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C-terminal-binding protein 1

Corepressor targeting diverse transcription regulators such as GLIS2 or BCL6. Has dehydrogenase activity. Involved in controlling the equilibrium between tubular and stacked structures in the Golgi complex. Functions in brown adipose tissue (BAT) differentiation.

AlphaFold DB (Q13363), UniProt , Accession X5D8Y5, Species HUMAN (Homo sapiens, Human), Gene CTBP1, Length 440 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.7	Very low	37.5	Very low	249 Å²	249	149.1 Å²	149.1	100%	1.227	86%	0.859	S	S	*	*				0	142.5	0	-69.8	166.7	177.6	0	0	107.2
2	G	33.9	Very low	37.8	Very low	83 Å²	83	146.8 Å²	146.8	86%	0.856	85%	0.853	S	S	*	*			trans	-84.3	153.7	-157.7	0	0	0	0	0	116.2
3	S	33.2	Very low	38.4	Very low	120 Å²	120	148.9 Å²	148.9	84%	0.839	86%	0.858	S	S	*	*			trans	-83.6	163.9	173.7	-41.8	0	0	0	0	112.4
4	S	36.8	Very low	38.5	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	83%	0.83	S	S	*	*			trans	-151.9	124.5	148.1	-170.6	0	0	0	0	110.7
5	H	38.7	Very low	39.4	Very low	170 Å²	170	138.9 Å²	138.9	79%	0.787	82%	0.816	S	S	*	*			trans	-94.9	130.1	166.2	-84.2	-86.1	0	0	0	108.8	L7	H5-L7 HydrophobicContact CB-CD1 4.44Å; H5-L7 PolarHBondContact O-N 3.09Å
6	L	39.3	Very low	40.4	Very low	176 Å²	176	134.9 Å²	134.9	92%	0.921	78%	0.783	S	S	*	*			trans	-77.8	100.2	169.6	-74.9	167.2	0	0	0	109.8
7	L	38.5	Very low	40.7	Very low	147 Å²	147	132.9 Å²	132.9	77%	0.77	78%	0.775	S	S	*	*			trans	-76.4	123.8	163.9	-93.1	79.7	0	0	0	109.6	H5 K9	H5-L7 HydrophobicContact CB-CD1 4.44Å; H5-L7 PolarHBondContact O-N 3.09Å; L7-K9 PolarHBondContact O-N 3.36Å
8	N	33.1	Very low	41.2	Very low	165 Å²	165	131 Å²	131	88%	0.882	77%	0.768	S	S	*	*			trans	-74	111.5	171.7	-170.5	14.1	0	0	0	109.8
9	K	38.5	Very low	42	Very low	187 Å²	187	128.3 Å²	128.3	81%	0.813	75%	0.749	S	S	*	*			trans	-96.9	107.9	174.9	-74.9	-170.2	174.6	-172.4	0	110	L7	L7-K9 PolarHBondContact O-N 3.36Å
10	G	36.4	Very low	42	Very low	71 Å²	71	129.2 Å²	129.2	73%	0.732	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-66.6	147.6	167.3	0	0	0	0	0	111.6
11	L	39.3	Very low	42	Very low	160 Å²	160	131.1 Å²	131.1	84%	0.838	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-73.1	150.6	171.5	-86.2	74.7	0	0	0	110.7
12	P	40.9	Very low	42	Very low	122 Å²	122	120.8 Å²	120.8	79%	0.792	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-66.8	138.8	174	28.6	-34.2	0	0	0	111.5	G14	P12-G14 PolarHBondContact O-N 3.22Å
13	L	46.4	Very low	42.3	Very low	174 Å²	174	122.9 Å²	122.9	91%	0.911	71%	0.711	S	S	*	*			trans	-76.8	83.3	175.1	-73.7	161.4	0	0	0	110
