3.05Å; I240-V261 HydrophobicContact CB-CG2 4.45Å; I240-V261 WeakPolarHBondContact O-CA 3.37Å; I240-I262 PolarHBondContact O-N 3.33Å
241	I	98.9	Very high	98	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	115	170.2	-45.6	-63.4	0	0	0	108.5	V170 I174 L187 V188 A189 I199 L203 I239 I262 V264	V170-I241 HydrophobicContact CG1-CD1 3.73Å; V170-I241 HydrophobicContact CG1-CG2 4.47Å; I174-I241 HydrophobicContact CD1-CD1 4.23Å; L187-I241 PolarHBondContact O-N 2.97Å; V188-I241 HydrophobicContact CG1-CB 4.42Å; V188-I241 HydrophobicContact CG2-CB 4.33Å; V188-I241 HydrophobicContact CG2-CG1 4.28Å; A189-I241 PolarHBondContact N-O 3.38Å; I199-I241 HydrophobicContact CD1-CG2 4.04Å; I199-I241 HydrophobicContact CG2-CB 4.38Å; I199-I241 HydrophobicContact CG2-CG1 4Å; I199-I241 HydrophobicContact CG2-CG2 4.14Å; L203-I241 HydrophobicContact CD1-CG1 4.13Å; I239-I241 HydrophobicContact CG2-CD1 3.84Å; I239-I241 HydrophobicContact CG2-CG1 4.5Å; I241-I262 WeakPolarHBondContact CA-O 3.34Å; I241-I262 HydrophobicContact CD1-CB 3.61Å; I241-I262 HydrophobicContact CD1-CG1 3.64Å; I241-I262 HydrophobicContact CD1-CG2 4.37Å; I241-V264 HydrophobicContact CG2-CG2 3.63Å
242	A	98.6	Very high	98	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.8	177.9	0	0	0	0	0	110.2	I250 I262 V264 G265 D282 V283	A242-I250 HydrophobicContact CB-CG1 3.95Å; A242-I262 PolarHBondContact N-O 3.26Å; A242-V264 WeakPolarHBondContact O-CA 3.18Å; A242-V264 VanDerWaalsContact O-CB 3.23Å; A242-V264 WeakPolarHBondContact O-CB 3.41Å; A242-V264 PolarHBondContact O-N 3.49Å; A242-G265 PolarHBondContact O-N 3.03Å; A242-D282 HydrophobicContact CB-CB 3.75Å; A242-V283 HydrophobicContact CB-CG2 3.79Å
243	A	98.1	Very high	97.9	Very high	16 Å²	16	33.6 Å²	33.6	13%	0.132	22%	0.217	C	C	.	.			trans	-143.3	43.4	-174.3	0	0	0	0	0	111.2	A189 V195 V264	A189-A243 CarbonylContact O-C 3.13Å; A189-A243 WeakPolarHBondContact O-CA 3.42Å; A189-A243 PolarHBondContact O-N 2.89Å; V195-A243 HydrophobicContact CG1-CB 3.84Å; A243-V264 HydrophobicContact CB-CB 3.91Å; A243-V264 HydrophobicContact CB-CG1 4.32Å; A243-V264 HydrophobicContact CB-CG2 4.27Å
244	A	97.3	Very high	97.9	Very high	47 Å²	47	31.6 Å²	31.6	39%	0.388	21%	0.206	S	C	.	.	S	Bend	trans	-103.6	-22.8	-173.3	0	0	0	0	0	113.2	A189 V246 L249 D282	A189-A244 PolarHBondContact O-N 2.96Å; A244-V246 HydrophobicContact CB-CG2 4.27Å; A244-L249 HydrophobicContact CB-CD2 3.55Å; A244-D282 WeakPolarHBondContact CA-OD2 3.17Å; A244-D282 PolarHBondContact N-OD2 3.22Å
245	G	95.9	Very high	97.9	Very high	42 Å²	42	31.6 Å²	31.6	43%	0.433	21%	0.206	S	C	.	.			trans	70.2	42	-173.4	0	0	0	0	0	112	N267 D282	G245-N267 WeakPolarHBondContact CA-OD1 3.38Å; G245-N267 PolarHBondContact O-OD1 3.42Å; G245-D282 VanDerWaalsContact CA-OD1 3.28Å; G245-D282 WeakPolarHBondContact CA-OD1 3.48Å; G245-D282 PolarHBondContact N-OD1 2.87Å; G245-D282 PolarHBondContact N-OD2 3.25Å
246	V	96.6	Very high	97.9	Very high	68 Å²	68	30.9 Å²	30.9	41%	0.412	20%	0.201	S	C	.	.			trans	-132.3	106.6	-179.1	-179.1	0	0	0	0	108.6	A244 G248 L249 D282	A244-V246 HydrophobicContact CB-CG2 4.27Å; V246-G248 PolarHBondContact O-N 3.37Å; V246-L249 HydrophobicContact CB-CB 4.06Å; V246-L249 HydrophobicContact CB-CD2 4.35Å; V246-L249 HydrophobicContact CG1-CB 4.11Å; V246-L249 HydrophobicContact CG1-CD1 4.39Å; V246-L249 VanDerWaalsContact O-CB 3.3Å; V246-L249 WeakPolarHBondContact O-CB 3.46Å; V246-L249 PolarHBondContact O-N 3Å; V246-D282 PolarHBondContact N-OD1 2.89Å; V246-D282 VanDerWaalsContact O-CA 3.29Å; V246-D282 WeakPolarHBondContact O-CA 3.38Å
247	P	96.4	Very high	97.8	Very high	72 Å²	72	34 Å²	34	47%	0.468	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	130.4	-179.7	-27.1	33.8	0	0	0	113.3	L249 N267 I280 G281	P247-L249 PolarHBondContact O-N 2.98Å; P247-N267 HydrophobicContact CG-CB 3.66Å; P247-I280 HydrophobicContact CB-CD1 3.83Å; P247-I280 HydrophobicContact CB-CG1 4.47Å; P247-I280 HydrophobicContact CG-CD1 4.18Å; P247-G281 WeakPolarHBondContact CA-O 3.15Å
248	G	94.7	Very high	97.7	Very high	35 Å²	35	36.2 Å²	36.2	36%	0.361	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	22.3	175.7	0	0	0	0	0	114.7	V246 I250 D282	V246-G248 PolarHBondContact O-N 3.37Å; G248-I250 VanDerWaalsContact C-N 3.3Å; G248-I250 PolarHBondContact O-N 2.81Å; G248-D282 CarbonylContact C-O 3.56Å; G248-D282 PolarHBondContact N-O 2.9Å
249	L	98.2	Very high	97.7	Very high	29 Å²	29	34.2 Å²	34.2	15%	0.152	22%	0.222	C	C	.	.			trans	-58.2	-41.3	175.4	178.6	63.2	0	0	0	112.3	A189 R227 L230 A244 V246 P247 M254 D282	A189-L249 HydrophobicContact CB-CD2 4.4Å; R227-L249 PolarHBondContact NH2-O 3.02Å; L230-L249 HydrophobicContact CD2-CD1 3.78Å; L230-L249 HydrophobicContact CD2-CD2 4.44Å; L230-L249 HydrophobicContact CD2-CG 4.09Å; A244-L249 HydrophobicContact CB-CD2 3.55Å; V246-L249 HydrophobicContact CB-CB 4.06Å; V246-L249 HydrophobicContact CB-CD2 4.35Å; V246-L249 HydrophobicContact CG1-CB 4.11Å; V246-L249 HydrophobicContact CG1-CD1 4.39Å; V246-L249 VanDerWaalsContact O-CB 3.3Å; V246-L249 WeakPolarHBondContact O-CB 3.46Å; V246-L249 PolarHBondContact O-N 3Å; P247-L249 PolarHBondContact O-N 2.98Å; L249-M254 VanDerWaalsContact O-SD 3.39Å; L249-D282 PolarHBondContact N-O 3.04Å
250	I	98.6	Very high	97.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-100.9	118.6	178.9	-52.2	-58.1	0	0	0	109.7	T234 I240 A242 G248 M254 V255 D282 V283 D284	T234-I250 HydrophobicContact CG2-CD1 4.15Å; I240-I250 HydrophobicContact CG2-CD1 4.33Å; I240-I250 HydrophobicContact CG2-CG1 4.29Å; I240-I250 HydrophobicContact CG2-CG2 4.37Å; A242-I250 HydrophobicContact CB-CG1 3.95Å; G248-I250 VanDerWaalsContact C-N 3.3Å; G248-I250 PolarHBondContact O-N 2.81Å; I250-M254 HydrophobicContact CD1-CE 3.74Å; I250-V255 HydrophobicContact CG2-CG2 3.76Å; I250-D282 PolarHBondContact N-O 3.12Å; I250-V283 HydrophobicContact CB-CG1 4.39Å; I250-V283 HydrophobicContact CB-CG2 4.11Å; I250-V283 HydrophobicContact CG1-CG2 4.42Å; I250-D284 PolarHBondContact O-N 3.11Å
251	T	98.6	Very high	97.7	Very high	30 Å²	30	34.2 Å²	34.2	18%	0.184	22%	0.223	C	C	.	.			trans	-116.9	163	-175.7	51	0	0	0	0	112	R227 D253 M254 D284	R227-T251 PolarHBondContact NH2-OG1 2.73Å; T251-D253 VanDerWaalsContact CB-OD1 3.31Å; T251-D253 WeakPolarHBondContact CB-OD1 3.37Å; T251-D253 PolarHBondContact O-N 2.98Å; T251-D253 VanDerWaalsContact O-N 3.12Å; T251-D253 PolarHBondContact OG1-OD1 2.91Å; T251-M254 PolarHBondContact N-SD 2.94Å; T251-M254 VanDerWaalsContact N-SD 3.41Å; T251-M254 VanDerWaalsContact O-CB 3.31Å; T251-M254 WeakPolarHBondContact O-CB 3.39Å; T251-M254 PolarHBondContact O-N 2.81Å; T251-M254 PolarHBondContact OG1-SD 2.94Å; T251-M254 VanDerWaalsContact OG1-SD 3.33Å; T251-D284 HydrophobicContact CG2-CB 4.33Å