14	G	39.7	Very low	42.8	Very low	46 Å²	46	125.7 Å²	125.7	47%	0.474	72%	0.715	S	S	.	*			trans	-127.8	119.4	178.8	0	0	0	0	0	112.7	P12	P12-G14 PolarHBondContact O-N 3.22Å
15	V	51.1	Low	43.5	Very low	102 Å²	102	126.2 Å²	126.2	62%	0.618	71%	0.705	S	S	*	*			trans	47.4	98	166.2	-170.2	0	0	0	0	115.9	A363	V15-A363 HydrophobicContact CG2-CB 4.05Å
16	R	56.5	Low	45.1	Very low	75 Å²	75	123.7 Å²	123.7	28%	0.283	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-58.7	128.7	167.5	-68.5	-178.5	178	178.6	-2.5	109.7	F89 K90 L92	R16-F89 PolarHBondContact NH1-O 2.7Å; R16-F89 PolarHBondContact NH2-O 2.76Å; R16-K90 PolarHBondContact NH1-O 2.87Å; R16-K90 PolarHBondContact NH2-O 2.92Å; R16-L92 VanDerWaalsContact NH1-N 3.18Å; R16-L92 PolarHBondContact NH1-O 3.21Å
17	P	44.5	Very low	47.4	Very low	100 Å²	100	121.9 Å²	121.9	65%	0.649	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-64.4	157.5	-171.8	25.1	-34.6	0	0	0	113
18	P	50.9	Low	50.2	Low	99 Å²	99	116.2 Å²	116.2	64%	0.643	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-63.6	148.6	175.7	28.4	-35.3	0	0	0	111.2	M20	P18-M20 PolarHBondContact O-N 3.27Å
19	I	55	Low	53.2	Low	79 Å²	79	109.3 Å²	109.3	41%	0.405	62%	0.62	S	S	.	*			trans	-65.2	109.6	172.7	-57.4	175.1	0	0	0	107.6	V71	I19-V71 HydrophobicContact CD1-CG1 4.15Å
20	M	42.8	Very low	56.1	Low	146 Å²	146	100.4 Å²	100.4	72%	0.719	58%	0.581	S	S	*	*			trans	-79.6	120.6	178.6	-68.6	-177.1	66.8	0	0	109.7	P18 G22 H25	P18-M20 PolarHBondContact O-N 3.27Å; M20-G22 PolarHBondContact O-N 2.93Å; M20-H25 PolarHBondContact O-CD2 3.33Å; M20-H25 VanDerWaalsContact O-CD2 3.25Å
21	N	42.1	Very low	59.1	Low	170 Å²	170	97 Å²	97	91%	0.909	55%	0.546	S	S	*	.			trans	-76.3	66.9	174.1	-73.5	-20	0	0	0	111
22	G	45.5	Very low	61.9	Low	32 Å²	32	89.4 Å²	89.4	33%	0.33	51%	0.506	S	S	.	.			trans	-92.6	164.5	169.3	0	0	0	0	0	112.8	M20 L24	M20-G22 PolarHBondContact O-N 2.93Å; G22-L24 PolarHBondContact O-N 3.04Å
23	P	38.5	Very low	64.6	Low	127 Å²	127	83.6 Å²	83.6	83%	0.825	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	130.4	-178.7	-19.6	32.8	0	0	0	112.6	H25	P23-H25 PolarHBondContact O-N 2.9Å
24	L	44.1	Very low	67.1	Low	179 Å²	179	75.8 Å²	75.8	94%	0.937	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	37.1	171.5	-78.9	129.7	0	0	0	116.3	G22	G22-L24 PolarHBondContact O-N 3.04Å
25	H	52.5	Low	69.8	Low	124 Å²	124	74.1 Å²	74.1	57%	0.574	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-61.3	141	152.1	-72.6	-68.3	0	0	0	110.1	M20 P23	M20-H25 PolarHBondContact O-CD2 3.33Å; M20-H25 VanDerWaalsContact O-CD2 3.25Å; P23-H25 PolarHBondContact O-N 2.9Å
26	P	70.9	Confident	72	Confident	116 Å²	116	77.3 Å²	77.3	75%	0.753	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-61.3	141.3	172.9	27.1	-34	0	0	0	109.7
27	R	89	Confident	73.9	Confident	138 Å²	138	76.7 Å²	76.7	52%	0.521	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-58.1	129.6	178.9	-73.4	176.8	172.2	-172.6	-9.8	110	L29 K46 T50	R27-L29 PolarHBondContact O-N 3.1Å; R27-K46 VanDerWaalsContact CZ-O 3.32Å; R27-K46 PolarHBondContact NH1-O 2.96Å; R27-K46 PolarHBondContact NH2-O 3.47Å; R27-T50 WeakPolarHBondContact CB-OG1 3.09Å; R27-T50 PolarHBondContact O-OG1 3.08Å
28	P	96	Very high	76.4	Confident	28 Å²	28	72.7 Å²	72.7	18%	0.182	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-54.7	135.3	-175.3	21.9	-34	0	0	0	111.3	V48 A49 T50 V71 I339	P28-V48 WeakPolarHBondContact CD-O 3.14Å; P28-V48 WeakPolarHBondContact CG-O 3.47Å; P28-A49 WeakPolarHBondContact O-CA 3.2Å; P28-A49 WeakPolarHBondContact O-CB 3.35Å; P28-T50 PolarHBondContact O-N 3.32Å; P28-V71 HydrophobicContact CB-CB 4.01Å; P28-V71 HydrophobicContact CB-CG1 4.43Å; P28-V71 HydrophobicContact CB-CG2 3.92Å; P28-I339 HydrophobicContact CG-CD1 4.17Å; P28-I339 HydrophobicContact CG-CG1 4.48Å; P28-I339 HydrophobicContact CG-CG2 3.98Å
29	L	97.8	Very high	78.6	Confident	21 Å²	21	72.6 Å²	72.6	11%	0.11	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.3	177.9	176.6	62.9	0	0	0	109.8	R27 T50 A52 V66 E69 A70 V71 G72	R27-L29 PolarHBondContact O-N 3.1Å; L29-T50 WeakPolarHBondContact CA-O 3.3Å; L29-A52 HydrophobicContact CD1-CB 3.96Å; L29-V66 HydrophobicContact CD2-CG2 4.38Å; L29-E69 HydrophobicContact CD2-CB 4.04Å; L29-A70 HydrophobicContact CD2-CB 4.25Å; L29-A70 HydrophobicContact CG-CB 4.25Å; L29-V71 PolarHBondContact O-N 2.87Å; L29-G72 PolarHBondContact O-N 3.28Å
30	V	98.5	Very high	80.7	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.4	170.7	176.4	0	0	0	0	107.6	L45 A49 T50 V51 A52 G72 L74 I335 I339	V30-L45 HydrophobicContact CG1-CD1 4.26Å; V30-A49 HydrophobicContact CG2-CB 3.78Å; V30-T50 PolarHBondContact N-O 3.37Å; V30-V51 CarbonylContact O-C 3.57Å; V30-V51 WeakPolarHBondContact O-CA 3.39Å; V30-A52 PolarHBondContact O-N 2.86Å; V30-G72 VanDerWaalsContact CA-O 3.3Å; V30-G72 WeakPolarHBondContact CA-O 3.41Å; V30-L74 HydrophobicContact CG1-CG 4.37Å; V30-I335 HydrophobicContact CB-CG2 4.5Å; V30-I335 HydrophobicContact CG1-CG1 4.45Å; V30-I335 HydrophobicContact CG1-CG2 4.01Å; V30-I335 HydrophobicContact CG2-CG2 3.64Å; V30-I339 HydrophobicContact CG2-CD1 3.83Å