252	A	97.9	Very high	97.7	Very high	30 Å²	30	34.2 Å²	34.2	25%	0.248	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-55.5	-32.9	-175	0	0	0	0	0	114.5	M254 V255 G287 K291	A252-M254 PolarHBondContact O-N 2.91Å; A252-V255 PolarHBondContact O-N 3.37Å; A252-G287 WeakPolarHBondContact CB-O 3.47Å; A252-K291 WeakPolarHBondContact O-CD 3.35Å; A252-K291 PolarHBondContact O-NZ 2.82Å
253	D	97.8	Very high	97.7	Very high	75 Å²	75	34.5 Å²	34.5	40%	0.401	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-73.6	-11.3	179	68.6	-60.9	0	0	0	113.8	K231 T251	K231-D253 WeakPolarHBondContact CD-OD2 3.28Å; K231-D253 WeakPolarHBondContact CE-OD2 3.3Å; K231-D253 IonicContact NZ-OD2 2.62Å; K231-D253 PolarHBondContact NZ-OD2 3.09Å; T251-D253 VanDerWaalsContact CB-OD1 3.31Å; T251-D253 WeakPolarHBondContact CB-OD1 3.37Å; T251-D253 PolarHBondContact O-N 2.98Å; T251-D253 VanDerWaalsContact O-N 3.12Å; T251-D253 PolarHBondContact OG1-OD1 2.91Å
254	M	98.5	Very high	97.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-96.1	-19.4	178.2	-61	171.9	68.1	0	0	113.7	R227 L230 K231 T234 I235 L249 I250 T251 A252	R227-M254 PolarHBondContact NH1-SD 2.9Å; R227-M254 PolarHBondContact NH2-SD 2.78Å; L230-M254 HydrophobicContact CD2-CE 3.86Å; L230-M254 HydrophobicContact CG-CE 3.7Å; K231-M254 HydrophobicContact CB-CG 4.29Å; K231-M254 HydrophobicContact CD-CG 4.49Å; K231-M254 HydrophobicContact CG-CG 4.08Å; T234-M254 CarbonylContact C-O 3.54Å; T234-M254 WeakPolarHBondContact CB-O 3.29Å; T234-M254 HydrophobicContact CG2-CE 3.84Å; T234-M254 WeakPolarHBondContact OG1-CB 3.49Å; T234-M254 WeakPolarHBondContact OG1-CE 3.1Å; T234-M254 PolarHBondContact OG1-O 2.78Å; I235-M254 WeakPolarHBondContact CA-O 3.38Å; I235-M254 PolarHBondContact N-O 3.06Å; L249-M254 VanDerWaalsContact O-SD 3.39Å; I250-M254 HydrophobicContact CD1-CE 3.74Å; T251-M254 PolarHBondContact N-SD 2.94Å; T251-M254 VanDerWaalsContact N-SD 3.41Å; T251-M254 VanDerWaalsContact O-CB 3.31Å; T251-M254 WeakPolarHBondContact O-CB 3.39Å; T251-M254 PolarHBondContact O-N 2.81Å; T251-M254 PolarHBondContact OG1-SD 2.94Å; T251-M254 VanDerWaalsContact OG1-SD 3.33Å; A252-M254 PolarHBondContact O-N 2.91Å
255	V	98.4	Very high	97.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-94.3	131.9	-174	-179.6	0	0	0	0	108.8	I240 I250 A252 A259 V261 V288 K291 A292	I240-V255 HydrophobicContact CD1-CB 4.4Å; I240-V255 HydrophobicContact CD1-CG1 4.39Å; I240-V255 HydrophobicContact CD1-CG2 3.9Å; I250-V255 HydrophobicContact CG2-CG2 3.76Å; A252-V255 PolarHBondContact O-N 3.37Å; V255-A259 HydrophobicContact CG1-CB 3.94Å; V255-V261 HydrophobicContact CG1-CG2 3.8Å; V255-V261 HydrophobicContact CG2-CG2 4.2Å; V255-V288 HydrophobicContact CB-CG1 4.39Å; V255-V288 HydrophobicContact CG1-CG1 4.27Å; V255-V288 HydrophobicContact CG2-CG1 3.83Å; V255-V288 HydrophobicContact CG2-CG2 3.94Å; V255-K291 WeakPolarHBondContact O-CD 3.49Å; V255-K291 WeakPolarHBondContact O-CE 3.07Å; V255-K291 PolarHBondContact O-NZ 3.04Å; V255-A292 HydrophobicContact CG1-CB 4.38Å
256	K	96.6	Very high	97.3	Very high	52 Å²	52	34.3 Å²	34.3	23%	0.226	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-78.3	154.2	171.7	72.1	-176.8	-170.8	-166.1	0	111.1	I235 L236 A237 D238 G258 A259	I235-K256 HydrophobicContact CD1-CB 4.44Å; I235-K256 WeakPolarHBondContact O-CB 3.41Å; L236-K256 PolarHBondContact O-NZ 2.81Å; A237-K256 VanDerWaalsContact C-CE 3.48Å; A237-K256 WeakPolarHBondContact O-CD 3.37Å; A237-K256 WeakPolarHBondContact O-CE 3.06Å; A237-K256 WeakPolarHBondContact O-CG 3.48Å; D238-K256 VanDerWaalsContact OD1-CE 3.23Å; D238-K256 WeakPolarHBondContact OD1-CE 3.43Å; D238-K256 IonicContact OD1-NZ 2.67Å; D238-K256 PolarHBondContact OD1-NZ 2.89Å; D238-K256 IonicContact OD2-NZ 3.45Å; D238-K256 PolarHBondContact OD2-NZ 3.49Å; K256-G258 PolarHBondContact O-N 3.45Å; K256-A259 HydrophobicContact CG-CB 3.9Å; K256-A259 WeakPolarHBondContact O-CB 3.49Å; K256-A259 PolarHBondContact O-N 3.12Å
257	K	97.5	Very high	96.9	Very high	171 Å²	171	32.1 Å²	32.1	74%	0.743	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	129.6	179.6	-173.6	178.6	-179.9	-179.2	0	110.2	A259 K291	K257-A259 VanDerWaalsContact C-N 3.33Å; K257-K291 WeakPolarHBondContact CA-O 3.07Å
258	G	97.1	Very high	96.4	Very high	48 Å²	48	36 Å²	36	50%	0.495	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-1.4	178.2	0	0	0	0	0	115.6	K256 K291 G293	K256-G258 PolarHBondContact O-N 3.45Å; G258-K291 PolarHBondContact N-O 2.94Å; G258-G293 VanDerWaalsContact C-N 3.29Å
259	A	98.5	Very high	95.9	Very high	2 Å²	2	38.1 Å²	38.1	2%	0.017	20%	0.199	C	C	.	.			trans	-63.3	152	176.2	0	0	0	0	0	112.3	D238 V255 K256 K257 A292 G293 F294	D238-A259 CarbonylContact O-C 3.53Å; D238-A259 VanDerWaalsContact O-CA 3.27Å; D238-A259 WeakPolarHBondContact O-CA 3.42Å; D238-A259 WeakPolarHBondContact O-CB 3.3Å; V255-A259 HydrophobicContact CG1-CB 3.94Å; K256-A259 HydrophobicContact CG-CB 3.9Å; K256-A259 WeakPolarHBondContact O-CB 3.49Å; K256-A259 PolarHBondContact O-N 3.12Å; K257-A259 VanDerWaalsContact C-N 3.33Å; A259-A292 CarbonylContact O-C 3.57Å; A259-A292 WeakPolarHBondContact O-CA 3.25Å; A259-A292 WeakPolarHBondContact O-CB 3.47Å; A259-G293 PolarHBondContact O-N 3.28Å; A259-F294 PolarHBondContact O-N 2.85Å
260	A	98.8	Very high	95.2	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.017	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133	167.8	0	0	0	0	0	110.2	I179 D238 I239 I240 F294	I179-A260 HydrophobicContact CD1-CB 3.75Å; I179-A260 HydrophobicContact CG1-CB 4.38Å; I179-A260 HydrophobicContact CG2-CB 4.09Å; D238-A260 PolarHBondContact O-N 3.26Å; I239-A260 CarbonylContact C-O 3.24Å; I239-A260 WeakPolarHBondContact CA-O 3.17Å; I239-A260 HydrophobicContact CG1-CB 4.37Å; I239-A260 HydrophobicContact CG2-CB 4.37Å; I240-A260 PolarHBondContact N-O 3.05Å; A260-F294 HydrophobicContact CB-CB 4.03Å; A260-F294 HydrophobicContact CB-CD2 4.38Å
261	V	98.8	Very high	94.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	112.8	179.2	-174.7	0	0	0	0	109.8	I240 V255 V283 V288 A292 F294 I295 T296	I240-V261 HydrophobicContact CB-CG2 4.45Å; I240-V261 WeakPolarHBondContact O-CA 3.37Å; V255-V261 HydrophobicContact CG1-CG2 3.8Å; V255-V261 HydrophobicContact CG2-CG2 4.2Å; V261-V283 HydrophobicContact CG1-CG1 4.01Å; V261-V283 HydrophobicContact CG1-CG2 3.79Å; V261-V288 HydrophobicContact CB-CG1 4.24Å; V261-V288 HydrophobicContact CG1-CG1 4.33Å; V261-V288 HydrophobicContact CG2-CG1 3.82Å; V261-A292 HydrophobicContact CG2-CB 4.08Å; V261-F294 PolarHBondContact N-O 3.29Å; V261-I295 HydrophobicContact CB-CG1 4.38Å; V261-I295 CarbonylContact O-C 3.54Å; V261-I295 VanDerWaalsContact O-CA 3.29Å; V261-I295 WeakPolarHBondContact O-CA 3.35Å; V261-T296 PolarHBondContact O-N 2.72Å; V261-T296 VanDerWaalsContact O-N 3.07Å
262	I	98.9	Very high	93.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	111.8	178.2	-48.4	-59.2	0	0	0	108.4	I30 V170 I174 I240 I241 A242 V264 T296 V302	I30-I262 HydrophobicContact CD1-CD1 4.14Å; V170-I262 HydrophobicContact CG1-CG2 4.23Å; V170-I262 HydrophobicContact CG2-CG2 4.09Å; I174-I262 HydrophobicContact CG1-CG1 4.47Å; I240-I262 PolarHBondContact O-N 3.33Å; I241-I262 WeakPolarHBondContact CA-O 3.34Å; I241-I262 HydrophobicContact CD1-CB 3.61Å; I241-I262 HydrophobicContact CD1-CG1 3.64Å; I241-I262 HydrophobicContact CD1-CG2 4.37Å; A242-I262 PolarHBondContact N-O 3.26Å; I262-V264 HydrophobicContact CG2-CG2 4.4Å; I262-T296 HydrophobicContact CD1-CG2 3.65Å; I262-T296 HydrophobicContact CG2-CG2 4.08Å; I262-V302 HydrophobicContact CG2-CG2 3.71Å
263	D	98.7	Very high	92.4	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.027	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	107.3	178.7	-164	-13.1	0	0	0	110.3	G265 G281 D282 V283 T296 V298 V302	D263-G265 PolarHBondContact OD1-N 3.16Å; D263-G281 WeakPolarHBondContact OD2-CA 3.4Å; D263-D282 VanDerWaalsContact CG-N 3.33Å; D263-D282 PolarHBondContact OD1-N 2.72Å; D263-D282 PolarHBondContact OD2-N 3.05Å; D263-V283 HydrophobicContact CB-CB 4.29Å; D263-V283 HydrophobicContact CB-CG2 3.7Å; D263-V283 VanDerWaalsContact OD2-CB 3.26Å; D263-V283 WeakPolarHBondContact OD2-CB 3.36Å; D263-V283 WeakPolarHBondContact OD2-CG2 3.36Å; D263-V283 PolarHBondContact OD2-N 2.91Å; D263-T296 PolarHBondContact N-OG1 2.9Å; D263-V298 HydrophobicContact CB-CG2 3.88Å; D263-V302 WeakPolarHBondContact O-CG2 3.45Å
264	V	98.2	Very high	91.7	Very high	18 Å²	18	57.9 Å²	57.9	11%	0.109	29%	0.29	C	S	.	.			trans	-95.1	-14.6	177.5	-169.2	0	0	0	0	110.8	T166 V170 V195 I199 I241 A242 A243 I262 V302	T166-V264 HydrophobicContact CG2-CG1 3.41Å; T166-V264 VanDerWaalsContact CG2-CG1 3.41Å; V170-V264 HydrophobicContact CG2-CG2 3.74Å; V195-V264 HydrophobicContact CG1-CG1 3.73Å; I199-V264 HydrophobicContact CD1-CG2 4.39Å; I241-V264 HydrophobicContact CG2-CG2 3.63Å; A242-V264 WeakPolarHBondContact O-CA 3.18Å; A242-V264 VanDerWaalsContact O-CB 3.23Å; A242-V264 WeakPolarHBondContact O-CB 3.41Å; A242-V264 PolarHBondContact O-N 3.49Å; A243-V264 HydrophobicContact CB-CB 3.91Å; A243-V264 HydrophobicContact CB-CG1 4.32Å; A243-V264 HydrophobicContact CB-CG2 4.27Å; I262-V264 HydrophobicContact CG2-CG2 4.4Å; V264-V302 HydrophobicContact CG1-CG1 4.18Å; V264-V302 HydrophobicContact CG2-CG2 4.24Å
265	G	93.4	Very high	90.9	Very high	4 Å²	4	60.4 Å²	60.4	4%	0.041	32%	0.316	C	S	.	.			trans	-60.2	139.9	-177.2	0	0	0	0	0	112.2	A242 D263 G281	A242-G265 PolarHBondContact O-N 3.03Å; D263-G265 PolarHBondContact OD1-N 3.16Å; G265-G281 WeakPolarHBondContact O-CA 3.32Å
266	I	90.2	Very high	90.1	Very high	80 Å²	80	67.4 Å²	67.4	41%	0.41	35%	0.347	S	S	.	.			trans	-131.7	109.2	170.4	-59.2	178.8	0	0	0	107.6	L279	I266-L279 HydrophobicContact CG2-CD1 4.46Å; I266-L279 HydrophobicContact CG2-CD2 3.92Å
267	N	89.1	Confident	89.4	Confident	21 Å²	21	69.2 Å²	69.2	11%	0.112	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143	178.9	-53.8	-73.3	0	0	0	109.2	G245 P247 L279 I280 G281 D282	G245-N267 WeakPolarHBondContact CA-OD1 3.38Å; G245-N267 PolarHBondContact O-OD1 3.42Å; P247-N267 HydrophobicContact CG-CB 3.66Å; N267-L279 WeakPolarHBondContact O-CA 3.36Å; N267-I280 WeakPolarHBondContact CA-O 3.23Å; N267-I280 HydrophobicContact CB-CG1 3.93Å; N267-I280 WeakPolarHBondContact CB-O 3.36Å; N267-I280 PolarHBondContact N-O 3.03Å; N267-I280 PolarHBondContact ND2-O 2.9Å; N267-I280 PolarHBondContact O-N 3.41Å; N267-G281 PolarHBondContact ND2-O 3.08Å; N267-G281 VanDerWaalsContact ND2-O 3.16Å; N267-D282 PolarHBondContact ND2-OD1 2.98Å
268	R	85.4	Confident	88.9	Confident	154 Å²	154	68.1 Å²	68.1	58%	0.581	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.4	176.2	-72.2	177.8	173.5	-179.9	-4.4	109.1	V277 L279	R268-V277 HydrophobicContact CB-CG1 3.75Å; R268-V277 HydrophobicContact CG-CG1 3.86Å; R268-L279 HydrophobicContact CG-CD2 3.97Å
269	N	84.1	Confident	88.6	Confident	79 Å²	79	69 Å²	69	42%	0.422	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.8	174.2	-172.9	-55.7	0	0	0	109.1	D271 V277 R278 I280	N269-D271 PolarHBondContact O-N 3.11Å; N269-V277 CarbonylContact O-C 3.57Å; N269-V277 WeakPolarHBondContact O-CA 3.47Å; N269-R278 PolarHBondContact N-O 3.38Å; N269-R278 PolarHBondContact O-N 2.98Å; N269-I280 HydrophobicContact CB-CD1 3.72Å; N269-I280 HydrophobicContact CB-CG1 4.13Å; N269-I280 HydrophobicContact CB-CG2 4.4Å
270	L	83.6	Confident	88.4	Confident	104 Å²	104	71.5 Å²	71.5	55%	0.545	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.8	173.4	-174.5	69.3	0	0	0	108.8	Q272 G275 V277	L270-Q272 PolarHBondContact O-N 2.87Å; L270-G275 WeakPolarHBondContact CD1-O 3.47Å; L270-V277 HydrophobicContact CD1-CG2 4.15Å
271	D	77.3	Confident	88.3	Confident	24 Å²	24	71.7 Å²	71.7	13%	0.128	36%	0.36	C	S	.	.			trans	-66	108	169.9	-178.2	-26.7	0	0	0	108.9	N269 H273 T274 G275 K276 R278	N269-D271 PolarHBondContact O-N 3.11Å; D271-H273 PolarHBondContact O-N 3.23Å; D271-H273 WeakPolarHBondContact OD1-CA 3.49Å; D271-H273 WeakPolarHBondContact OD1-CB 3.49Å; D271-H273 PolarHBondContact OD1-N 3.13Å; D271-T274 VanDerWaalsContact CB-OG1 3.31Å; D271-T274 WeakPolarHBondContact CB-OG1 3.46Å; D271-T274 PolarHBondContact O-N 2.91Å; D271-T274 PolarHBondContact OD1-N 3.15Å; D271-T274 WeakPolarHBondContact OD2-CG2 3.44Å; D271-T274 PolarHBondContact OD2-OG1 3.31Å; D271-G275 VanDerWaalsContact O-CA 3.28Å; D271-G275 WeakPolarHBondContact O-CA 3.33Å; D271-G275 PolarHBondContact O-N 3.01Å; D271-K276 VanDerWaalsContact CB-O 3.24Å; D271-K276 WeakPolarHBondContact CB-O 3.22Å; D271-K276 PolarHBondContact N-O 2.92Å; D271-R278 HydrophobicContact CB-CG 4.43Å; D271-R278 IonicContact OD2-CZ 3.91Å; D271-R278 VanDerWaalsContact OD2-CZ 3.22Å; D271-R278 IonicContact OD2-NE 3.22Å; D271-R278 PolarHBondContact OD2-NE 2.94Å; D271-R278 IonicContact OD2-NH2 2.88Å; D271-R278 PolarHBondContact OD2-NH2 2.84Å