31	A	98.4	Very high	83.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.6	-178.2	0	0	0	0	0	111.9	L33 A52 V66 A70 G72 A73 L74	A31-L33 HydrophobicContact CB-CD2 3.99Å; A31-A52 WeakPolarHBondContact CA-O 3.36Å; A31-V66 HydrophobicContact CB-CG1 3.55Å; A31-V66 HydrophobicContact CB-CG2 4.45Å; A31-A70 HydrophobicContact CB-CB 4.48Å; A31-G72 PolarHBondContact N-O 3.34Å; A31-A73 CarbonylContact O-C 3.54Å; A31-A73 WeakPolarHBondContact O-CA 3.49Å; A31-L74 PolarHBondContact O-N 2.69Å
32	L	98.6	Very high	86	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	114.7	160.3	179.3	63.9	0	0	0	108.2	D37 A52 F53 C54 L74 Y76 I98	L32-D37 VanDerWaalsContact CD2-O 3.26Å; L32-D37 WeakPolarHBondContact CD2-O 3.43Å; L32-A52 PolarHBondContact N-O 3.4Å; L32-F53 HydrophobicContact CB-CB 4.13Å; L32-F53 CarbonylContact O-C 3.56Å; L32-F53 VanDerWaalsContact O-CA 3.28Å; L32-F53 WeakPolarHBondContact O-CA 3.2Å; L32-C54 PolarHBondContact O-N 3.35Å; L32-L74 WeakPolarHBondContact CA-O 3.45Å; L32-L74 HydrophobicContact CB-CB 4.49Å; L32-L74 HydrophobicContact CD1-CB 3.82Å; L32-Y76 HydrophobicContact CD1-CD2 4.29Å; L32-Y76 HydrophobicContact CD1-CE2 3.84Å; L32-Y76 HydrophobicContact CD2-CE2 4.45Å; L32-I98 HydrophobicContact CD1-CD1 3.8Å
33	L	98.6	Very high	88.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.324	C	S	.	.	S	Bend	trans	-77.2	-61.2	-170.5	-54.8	-172.5	0	0	0	111.6	A31 G35 C54 D55 A56 I62 V66 A73 L74 M75 I79 L81 F89	A31-L33 HydrophobicContact CB-CD2 3.99Å; L33-G35 PolarHBondContact O-N 3.36Å; L33-C54 WeakPolarHBondContact O-CB 3.43Å; L33-D55 PolarHBondContact O-N 3.42Å; L33-A56 PolarHBondContact O-N 3.2Å; L33-I62 HydrophobicContact CD1-CD1 4.29Å; L33-I62 HydrophobicContact CD2-CD1 4.21Å; L33-V66 HydrophobicContact CD2-CG1 4.46Å; L33-A73 HydrophobicContact CD1-CB 4.19Å; L33-A73 HydrophobicContact CD2-CB 4.29Å; L33-A73 HydrophobicContact CG-CB 4.23Å; L33-L74 PolarHBondContact N-O 2.98Å; L33-M75 HydrophobicContact CB-CB 4.33Å; L33-M75 HydrophobicContact CD1-CB 4.4Å; L33-M75 HydrophobicContact CD1-SD 4.16Å; L33-M75 HydrophobicContact CG-CB 4.46Å; L33-I79 HydrophobicContact CB-CG2 4.27Å; L33-L81 HydrophobicContact CD1-CD1 4.15Å; L33-F89 HydrophobicContact CD1-CZ 4.34Å
34	D	98.1	Very high	91.3	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.053	29%	0.293	C	S	.	.	S	Bend	trans	-103.3	37	-169.9	59.3	-15	0	0	0	112.9	A56 M75 Y76 T78 I79	D34-A56 WeakPolarHBondContact CA-O 3.46Å; D34-A56 WeakPolarHBondContact CB-O 3.35Å; D34-M75 WeakPolarHBondContact OD1-CA 3.4Å; D34-M75 WeakPolarHBondContact OD1-CB 3.47Å; D34-Y76 VanDerWaalsContact CG-N 3.29Å; D34-Y76 PolarHBondContact OD1-N 2.87Å; D34-Y76 VanDerWaalsContact OD2-CA 3.32Å; D34-Y76 WeakPolarHBondContact OD2-CA 3.42Å; D34-Y76 WeakPolarHBondContact OD2-CB 3.37Å; D34-Y76 PolarHBondContact OD2-N 3.1Å; D34-T78 WeakPolarHBondContact CB-OG1 3.42Å; D34-T78 PolarHBondContact OD2-N 2.88Å; D34-T78 PolarHBondContact OD2-OG1 3.41Å; D34-I79 HydrophobicContact CB-CB 3.92Å; D34-I79 HydrophobicContact CB-CG2 3.73Å; D34-I79 PolarHBondContact OD2-N 3.26Å