272	Q	80.9	Confident	88.3	Confident	188 Å²	188	71.7 Å²	71.7	88%	0.879	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.8	-177.5	-66	-173.8	-11.8	0	0	113.2	L270	L270-Q272 PolarHBondContact O-N 2.87Å
273	H	78.5	Confident	88.3	Confident	188 Å²	188	72.1 Å²	72.1	87%	0.87	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-39.5	179.1	-111.2	66.3	0	0	0	112.4	D271	D271-H273 PolarHBondContact O-N 3.23Å; D271-H273 WeakPolarHBondContact OD1-CA 3.49Å; D271-H273 WeakPolarHBondContact OD1-CB 3.49Å; D271-H273 PolarHBondContact OD1-N 3.13Å
274	T	83.6	Confident	88.2	Confident	75 Å²	75	75.1 Å²	75.1	46%	0.46	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-11.3	-175.8	67.1	0	0	0	0	114.1	D271 K276	D271-T274 VanDerWaalsContact CB-OG1 3.31Å; D271-T274 WeakPolarHBondContact CB-OG1 3.46Å; D271-T274 PolarHBondContact O-N 2.91Å; D271-T274 PolarHBondContact OD1-N 3.15Å; D271-T274 WeakPolarHBondContact OD2-CG2 3.44Å; D271-T274 PolarHBondContact OD2-OG1 3.31Å; T274-K276 PolarHBondContact O-N 3.48Å; T274-K276 VanDerWaalsContact O-N 3.16Å; T274-K276 PolarHBondContact OG1-N 3.18Å
275	G	81.3	Confident	88.2	Confident	54 Å²	54	76.5 Å²	76.5	56%	0.557	38%	0.384	S	S	*	.			trans	67.1	4.4	-172.1	0	0	0	0	0	113.8	L270 D271	L270-G275 WeakPolarHBondContact CD1-O 3.47Å; D271-G275 VanDerWaalsContact O-CA 3.28Å; D271-G275 WeakPolarHBondContact O-CA 3.33Å; D271-G275 PolarHBondContact O-N 3.01Å
276	K	81.9	Confident	88.4	Confident	147 Å²	147	82.2 Å²	82.2	64%	0.639	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-89.1	137.7	-177.4	-66.4	-176.8	178.6	178.7	0	110.9	D271 T274 R278	D271-K276 VanDerWaalsContact CB-O 3.24Å; D271-K276 WeakPolarHBondContact CB-O 3.22Å; D271-K276 PolarHBondContact N-O 2.92Å; T274-K276 PolarHBondContact O-N 3.48Å; T274-K276 VanDerWaalsContact O-N 3.16Å; T274-K276 PolarHBondContact OG1-N 3.18Å; K276-R278 PolarHBondContact O-N 3.28Å
277	V	82.6	Confident	88.7	Confident	89 Å²	89	79.6 Å²	79.6	54%	0.539	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.4	170.4	-179.6	0	0	0	0	108.9	R268 N269 L270	R268-V277 HydrophobicContact CB-CG1 3.75Å; R268-V277 HydrophobicContact CG-CG1 3.86Å; N269-V277 CarbonylContact O-C 3.57Å; N269-V277 WeakPolarHBondContact O-CA 3.47Å; L270-V277 HydrophobicContact CD1-CG2 4.15Å
278	R	86.2	Confident	89.1	Confident	148 Å²	148	78.6 Å²	78.6	56%	0.558	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	144.4	170.7	-62.8	-172.3	-173.4	-150.8	5	109.7	N269 D271 K276	N269-R278 PolarHBondContact N-O 3.38Å; N269-R278 PolarHBondContact O-N 2.98Å; D271-R278 HydrophobicContact CB-CG 4.43Å; D271-R278 IonicContact OD2-CZ 3.91Å; D271-R278 VanDerWaalsContact OD2-CZ 3.22Å; D271-R278 IonicContact OD2-NE 3.22Å; D271-R278 PolarHBondContact OD2-NE 2.94Å; D271-R278 IonicContact OD2-NH2 2.88Å; D271-R278 PolarHBondContact OD2-NH2 2.84Å; K276-R278 PolarHBondContact O-N 3.28Å
279	L	89.9	Confident	89.7	Confident	68 Å²	68	73.8 Å²	73.8	36%	0.356	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.7	168.6	-61.7	-179.8	0	0	0	108.6	I266 N267 R268	I266-L279 HydrophobicContact CG2-CD1 4.46Å; I266-L279 HydrophobicContact CG2-CD2 3.92Å; N267-L279 WeakPolarHBondContact O-CA 3.36Å; R268-L279 HydrophobicContact CG-CD2 3.97Å
280	I	94.6	Very high	90.4	Very high	53 Å²	53	75.3 Å²	75.3	27%	0.272	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.4	174.3	64.7	176.1	0	0	0	109.3	P247 N267 N269	P247-I280 HydrophobicContact CB-CD1 3.83Å; P247-I280 HydrophobicContact CB-CG1 4.47Å; P247-I280 HydrophobicContact CG-CD1 4.18Å; N267-I280 WeakPolarHBondContact CA-O 3.23Å; N267-I280 HydrophobicContact CB-CG1 3.93Å; N267-I280 WeakPolarHBondContact CB-O 3.36Å; N267-I280 PolarHBondContact N-O 3.03Å; N267-I280 PolarHBondContact ND2-O 2.9Å; N267-I280 PolarHBondContact O-N 3.41Å; N269-I280 HydrophobicContact CB-CD1 3.72Å; N269-I280 HydrophobicContact CB-CG1 4.13Å; N269-I280 HydrophobicContact CB-CG2 4.4Å
281	G	97.1	Very high	91	Very high	6 Å²	6	73.6 Å²	73.6	6%	0.062	37%	0.373	C	S	.	.			trans	-90.5	-167.1	-179.1	0	0	0	0	0	113.5	P247 D263 G265 N267 V283	P247-G281 WeakPolarHBondContact CA-O 3.15Å; D263-G281 WeakPolarHBondContact OD2-CA 3.4Å; G265-G281 WeakPolarHBondContact O-CA 3.32Å; N267-G281 PolarHBondContact ND2-O 3.08Å; N267-G281 VanDerWaalsContact ND2-O 3.16Å; G281-V283 VanDerWaalsContact C-N 3.34Å
282	D	98.4	Very high	92	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.368	C	S	.	.	S	Bend	trans	-87.8	-6.2	176.9	-68.7	-9.2	0	0	0	112.6	A242 A244 G245 V246 G248 L249 I250 D263 N267	A242-D282 HydrophobicContact CB-CB 3.75Å; A244-D282 WeakPolarHBondContact CA-OD2 3.17Å; A244-D282 PolarHBondContact N-OD2 3.22Å; G245-D282 VanDerWaalsContact CA-OD1 3.28Å; G245-D282 WeakPolarHBondContact CA-OD1 3.48Å; G245-D282 PolarHBondContact N-OD1 2.87Å; G245-D282 PolarHBondContact N-OD2 3.25Å; V246-D282 PolarHBondContact N-OD1 2.89Å; V246-D282 VanDerWaalsContact O-CA 3.29Å; V246-D282 WeakPolarHBondContact O-CA 3.38Å; G248-D282 CarbonylContact C-O 3.56Å; G248-D282 PolarHBondContact N-O 2.9Å; L249-D282 PolarHBondContact N-O 3.04Å; I250-D282 PolarHBondContact N-O 3.12Å; D263-D282 VanDerWaalsContact CG-N 3.33Å; D263-D282 PolarHBondContact OD1-N 2.72Å; D263-D282 PolarHBondContact OD2-N 3.05Å; N267-D282 PolarHBondContact ND2-OD1 2.98Å
283	V	98.5	Very high	92.8	Very high	10 Å²	10	64.7 Å²	64.7	6%	0.061	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-107.9	137.7	-175.6	-175.3	0	0	0	0	110.4	A242 I250 V261 D263 G281 F285 V288 I295	A242-V283 HydrophobicContact CB-CG2 3.79Å; I250-V283 HydrophobicContact CB-CG1 4.39Å; I250-V283 HydrophobicContact CB-CG2 4.11Å; I250-V283 HydrophobicContact CG1-CG2 4.42Å; V261-V283 HydrophobicContact CG1-CG1 4.01Å; V261-V283 HydrophobicContact CG1-CG2 3.79Å; D263-V283 HydrophobicContact CB-CB 4.29Å; D263-V283 HydrophobicContact CB-CG2 3.7Å; D263-V283 VanDerWaalsContact OD2-CB 3.26Å; D263-V283 WeakPolarHBondContact OD2-CB 3.36Å; D263-V283 WeakPolarHBondContact OD2-CG2 3.36Å; D263-V283 PolarHBondContact OD2-N 2.91Å; G281-V283 VanDerWaalsContact C-N 3.34Å; V283-F285 VanDerWaalsContact C-N 3.25Å; V283-F285 PolarHBondContact O-N 3.43Å; V283-V288 HydrophobicContact CG1-CB 3.86Å; V283-V288 HydrophobicContact CG1-CG1 4.07Å; V283-V288 HydrophobicContact CG1-CG2 3.71Å; V283-I295 HydrophobicContact CG1-CD1 4.45Å
284	D	97.9	Very high	93.7	Very high	67 Å²	67	58.5 Å²	58.5	36%	0.358	31%	0.308	S	S	.	.			trans	-68.7	86.3	162.2	170.9	21.8	0	0	0	109.2	I250 T251 E286 G287 V288	I250-D284 PolarHBondContact O-N 3.11Å; T251-D284 HydrophobicContact CG2-CB 4.33Å; D284-E286 PolarHBondContact O-N 2.78Å; D284-G287 PolarHBondContact O-N 3.43Å; D284-G287 PolarHBondContact OD1-N 3.06Å; D284-V288 VanDerWaalsContact O-CB 3.26Å; D284-V288 WeakPolarHBondContact O-CB 3.24Å; D284-V288 VanDerWaalsContact O-CG2 3.25Å; D284-V288 WeakPolarHBondContact O-CG2 3.31Å; D284-V288 PolarHBondContact O-N 3.48Å
285	F	97.8	Very high	94.5	Very high	48 Å²	48	55 Å²	55	21%	0.211	29%	0.286	C	S	.	.	H	α-helix	trans	-58	-48.5	-169.6	-179.2	-91.7	0	0	0	112.7	V29 V283 V288 K289 I295 P297	V29-F285 HydrophobicContact CG1-CZ 4.3Å; V29-F285 HydrophobicContact CG2-CZ 4.07Å; V283-F285 VanDerWaalsContact C-N 3.25Å; V283-F285 PolarHBondContact O-N 3.43Å; F285-V288 PolarHBondContact O-N 2.87Å; F285-K289 HydrophobicContact CE1-CD 3.79Å; F285-K289 HydrophobicContact CZ-CD 4.17Å; F285-K289 WeakPolarHBondContact O-CB 3.46Å; F285-K289 PolarHBondContact O-N 3.09Å; F285-I295 HydrophobicContact CD2-CD1 3.47Å; F285-I295 VanDerWaalsContact CD2-CD1 3.47Å; F285-I295 HydrophobicContact CD2-CG1 3.87Å; F285-I295 HydrophobicContact CE2-CB 4.41Å; F285-I295 HydrophobicContact CE2-CD1 3.81Å; F285-I295 HydrophobicContact CE2-CG1 3.87Å; F285-I295 HydrophobicContact CE2-CG2 3.74Å; F285-I295 HydrophobicContact CG-CD1 4.12Å; F285-I295 HydrophobicContact CZ-CG2 4.13Å; F285-P297 HydrophobicContact CE2-CB 3.94Å; F285-P297 HydrophobicContact CZ-CB 4.3Å
286	E	97.1	Very high	95.3	Very high	124 Å²	124	52.4 Å²	52.4	58%	0.579	26%	0.259	S	S	*	.	H	α-helix	trans	-65.6	-44.5	-176.2	-66.8	-57.7	138.8	0	0	111.5	D284	D284-E286 PolarHBondContact O-N 2.78Å
287	G	97.2	Very high	96.1	Very high	25 Å²	25	46.7 Å²	46.7	26%	0.258	24%	0.237	S	C	.	.	H	α-helix	trans	-66.3	-43.7	177.5	0	0	0	0	0	112.8	A252 D284	A252-G287 WeakPolarHBondContact CB-O 3.47Å; D284-G287 PolarHBondContact O-N 3.43Å; D284-G287 PolarHBondContact OD1-N 3.06Å
288	V	98.3	Very high	96.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.9	-33.7	-176.6	172.2	0	0	0	0	112.1	V255 V261 V283 D284 F285 E290 K291 A292 I295	V255-V288 HydrophobicContact CB-CG1 4.39Å; V255-V288 HydrophobicContact CG1-CG1 4.27Å; V255-V288 HydrophobicContact CG2-CG1 3.83Å; V255-V288 HydrophobicContact CG2-CG2 3.94Å; V261-V288 HydrophobicContact CB-CG1 4.24Å; V261-V288 HydrophobicContact CG1-CG1 4.33Å; V261-V288 HydrophobicContact CG2-CG1 3.82Å; V283-V288 HydrophobicContact CG1-CB 3.86Å; V283-V288 HydrophobicContact CG1-CG1 4.07Å; V283-V288 HydrophobicContact CG1-CG2 3.71Å; D284-V288 VanDerWaalsContact O-CB 3.26Å; D284-V288 WeakPolarHBondContact O-CB 3.24Å; D284-V288 VanDerWaalsContact O-CG2 3.25Å; D284-V288 WeakPolarHBondContact O-CG2 3.31Å; D284-V288 PolarHBondContact O-N 3.48Å; F285-V288 PolarHBondContact O-N 2.87Å; V288-E290 PolarHBondContact O-N 3.14Å; V288-K291 PolarHBondContact O-N 3.41Å; V288-A292 HydrophobicContact CG1-CB 4.04Å; V288-A292 WeakPolarHBondContact O-CB 3.43Å; V288-A292 PolarHBondContact O-N 3.29Å; V288-I295 HydrophobicContact CB-CD1 4.1Å; V288-I295 HydrophobicContact CG1-CD1 3.9Å
289	K	97.8	Very high	97.1	Very high	52 Å²	52	41.3 Å²	41.3	23%	0.226	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-30.4	177.7	177.3	-177.9	173.4	-166.9	0	112.9	S26 A27 F285 K291 I295	S26-K289 WeakPolarHBondContact OG-CE 3.44Å; S26-K289 WeakPolarHBondContact OG-CG 3.39Å; A27-K289 HydrophobicContact CB-CG 4.22Å; A27-K289 VanDerWaalsContact CB-O 3.29Å; A27-K289 WeakPolarHBondContact CB-O 3.23Å; A27-K289 PolarHBondContact N-O 3.25Å; F285-K289 HydrophobicContact CE1-CD 3.79Å; F285-K289 HydrophobicContact CZ-CD 4.17Å; F285-K289 WeakPolarHBondContact O-CB 3.46Å; F285-K289 PolarHBondContact O-N 3.09Å; K289-K291 PolarHBondContact O-N 3.4Å; K289-I295 HydrophobicContact CB-CD1 4.33Å; K289-I295 HydrophobicContact CB-CG2 4.43Å; K289-I295 HydrophobicContact CG-CG2 4.42Å
290	E	97.1	Very high	97.4	Very high	111 Å²	111	39 Å²	39	52%	0.519	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-3.1	178.4	-64.2	-57.1	113.6	0	0	114	S26 V288	S26-E290 PolarHBondContact OG-OE1 3.13Å; V288-E290 PolarHBondContact O-N 3.14Å
291	K	96.3	Very high	97.6	Very high	68 Å²	68	36.5 Å²	36.5	30%	0.296	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-37.6	-175.8	-163.5	176.7	-169.5	-167.8	0	114	A252 V255 K257 G258 V288 K289	A252-K291 WeakPolarHBondContact O-CD 3.35Å; A252-K291 PolarHBondContact O-NZ 2.82Å; V255-K291 WeakPolarHBondContact O-CD 3.49Å; V255-K291 WeakPolarHBondContact O-CE 3.07Å; V255-K291 PolarHBondContact O-NZ 3.04Å; K257-K291 WeakPolarHBondContact CA-O 3.07Å; G258-K291 PolarHBondContact N-O 2.94Å; V288-K291 PolarHBondContact O-N 3.41Å; K289-K291 PolarHBondContact O-N 3.4Å
292	A	98.2	Very high	97.6	Very high	4 Å²	4	36.6 Å²	36.6	3%	0.033	20%	0.202	C	C	.	.			trans	-64.6	153.7	179.6	0	0	0	0	0	111.5	A27 V255 A259 V261 V288	A27-A292 VanDerWaalsContact CA-O 3.32Å; A27-A292 WeakPolarHBondContact CA-O 3.46Å; A27-A292 HydrophobicContact CB-CB 3.96Å; A27-A292 WeakPolarHBondContact CB-O 3.39Å; V255-A292 HydrophobicContact CG1-CB 4.38Å; A259-A292 CarbonylContact O-C 3.57Å; A259-A292 WeakPolarHBondContact O-CA 3.25Å; A259-A292 WeakPolarHBondContact O-CB 3.47Å; V261-A292 HydrophobicContact CG2-CB 4.08Å; V288-A292 HydrophobicContact CG1-CB 4.04Å; V288-A292 WeakPolarHBondContact O-CB 3.43Å; V288-A292 PolarHBondContact O-N 3.29Å
293	G	98.2	Very high	97.5	Very high	21 Å²	21	38.1 Å²	38.1	22%	0.216	22%	0.217	C	C	.	.	S	Bend	trans	-80.4	-36.6	167.3	0	0	0	0	0	111.2	V28 G258 A259	V28-G293 PolarHBondContact N-O 3.14Å; G258-G293 VanDerWaalsContact C-N 3.29Å; A259-G293 PolarHBondContact O-N 3.28Å
294	F	98.7	Very high	97.4	Very high	59 Å²	59	39.6 Å²	39.6	26%	0.259	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.5	178.1	-62.3	-92.6	0	0	0	110.5	V28 I30 I179 A259 A260 V261	V28-F294 HydrophobicContact CB-CD1 3.75Å; V28-F294 HydrophobicContact CB-CE1 4.02Å; V28-F294 HydrophobicContact CG1-CD1 4.09Å; V28-F294 HydrophobicContact CG1-CE1 4.19Å; V28-F294 HydrophobicContact CG2-CD1 4.49Å; V28-F294 HydrophobicContact CG2-CE1 4.35Å; V28-F294 WeakPolarHBondContact O-CA 3.27Å; I30-F294 HydrophobicContact CD1-CB 3.89Å; I30-F294 HydrophobicContact CD1-CD1 4.05Å; I30-F294 HydrophobicContact CD1-CG 4.33Å; I30-F294 HydrophobicContact CG1-CB 4.36Å; I30-F294 HydrophobicContact CG1-CD1 4.1Å; I179-F294 HydrophobicContact CD1-CB 4.16Å; I179-F294 HydrophobicContact CD1-CD1 4.38Å; I179-F294 HydrophobicContact CD1-CD2 4.22Å; I179-F294 HydrophobicContact CD1-CG 4.01Å; I179-F294 HydrophobicContact CG1-CD1 4.47Å; I179-F294 HydrophobicContact CG1-CD2 3.98Å; I179-F294 HydrophobicContact CG1-CE2 4.09Å; I179-F294 HydrophobicContact CG1-CG 4.18Å; I179-F294 HydrophobicContact CG1-CZ 4.38Å; A259-F294 PolarHBondContact O-N 2.85Å; A260-F294 HydrophobicContact CB-CB 4.03Å; A260-F294 HydrophobicContact CB-CD2 4.38Å; V261-F294 PolarHBondContact N-O 3.29Å