35	G	96.6	Very high	93.9	Very high	11 Å²	11	48.2 Å²	48.2	11%	0.113	25%	0.248	C	C	.	.			trans	-154.3	170.9	178.1	0	0	0	0	0	113.5	L33 F53 D55	L33-G35 PolarHBondContact O-N 3.36Å; G35-F53 WeakPolarHBondContact O-CB 3.33Å; G35-D55 PolarHBondContact O-N 3.16Å
36	R	96.5	Very high	96	Very high	168 Å²	168	48.4 Å²	48.4	63%	0.634	25%	0.248	S	C	*	.	S	Bend	trans	-116.9	-21.8	-174.9	-59.9	175.8	69.3	112.6	8.6	114.4	D55	R36-D55 VanDerWaalsContact CD-OD1 3.31Å; R36-D55 WeakPolarHBondContact CD-OD1 2.96Å; R36-D55 WeakPolarHBondContact CD-OD2 3.25Å; R36-D55 HydrophobicContact CG-CB 3.85Å; R36-D55 WeakPolarHBondContact CG-OD1 3.48Å; R36-D55 WeakPolarHBondContact CG-OD2 3.47Å; R36-D55 IonicContact CZ-OD2 3.6Å; R36-D55 VanDerWaalsContact CZ-OD2 3.27Å; R36-D55 IonicContact NE-OD2 3.34Å; R36-D55 IonicContact NH1-OD2 2.7Å; R36-D55 PolarHBondContact NH1-OD2 2.96Å
37	D	97.3	Very high	97.2	Very high	63 Å²	63	46.8 Å²	46.8	34%	0.337	23%	0.233	S	C	.	.			trans	-106.2	116	-171.7	174.8	14.4	0	0	0	110	L32 T39 R328	L32-D37 VanDerWaalsContact CD2-O 3.26Å; L32-D37 WeakPolarHBondContact CD2-O 3.43Å; D37-T39 VanDerWaalsContact OD1-CB 3.24Å; D37-T39 WeakPolarHBondContact OD1-CB 3.1Å; D37-T39 VanDerWaalsContact OD1-CG2 3.24Å; D37-T39 WeakPolarHBondContact OD1-CG2 3.47Å; D37-T39 PolarHBondContact OD1-N 3.42Å; D37-T39 PolarHBondContact OD1-OG1 3.41Å; D37-T39 PolarHBondContact OD2-OG1 3.14Å; D37-R328 PolarHBondContact O-NH2 2.96Å; D37-R328 VanDerWaalsContact O-NH2 3.08Å; D37-R328 IonicContact OD1-NH2 2.7Å; D37-R328 PolarHBondContact OD1-NH2 3.39Å; D37-R328 VanDerWaalsContact OD1-NH2 3.14Å; D37-R328 IonicContact OD2-CZ 3.38Å; D37-R328 VanDerWaalsContact OD2-CZ 3.31Å; D37-R328 IonicContact OD2-NH1 2.77Å; D37-R328 PolarHBondContact OD2-NH1 3.12Å; D37-R328 IonicContact OD2-NH2 3.65Å; D37-R328 PolarHBondContact OD2-NH2 3.18Å; D37-R328 VanDerWaalsContact OD2-NH2 3.08Å
38	C	97.1	Very high	97.5	Very high	15 Å²	15	41.5 Å²	41.5	10%	0.101	22%	0.216	C	C	.	.			trans	-113.1	18.9	173.3	-63.6	0	0	0	0	113	V40 E41 M42 V51	C38-V40 VanDerWaalsContact C-N 3.34Å; C38-V40 PolarHBondContact O-N 3.48Å; C38-E41 WeakPolarHBondContact CA-OE2 3.47Å; C38-E41 PolarHBondContact O-N 2.97Å; C38-M42 HydrophobicContact CB-CG 4.1Å; C38-M42 WeakPolarHBondContact O-CB 3.34Å; C38-M42 VanDerWaalsContact O-CG 3.26Å; C38-M42 WeakPolarHBondContact O-CG 3.38Å; C38-M42 PolarHBondContact O-N 3.08Å; C38-V51 HydrophobicContact CB-CG1 4.1Å