295	I	98.8	Very high	97.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	140.9	175.2	-166.6	170.6	0	0	0	111.2	A27 V28 V29 I30 V261 V283 F285 V288 K289	A27-I295 HydrophobicContact CB-CB 4.16Å; A27-I295 HydrophobicContact CB-CG2 3.7Å; V28-I295 PolarHBondContact O-N 3.48Å; V29-I295 CarbonylContact C-O 3.52Å; V29-I295 VanDerWaalsContact CA-O 3.31Å; V29-I295 WeakPolarHBondContact CA-O 3.32Å; V29-I295 HydrophobicContact CG2-CG2 4.09Å; I30-I295 PolarHBondContact N-O 2.87Å; V261-I295 HydrophobicContact CB-CG1 4.38Å; V261-I295 CarbonylContact O-C 3.54Å; V261-I295 VanDerWaalsContact O-CA 3.29Å; V261-I295 WeakPolarHBondContact O-CA 3.35Å; V283-I295 HydrophobicContact CG1-CD1 4.45Å; F285-I295 HydrophobicContact CD2-CD1 3.47Å; F285-I295 VanDerWaalsContact CD2-CD1 3.47Å; F285-I295 HydrophobicContact CD2-CG1 3.87Å; F285-I295 HydrophobicContact CE2-CB 4.41Å; F285-I295 HydrophobicContact CE2-CD1 3.81Å; F285-I295 HydrophobicContact CE2-CG1 3.87Å; F285-I295 HydrophobicContact CE2-CG2 3.74Å; F285-I295 HydrophobicContact CG-CD1 4.12Å; F285-I295 HydrophobicContact CZ-CG2 4.13Å; V288-I295 HydrophobicContact CB-CD1 4.1Å; V288-I295 HydrophobicContact CG1-CD1 3.9Å; K289-I295 HydrophobicContact CB-CD1 4.33Å; K289-I295 HydrophobicContact CB-CG2 4.43Å; K289-I295 HydrophobicContact CG-CG2 4.42Å
296	T	98.7	Very high	97.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.209	C	C	.	.			trans	-96.2	137.9	169.8	59.1	0	0	0	0	111.2	I30 M173 V261 I262 D263	I30-T296 HydrophobicContact CB-CG2 4.06Å; M173-T296 HydrophobicContact CE-CG2 3.37Å; M173-T296 HydrophobicContact SD-CG2 4.44Å; V261-T296 PolarHBondContact O-N 2.72Å; V261-T296 VanDerWaalsContact O-N 3.07Å; I262-T296 HydrophobicContact CD1-CG2 3.65Å; I262-T296 HydrophobicContact CG2-CG2 4.08Å; D263-T296 PolarHBondContact N-OG1 2.9Å
297	P	97.9	Very high	97.3	Very high	27 Å²	27	31.2 Å²	31.2	18%	0.175	19%	0.191	C	C	.	.			trans	-81.1	155.5	175.6	34.2	-33.2	0	0	0	111.7	V29 I30 F285 P299 G301	V29-P297 HydrophobicContact CG1-CB 4.35Å; V29-P297 HydrophobicContact CG1-CG 3.95Å; I30-P297 VanDerWaalsContact O-CD 3.23Å; I30-P297 WeakPolarHBondContact O-CD 3.36Å; F285-P297 HydrophobicContact CE2-CB 3.94Å; F285-P297 HydrophobicContact CZ-CB 4.3Å; P297-P299 CarbonylContact C-O 3.31Å; P297-G301 WeakPolarHBondContact O-CA 3.41Å; P297-G301 PolarHBondContact O-N 3.3Å
298	V	97.1	Very high	97.3	Very high	35 Å²	35	30 Å²	30	21%	0.212	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	119.8	164.8	-179.7	0	0	0	0	108.1	D263	D263-V298 HydrophobicContact CB-CG2 3.88Å
299	P	94.7	Very high	97.4	Very high	90 Å²	90	30.6 Å²	30.6	58%	0.584	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	cis	-74.3	174.3	-3.8	33.7	-36.8	0	0	0	113.2	P297	P297-P299 CarbonylContact C-O 3.31Å
300	G	95.6	Very high	97.4	Very high	18 Å²	18	28.2 Å²	28.2	19%	0.186	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.4	-5.6	171.1	0	0	0	0	0	116	G32 T33	G32-G300 CarbonylContact C-O 3.09Å; G32-G300 WeakPolarHBondContact CA-O 3.45Å; G32-G300 PolarHBondContact N-O 2.76Å; T33-G300 PolarHBondContact N-O 3.07Å; T33-G300 PolarHBondContact OG1-O 3.3Å
301	G	97.9	Very high	97.4	Very high	1 Å²	1	23 Å²	23	1%	0.01	15%	0.146	C	C	.	.	S	Bend	trans	-89.9	-110	171.1	0	0	0	0	0	112.7	G32 P297 G303 P304	G32-G301 WeakPolarHBondContact CA-O 3.28Å; P297-G301 WeakPolarHBondContact O-CA 3.41Å; P297-G301 PolarHBondContact O-N 3.3Å; G301-G303 PolarHBondContact O-N 3.03Å; G301-P304 WeakPolarHBondContact O-CD 3.25Å
302	V	98.1	Very high	97.5	Very high	8 Å²	8	22.5 Å²	22.5	5%	0.048	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-35.4	-169.6	-178.1	0	0	0	0	113.4	T166 A169 V170 M173 I262 D263 V264 M305 T306	T166-V302 HydrophobicContact CG2-CG1 3.97Å; A169-V302 HydrophobicContact CB-CG1 4.4Å; V170-V302 HydrophobicContact CG2-CG1 4.05Å; V170-V302 HydrophobicContact CG2-CG2 4.28Å; M173-V302 HydrophobicContact SD-CG2 3.99Å; I262-V302 HydrophobicContact CG2-CG2 3.71Å; D263-V302 WeakPolarHBondContact O-CG2 3.45Å; V264-V302 HydrophobicContact CG1-CG1 4.18Å; V264-V302 HydrophobicContact CG2-CG2 4.24Å; V302-M305 WeakPolarHBondContact O-CA 3.37Å; V302-M305 WeakPolarHBondContact O-CB 3.31Å; V302-M305 PolarHBondContact O-N 3.42Å; V302-T306 PolarHBondContact O-N 3.46Å; V302-T306 PolarHBondContact O-OG1 3.14Å
303	G	95.2	Very high	97.6	Very high	32 Å²	32	23 Å²	23	33%	0.33	15%	0.147	S	C	.	.	H	α-helix	trans	-53.9	-55.1	-175.8	0	0	0	0	0	115.3	G301 M305 T306 V307	G301-G303 PolarHBondContact O-N 3.03Å; G303-M305 PolarHBondContact O-N 3.11Å; G303-T306 WeakPolarHBondContact O-CB 3.38Å; G303-T306 PolarHBondContact O-N 3.12Å; G303-V307 PolarHBondContact O-N 2.72Å
304	P	96	Very high	97.6	Very high	42 Å²	42	22 Å²	22	27%	0.273	14%	0.136	S	C	.	.	H	α-helix	trans	-55.8	-37	173.8	-28.2	34.1	0	0	0	114	A36 G301 V307 A308	A36-P304 HydrophobicContact CB-CB 4.06Å; G301-P304 WeakPolarHBondContact O-CD 3.25Å; P304-V307 PolarHBondContact O-N 2.89Å; P304-A308 PolarHBondContact O-N 2.79Å
305	M	98.1	Very high	97.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.9	-37.7	177.9	-70.3	-72.8	-63.7	0	0	111.9	G32 L35 A36 I39 A169 E172 M173 V302 G303 V307 A308 M309	G32-M305 WeakPolarHBondContact O-CG 3.25Å; L35-M305 HydrophobicContact CB-CE 4.2Å; L35-M305 HydrophobicContact CB-SD 3.43Å; L35-M305 WeakPolarHBondContact CB-SD 3.29Å; A36-M305 HydrophobicContact CB-SD 4.08Å; A36-M305 PolarHBondContact N-SD 3.04Å; I39-M305 HydrophobicContact CD1-CE 3.29Å; I39-M305 HydrophobicContact CD1-SD 3.79Å; A169-M305 HydrophobicContact CB-CB 3.53Å; E172-M305 HydrophobicContact CB-CE 3.93Å; E172-M305 HydrophobicContact CG-CE 3.9Å; M173-M305 HydrophobicContact CG-CB 4.5Å; M173-M305 HydrophobicContact CG-CE 3.82Å; M173-M305 HydrophobicContact CG-CG 3.85Å; M173-M305 HydrophobicContact CG-SD 4.4Å; M173-M305 HydrophobicContact SD-CB 4.27Å; M173-M305 HydrophobicContact SD-CG 3.81Å; V302-M305 WeakPolarHBondContact O-CA 3.37Å; V302-M305 WeakPolarHBondContact O-CB 3.31Å; V302-M305 PolarHBondContact O-N 3.42Å; G303-M305 PolarHBondContact O-N 3.11Å; M305-V307 VanDerWaalsContact C-N 3.29Å; M305-V307 PolarHBondContact O-N 3.14Å; M305-A308 PolarHBondContact O-N 3.38Å; M305-M309 VanDerWaalsContact O-CG 3.32Å; M305-M309 WeakPolarHBondContact O-CG 3.32Å; M305-M309 PolarHBondContact O-N 2.91Å