39	T	97.9	Very high	97.6	Very high	98 Å²	98	40.3 Å²	40.3	60%	0.601	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.4	-172.3	55.7	0	0	0	0	114.6	D37 P43	D37-T39 VanDerWaalsContact OD1-CB 3.24Å; D37-T39 WeakPolarHBondContact OD1-CB 3.1Å; D37-T39 VanDerWaalsContact OD1-CG2 3.24Å; D37-T39 WeakPolarHBondContact OD1-CG2 3.47Å; D37-T39 PolarHBondContact OD1-N 3.42Å; D37-T39 PolarHBondContact OD1-OG1 3.41Å; D37-T39 PolarHBondContact OD2-OG1 3.14Å; T39-P43 WeakPolarHBondContact O-CD 3.22Å; T39-P43 WeakPolarHBondContact O-CG 3.21Å
40	V	98.3	Very high	97.6	Very high	25 Å²	25	42.7 Å²	42.7	15%	0.152	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-38.1	174.8	178.8	0	0	0	0	110.8	C38 I44 R328 E329	C38-V40 VanDerWaalsContact C-N 3.34Å; C38-V40 PolarHBondContact O-N 3.48Å; V40-I44 WeakPolarHBondContact O-CD1 3.39Å; V40-R328 HydrophobicContact CB-CB 4.03Å; V40-R328 HydrophobicContact CG1-CB 3.79Å; V40-E329 HydrophobicContact CG1-CB 4.38Å; V40-E329 HydrophobicContact CG1-CG 3.61Å
41	E	98.6	Very high	97.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.9	-41.2	-175.6	-61	75.1	-174.6	0	0	112	C38 I44 L45 L74 R328 A332	C38-E41 WeakPolarHBondContact CA-OE2 3.47Å; C38-E41 PolarHBondContact O-N 2.97Å; E41-I44 PolarHBondContact O-N 3.01Å; E41-I44 VanDerWaalsContact O-N 3.1Å; E41-L45 PolarHBondContact O-N 3.36Å; E41-L74 HydrophobicContact CB-CD1 4.39Å; E41-L74 HydrophobicContact CG-CD1 3.69Å; E41-R328 VanDerWaalsContact OE1-CB 3.31Å; E41-R328 WeakPolarHBondContact OE1-CB 3.33Å; E41-R328 WeakPolarHBondContact OE1-CG 3.35Å; E41-R328 IonicContact OE1-CZ 2.72Å; E41-R328 IonicContact OE1-NE 3.52Å; E41-R328 PolarHBondContact OE1-NE 3.37Å; E41-R328 IonicContact OE1-NH2 3.43Å; E41-R328 IonicContact OE2-CZ 3.56Å; E41-R328 IonicContact OE2-NE 2.67Å; E41-R328 PolarHBondContact OE2-NE 3.22Å; E41-R328 IonicContact OE2-NH2 3.5Å; E41-R328 PolarHBondContact OE2-NH2 3.15Å; E41-A332 HydrophobicContact CB-CB 4.22Å; E41-A332 HydrophobicContact CG-CB 4.26Å
42	M	97.3	Very high	97.5	Very high	87 Å²	87	45.2 Å²	45.2	43%	0.429	24%	0.243	S	C	.	.	H	α-helix	trans	-57.1	-50	-177.2	-87.2	-79.9	-84.9	0	0	113.1	C38 I44 L45 K46 V51	C38-M42 HydrophobicContact CB-CG 4.1Å; C38-M42 WeakPolarHBondContact O-CB 3.34Å; C38-M42 VanDerWaalsContact O-CG 3.26Å; C38-M42 WeakPolarHBondContact O-CG 3.38Å; C38-M42 PolarHBondContact O-N 3.08Å; M42-I44 PolarHBondContact O-N 2.78Å; M42-I44 VanDerWaalsContact O-N 3.15Å; M42-L45 PolarHBondContact O-N 3.37Å; M42-K46 WeakPolarHBondContact O-CB 3.33Å; M42-K46 WeakPolarHBondContact O-CG 3.19Å; M42-K46 PolarHBondContact O-N 3.35Å; M42-V51 HydrophobicContact CG-CB 4.2Å; M42-V51 HydrophobicContact SD-CB 3.72Å; M42-V51 HydrophobicContact SD-CG2 4.02Å
43	P	97.8	Very high	97.4	Very high	75 Å²	75	50.3 Å²	50.3	49%	0.487	27%	0.265	S	S	.	.	H	α-helix	trans	-54.4	-31.1	174.8	-28.5	35.8	0	0	0	114.9	T39 K46	T39-P43 WeakPolarHBondContact O-CD 3.22Å; T39-P43 WeakPolarHBondContact O-CG 3.21Å; P43-K46 WeakPolarHBondContact O-CE 3.3Å
44	I	98.4	Very high	97.3	Very high	33 Å²	33	51.8 Å²	51.8	17%	0.169	28%	0.275	C	S	.	.	H	α-helix	trans	-86.7	-23.9	-175.7	-61.7	171	0	0	0	112.1	V40 E41 M42 E329 A332 R333 R336	V40-I44 WeakPolarHBondContact O-CD1 3.39Å; E41-I44 PolarHBondContact O-N 3.01Å; E41-I44 VanDerWaalsContact O-N 3.1Å; M42-I44 PolarHBondContact O-N 2.78Å; M42-I44 VanDerWaalsContact O-N 3.15Å; I44-E329 HydrophobicContact CD1-CB 3.88Å; I44-E329 HydrophobicContact CD1-CG 3.91Å; I44-A332 HydrophobicContact CB-CB 3.98Å; I44-A332 HydrophobicContact CD1-CB 4.02Å; I44-A332 HydrophobicContact CG2-CB 3.8Å; I44-R333 HydrophobicContact CG2-CG 4.27Å; I44-R336 PolarHBondContact O-NH1 3.32Å
45	L	98.2	Very high	97.2	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-115.4	-16.3	-172.8	-68.1	177	0	0	0	115.2	V30 E41 M42 D47 V48 A49 V51 A332 I335 R336	V30-L45 HydrophobicContact CG1-CD1 4.26Å; E41-L45 PolarHBondContact O-N 3.36Å; M42-L45 PolarHBondContact O-N 3.37Å; L45-D47 PolarHBondContact O-N 3.47Å; L45-V48 HydrophobicContact CD2-CG2 4.07Å; L45-V48 WeakPolarHBondContact O-CG2 3.49Å; L45-V48 PolarHBondContact O-N 2.92Å; L45-A49 HydrophobicContact CB-CB 4.35Å; L45-A49 PolarHBondContact O-N 3.12Å; L45-V51 HydrophobicContact CB-CG2 3.62Å; L45-V51 HydrophobicContact CD1-CG2 3.84Å; L45-V51 HydrophobicContact CG-CG2 4.39Å; L45-A332 HydrophobicContact CD1-CB 4.28Å; L45-A332 WeakPolarHBondContact CD2-O 3.05Å; L45-A332 HydrophobicContact CG-CB 4.33Å; L45-I335 HydrophobicContact CD1-CB 4.34Å; L45-I335 HydrophobicContact CD1-CG2 3.93Å; L45-I335 HydrophobicContact CD2-CB 4.24Å; L45-I335 HydrophobicContact CD2-CG2 3.8Å; L45-R336 HydrophobicContact CD2-CB 3.98Å
46	K	95.7	Very high	97.3	Very high	129 Å²	129	53.5 Å²	53.5	56%	0.561	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.8	-173.4	60.9	-179.3	177.2	-174.7	0	117.3	R27 M42 P43	R27-K46 VanDerWaalsContact CZ-O 3.32Å; R27-K46 PolarHBondContact NH1-O 2.96Å; R27-K46 PolarHBondContact NH2-O 3.47Å; M42-K46 WeakPolarHBondContact O-CB 3.33Å; M42-K46 WeakPolarHBondContact O-CG 3.19Å; M42-K46 PolarHBondContact O-N 3.35Å; P43-K46 WeakPolarHBondContact O-CE 3.3Å