306	T	96.9	Very high	97.5	Very high	31 Å²	31	21.6 Å²	21.6	19%	0.19	14%	0.139	C	C	.	.	H	α-helix	trans	-55.9	-44.4	174.3	-62.4	0	0	0	0	111.2	A165 T166 V302 G303 M309 L310	A165-T306 HydrophobicContact CB-CG2 3.98Å; A165-T306 WeakPolarHBondContact CB-O 3.28Å; T166-T306 WeakPolarHBondContact OG1-CG2 3.42Å; T166-T306 PolarHBondContact OG1-OG1 2.99Å; V302-T306 PolarHBondContact O-N 3.46Å; V302-T306 PolarHBondContact O-OG1 3.14Å; G303-T306 WeakPolarHBondContact O-CB 3.38Å; G303-T306 PolarHBondContact O-N 3.12Å; T306-M309 PolarHBondContact O-N 2.79Å; T306-L310 PolarHBondContact O-N 3.03Å
307	V	96.8	Very high	97.5	Very high	31 Å²	31	21.8 Å²	21.8	19%	0.188	14%	0.14	C	C	.	.	H	α-helix	trans	-65.7	-43.8	177.8	-178.8	0	0	0	0	110.9	A81 G303 P304 M305 M309 L310 M311	A81-V307 HydrophobicContact CB-CG1 3.59Å; G303-V307 PolarHBondContact O-N 2.72Å; P304-V307 PolarHBondContact O-N 2.89Å; M305-V307 VanDerWaalsContact C-N 3.29Å; M305-V307 PolarHBondContact O-N 3.14Å; V307-M309 VanDerWaalsContact C-N 3.33Å; V307-M309 PolarHBondContact O-N 2.87Å; V307-L310 WeakPolarHBondContact O-CB 3.5Å; V307-L310 PolarHBondContact O-N 3.16Å; V307-M311 HydrophobicContact CG1-CE 4.47Å; V307-M311 WeakPolarHBondContact O-CG 3.49Å; V307-M311 PolarHBondContact O-N 3.4Å
308	A	98	Very high	97.5	Very high	0 Å²	0	21 Å²	21	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-42	177.5	0	0	0	0	0	112.2	A36 I39 I43 P304 M305 M311 K312	A36-A308 HydrophobicContact CB-CB 4.11Å; I39-A308 HydrophobicContact CB-CB 4.22Å; I39-A308 HydrophobicContact CG2-CB 3.89Å; I43-A308 VanDerWaalsContact CD1-O 3.32Å; I43-A308 WeakPolarHBondContact CD1-O 3.05Å; P304-A308 PolarHBondContact O-N 2.79Å; M305-A308 PolarHBondContact O-N 3.38Å; A308-M311 PolarHBondContact O-N 3.2Å; A308-K312 PolarHBondContact O-N 2.81Å
309	M	98.5	Very high	97.4	Very high	13 Å²	13	23 Å²	23	6%	0.064	14%	0.139	C	C	.	.	H	α-helix	trans	-70.9	-32.6	179.4	-66.1	-50.4	-65.7	0	0	113	I39 A165 A168 A169 E172 M305 T306 V307 M311 K312 N313	I39-M309 HydrophobicContact CD1-SD 4.03Å; A165-M309 HydrophobicContact CB-CB 4.34Å; A168-M309 HydrophobicContact CB-CB 4.27Å; A168-M309 HydrophobicContact CB-CE 3.76Å; A168-M309 HydrophobicContact CB-CG 4.31Å; A169-M309 HydrophobicContact CB-CG 3.97Å; E172-M309 HydrophobicContact CB-SD 4.38Å; E172-M309 HydrophobicContact CG-SD 4.37Å; M305-M309 VanDerWaalsContact O-CG 3.32Å; M305-M309 WeakPolarHBondContact O-CG 3.32Å; M305-M309 PolarHBondContact O-N 2.91Å; T306-M309 PolarHBondContact O-N 2.79Å; V307-M309 VanDerWaalsContact C-N 3.33Å; V307-M309 PolarHBondContact O-N 2.87Å; M309-M311 VanDerWaalsContact C-N 3.35Å; M309-K312 HydrophobicContact CE-CD 3.92Å; M309-K312 WeakPolarHBondContact O-CB 3.39Å; M309-K312 PolarHBondContact O-N 3.15Å; M309-K312 HydrophobicContact SD-CD 4.16Å; M309-N313 PolarHBondContact O-N 3.26Å
310	L	98.3	Very high	97.4	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-59.5	-47.1	170.3	178.7	66.8	0	0	0	111.1	K78 L120 V144 A165 T306 V307 K312 N313 T314	K78-L310 HydrophobicContact CB-CD2 4.39Å; K78-L310 HydrophobicContact CD-CD2 3.58Å; K78-L310 HydrophobicContact CG-CD2 3.74Å; L120-L310 HydrophobicContact CD2-CD1 3.85Å; L120-L310 HydrophobicContact CD2-CD2 3.76Å; L120-L310 HydrophobicContact CD2-CG 4.34Å; V144-L310 HydrophobicContact CB-CD1 4.04Å; V144-L310 HydrophobicContact CG2-CD1 3.73Å; A165-L310 HydrophobicContact CB-CB 4.14Å; T306-L310 PolarHBondContact O-N 3.03Å; V307-L310 WeakPolarHBondContact O-CB 3.5Å; V307-L310 PolarHBondContact O-N 3.16Å; L310-K312 VanDerWaalsContact C-N 3.3Å; L310-K312 PolarHBondContact O-N 3.01Å; L310-N313 WeakPolarHBondContact O-CB 3.36Å; L310-N313 PolarHBondContact O-N 2.92Å; L310-N313 VanDerWaalsContact O-N 3.16Å; L310-T314 PolarHBondContact O-N 3.48Å; L310-T314 PolarHBondContact O-OG1 3.31Å; L310-T314 VanDerWaalsContact O-OG1 3.14Å
311	M	98.4	Very high	97.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.3	-38.7	178	-60.5	-62.1	134.4	0	0	111.4	I43 L60 K78 A81 A82 L85 I87 V307 A308 M309 N313 T314 V315	I43-M311 HydrophobicContact CD1-CB 3.86Å; L60-M311 HydrophobicContact CD2-CE 3.69Å; L60-M311 HydrophobicContact CD2-SD 4.33Å; K78-M311 HydrophobicContact CB-CE 4.16Å; K78-M311 VanDerWaalsContact O-CE 3.25Å; K78-M311 WeakPolarHBondContact O-CE 3.35Å; A81-M311 HydrophobicContact CB-CE 4.41Å; A81-M311 HydrophobicContact CB-CG 4.39Å; A82-M311 VanDerWaalsContact CA-SD 3.57Å; A82-M311 HydrophobicContact CB-CE 4.3Å; A82-M311 HydrophobicContact CB-SD 3.71Å; L85-M311 HydrophobicContact CD1-CB 3.67Å; L85-M311 HydrophobicContact CD1-CG 3.65Å; I87-M311 HydrophobicContact CD1-CB 3.91Å; I87-M311 HydrophobicContact CD1-CG 4.47Å; I87-M311 HydrophobicContact CD1-SD 4.02Å; V307-M311 HydrophobicContact CG1-CE 4.47Å; V307-M311 WeakPolarHBondContact O-CG 3.49Å; V307-M311 PolarHBondContact O-N 3.4Å; A308-M311 PolarHBondContact O-N 3.2Å; M309-M311 VanDerWaalsContact C-N 3.35Å; M311-N313 VanDerWaalsContact C-N 3.35Å; M311-N313 PolarHBondContact O-N 3.2Å; M311-T314 WeakPolarHBondContact O-CB 3.41Å; M311-T314 PolarHBondContact O-N 3.11Å; M311-V315 PolarHBondContact O-N 2.62Å
312	K	98.4	Very high	96.8	Very high	59 Å²	59	27.8 Å²	27.8	26%	0.257	16%	0.164	S	C	.	.	H	α-helix	trans	-62.1	-40.9	173.4	-168.4	169.2	-179.2	169.4	0	112.3	I43 A308 M309 L310 T314 V315 T316	I43-K312 HydrophobicContact CD1-CB 4.01Å; I43-K312 HydrophobicContact CG1-CB 4.32Å; A308-K312 PolarHBondContact O-N 2.81Å; M309-K312 HydrophobicContact CE-CD 3.92Å; M309-K312 WeakPolarHBondContact O-CB 3.39Å; M309-K312 PolarHBondContact O-N 3.15Å; M309-K312 HydrophobicContact SD-CD 4.16Å; L310-K312 VanDerWaalsContact C-N 3.3Å; L310-K312 PolarHBondContact O-N 3.01Å; K312-T314 VanDerWaalsContact C-N 3.35Å; K312-V315 PolarHBondContact O-N 3.26Å; K312-T316 WeakPolarHBondContact O-CB 3.22Å; K312-T316 PolarHBondContact O-N 3.29Å; K312-T316 PolarHBondContact O-OG1 2.91Å
313	N	98.5	Very high	96	Very high	14 Å²	14	33.8 Å²	33.8	8%	0.075	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-40.4	173.8	-76	-5.4	0	0	0	111.2	V144 M162 V163 M309 L310 M311 V315 T316 A317	V144-N313 HydrophobicContact CB-CB 4Å; V144-N313 HydrophobicContact CG1-CB 4.26Å; V144-N313 WeakPolarHBondContact O-CB 3.22Å; V144-N313 PolarHBondContact O-ND2 3.37Å; M162-N313 HydrophobicContact SD-CB 4.29Å; V163-N313 PolarHBondContact O-ND2 3.45Å; M309-N313 PolarHBondContact O-N 3.26Å; L310-N313 WeakPolarHBondContact O-CB 3.36Å; L310-N313 PolarHBondContact O-N 2.92Å; L310-N313 VanDerWaalsContact O-N 3.16Å; M311-N313 VanDerWaalsContact C-N 3.35Å; M311-N313 PolarHBondContact O-N 3.2Å; N313-V315 PolarHBondContact O-N 3.47Å; N313-T316 WeakPolarHBondContact O-CB 3.43Å; N313-T316 PolarHBondContact O-N 3.09Å; N313-A317 WeakPolarHBondContact O-CB 3.44Å; N313-A317 PolarHBondContact O-N 3.09Å
314	T	98.5	Very high	94.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.9	-45.5	175.3	-50.2	0	0	0	0	112.6	P58 L60 I87 L310 M311 K312 T316 A317 A318	P58-T314 HydrophobicContact CB-CG2 4.3Å; L60-T314 HydrophobicContact CB-CG2 4.02Å; L60-T314 HydrophobicContact CD1-CG2 4.49Å; I87-T314 HydrophobicContact CG2-CG2 4.01Å; L310-T314 PolarHBondContact O-N 3.48Å; L310-T314 PolarHBondContact O-OG1 3.31Å; L310-T314 VanDerWaalsContact O-OG1 3.14Å; M311-T314 WeakPolarHBondContact O-CB 3.41Å; M311-T314 PolarHBondContact O-N 3.11Å; K312-T314 VanDerWaalsContact C-N 3.35Å; T314-T316 VanDerWaalsContact C-N 3.31Å; T314-T316 PolarHBondContact O-N 3.47Å; T314-A317 PolarHBondContact O-N 2.96Å; T314-A318 PolarHBondContact O-N 2.91Å
315	V	98.3	Very high	94.2	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-65.9	-37.4	176.1	178.1	0	0	0	0	111.4	I43 D46 V47 L50 P58 I87 M311 K312 N313 A318 R319	I43-V315 HydrophobicContact CG2-CG2 3.9Å; D46-V315 HydrophobicContact CB-CG1 4.01Å; V47-V315 HydrophobicContact CG2-CG2 3.68Å; L50-V315 HydrophobicContact CD1-CG1 3.98Å; P58-V315 HydrophobicContact CG-CG2 4.21Å; I87-V315 HydrophobicContact CD1-CG2 3.84Å; I87-V315 HydrophobicContact CG1-CG2 4.28Å; M311-V315 PolarHBondContact O-N 2.62Å; K312-V315 PolarHBondContact O-N 3.26Å; N313-V315 PolarHBondContact O-N 3.47Å; V315-A318 PolarHBondContact O-N 2.95Å; V315-R319 PolarHBondContact O-N 3.09Å
316	T	97.8	Very high	93.9	Very high	49 Å²	49	45 Å²	45	30%	0.301	24%	0.235	S	C	.	.	H	α-helix	trans	-63.8	-42.6	175.6	-56.7	0	0	0	0	111.2	M162 K312 N313 T314 R319 N320	M162-T316 HydrophobicContact CE-CG2 4.23Å; M162-T316 HydrophobicContact SD-CG2 4.46Å; K312-T316 WeakPolarHBondContact O-CB 3.22Å; K312-T316 PolarHBondContact O-N 3.29Å; K312-T316 PolarHBondContact O-OG1 2.91Å; N313-T316 WeakPolarHBondContact O-CB 3.43Å; N313-T316 PolarHBondContact O-N 3.09Å; T314-T316 VanDerWaalsContact C-N 3.31Å; T314-T316 PolarHBondContact O-N 3.47Å; T316-R319 PolarHBondContact O-N 2.99Å; T316-N320 WeakPolarHBondContact O-CB 3.34Å; T316-N320 PolarHBondContact O-N 3.28Å; T316-N320 PolarHBondContact O-ND2 3.15Å; T316-N320 PolarHBondContact O-OD1 3.07Å
317	A	97.9	Very high	93.8	Very high	3 Å²	3	45.8 Å²	45.8	3%	0.025	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-45.3	176.8	0	0	0	0	0	111.1	S117 E141 V144 M162 N313 T314 R319 N320 A321	S117-A317 VanDerWaalsContact O-CB 3.23Å; S117-A317 WeakPolarHBondContact O-CB 3.44Å; E141-A317 WeakPolarHBondContact O-CB 3.46Å; V144-A317 HydrophobicContact CG1-CB 4.21Å; M162-A317 HydrophobicContact CE-CB 3.6Å; N313-A317 WeakPolarHBondContact O-CB 3.44Å; N313-A317 PolarHBondContact O-N 3.09Å; T314-A317 PolarHBondContact O-N 2.96Å; A317-R319 PolarHBondContact O-N 2.89Å; A317-N320 PolarHBondContact O-N 2.88Å; A317-A321 PolarHBondContact O-N 3.18Å
318	A	97.6	Very high	93.6	Very high	10 Å²	10	46.6 Å²	46.6	8%	0.083	24%	0.241	C	C	.	.	H	α-helix	trans	-59.6	-45.2	174.5	0	0	0	0	0	112.3	P58 T314 V315 A321 L322	P58-A318 HydrophobicContact CB-CB 3.82Å; P58-A318 HydrophobicContact CG-CB 3.77Å; T314-A318 PolarHBondContact O-N 2.91Å; V315-A318 PolarHBondContact O-N 2.95Å; A318-A321 PolarHBondContact O-N 3.06Å; A318-L322 WeakPolarHBondContact O-CG 3.32Å
319	R	95.9	Very high	93.3	Very high	77 Å²	77	49.6 Å²	49.6	29%	0.291	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-43.2	176.2	-82.4	176.5	170.5	160.3	-5.5	112.3	D46 E49 L50 V315 T316 A317 A321 L322	D46-R319 VanDerWaalsContact CG-CZ 3.48Å; D46-R319 IonicContact OD1-CZ 3.23Å; D46-R319 IonicContact OD1-NH1 2.72Å; D46-R319 IonicContact OD1-NH2 2.88Å; D46-R319 PolarHBondContact OD1-NH2 3.17Å; D46-R319 IonicContact OD2-CZ 3.65Å; D46-R319 IonicContact OD2-NH1 3.51Å; D46-R319 PolarHBondContact OD2-NH1 2.83Å; D46-R319 IonicContact OD2-NH2 3.57Å; E49-R319 IonicContact OE2-NH2 3.36Å; E49-R319 PolarHBondContact OE2-NH2 3.35Å; L50-R319 HydrophobicContact CD1-CG 4.1Å; L50-R319 HydrophobicContact CD2-CG 3.85Å; L50-R319 HydrophobicContact CG-CG 4.35Å; V315-R319 PolarHBondContact O-N 3.09Å; T316-R319 PolarHBondContact O-N 2.99Å; A317-R319 PolarHBondContact O-N 2.89Å; R319-A321 VanDerWaalsContact C-N 3.31Å; R319-A321 PolarHBondContact O-N 3.21Å; R319-L322 WeakPolarHBondContact O-CB 3.38Å; R319-L322 PolarHBondContact O-N 3.49Å
320	N	93.9	Very high	93	Very high	57 Å²	57	52 Å²	52	31%	0.305	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-37.1	179.9	-69.5	-12.3	0	0	0	112.2	T316 A317 L322 M323 H324	T316-N320 WeakPolarHBondContact O-CB 3.34Å; T316-N320 PolarHBondContact O-N 3.28Å; T316-N320 PolarHBondContact O-ND2 3.15Å; T316-N320 PolarHBondContact O-OD1 3.07Å; A317-N320 PolarHBondContact O-N 2.88Å; N320-L322 PolarHBondContact O-N 3.39Å; N320-M323 HydrophobicContact CB-CE 4.34Å; N320-M323 PolarHBondContact O-N 2.91Å; N320-M323 VanDerWaalsContact O-N 3.11Å; N320-M323 WeakPolarHBondContact OD1-CE 3.43Å; N320-H324 PolarHBondContact O-CD2 3.08Å
321	A	92.4	Very high	92.6	Very high	64 Å²	64	55.6 Å²	55.6	53%	0.529	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-17.7	176.7	0	0	0	0	0	113.8	A317 A318 R319	A317-A321 PolarHBondContact O-N 3.18Å; A318-A321 PolarHBondContact O-N 3.06Å; R319-A321 VanDerWaalsContact C-N 3.31Å; R319-A321 PolarHBondContact O-N 3.21Å
322	L	89.6	Confident	92.2	Very high	90 Å²	90	59.8 Å²	59.8	47%	0.471	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.4	175.5	-60.2	172.5	0	0	0	113.2	L50 N55 A318 R319 N320	L50-L322 HydrophobicContact CD2-CD1 3.72Å; N55-L322 HydrophobicContact CB-CD1 4Å; N55-L322 HydrophobicContact CB-CD2 4.38Å; N55-L322 WeakPolarHBondContact OD1-CD1 3.16Å; N55-L322 WeakPolarHBondContact OD1-CD2 3.21Å; A318-L322 WeakPolarHBondContact O-CG 3.32Å; R319-L322 WeakPolarHBondContact O-CB 3.38Å; R319-L322 PolarHBondContact O-N 3.49Å; N320-L322 PolarHBondContact O-N 3.39Å
323	M	81	Confident	91.6	Very high	134 Å²	134	59.9 Å²	59.9	66%	0.66	31%	0.314	S	S	*	.			trans	-90.2	-3.8	-179.8	-65.5	-171.4	-74.3	0	0	112.8	N320	N320-M323 HydrophobicContact CB-CE 4.34Å; N320-M323 PolarHBondContact O-N 2.91Å; N320-M323 VanDerWaalsContact O-N 3.11Å; N320-M323 WeakPolarHBondContact OD1-CE 3.43Å
324	H	58.2	Low	91	Very high	219 Å²	219	64.1 Å²	64.1	100%	1.014	34%	0.335	S	S	*	.			trans	-121.3	0	-178.7	-67.9	-52.9	0	0	0	110.1	N320	N320-H324 PolarHBondContact O-CD2 3.08Å

Retrieved 324 of 324 residues in 548.3 ms (Link to these results)

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