47	D	96.1	Very high	97.2	Very high	81 Å²	81	50.2 Å²	50.2	43%	0.433	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-27.7	177.4	60.9	-44.1	0	0	0	112.7	L45 R336	L45-D47 PolarHBondContact O-N 3.47Å; D47-R336 IonicContact OD1-CZ 2.77Å; D47-R336 IonicContact OD1-NH1 3.08Å; D47-R336 PolarHBondContact OD1-NH1 3.3Å; D47-R336 IonicContact OD1-NH2 3.41Å; D47-R336 IonicContact OD2-CZ 3.84Å; D47-R336 IonicContact OD2-NH1 3.08Å; D47-R336 PolarHBondContact OD2-NH1 2.98Å; D47-R336 IonicContact OD2-NH2 2.72Å; D47-R336 PolarHBondContact OD2-NH2 2.86Å
48	V	96.8	Very high	97.1	Very high	27 Å²	27	48.9 Å²	48.9	16%	0.164	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-20.6	-175.9	-64	0	0	0	0	114.7	P28 L45 R336 I339 T340	P28-V48 WeakPolarHBondContact CD-O 3.14Å; P28-V48 WeakPolarHBondContact CG-O 3.47Å; L45-V48 HydrophobicContact CD2-CG2 4.07Å; L45-V48 WeakPolarHBondContact O-CG2 3.49Å; L45-V48 PolarHBondContact O-N 2.92Å; V48-R336 HydrophobicContact CG2-CG 4.33Å; V48-I339 HydrophobicContact CB-CG2 4.26Å; V48-T340 HydrophobicContact CG1-CG2 3.94Å
49	A	97.6	Very high	97	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.025	27%	0.266	C	S	.	.			trans	-141.2	167.3	-171.6	0	0	0	0	0	113.2	P28 V30 L45 I339	P28-A49 WeakPolarHBondContact O-CA 3.2Å; P28-A49 WeakPolarHBondContact O-CB 3.35Å; V30-A49 HydrophobicContact CG2-CB 3.78Å; L45-A49 HydrophobicContact CB-CB 4.35Å; L45-A49 PolarHBondContact O-N 3.12Å; A49-I339 HydrophobicContact CB-CD1 3.96Å
50	T	97.2	Very high	96.9	Very high	72 Å²	72	51.2 Å²	51.2	44%	0.442	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	114.7	160.1	-51.9	0	0	0	0	107.1	R27 P28 L29 V30	R27-T50 WeakPolarHBondContact CB-OG1 3.09Å; R27-T50 PolarHBondContact O-OG1 3.08Å; P28-T50 PolarHBondContact O-N 3.32Å; L29-T50 WeakPolarHBondContact CA-O 3.3Å; V30-T50 PolarHBondContact N-O 3.37Å
51	V	97.3	Very high	96.9	Very high	20 Å²	20	54.7 Å²	54.7	12%	0.121	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.6	176.2	-166.8	0	0	0	0	109.8	V30 C38 M42 L45	V30-V51 CarbonylContact O-C 3.57Å; V30-V51 WeakPolarHBondContact O-CA 3.39Å; C38-V51 HydrophobicContact CB-CG1 4.1Å; M42-V51 HydrophobicContact CG-CB 4.2Å; M42-V51 HydrophobicContact SD-CB 3.72Å; M42-V51 HydrophobicContact SD-CG2 4.02Å; L45-V51 HydrophobicContact CB-CG2 3.62Å; L45-V51 HydrophobicContact CD1-CG2 3.84Å; L45-V51 HydrophobicContact CG-CG2 4.39Å
52	A	96.6	Very high	96.8	Very high	33 Å²	33	55 Å²	55	27%	0.273	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	169.5	171.7	0	0	0	0	0	110.1	L29 V30 A31 L32	L29-A52 HydrophobicContact CD1-CB 3.96Å; V30-A52 PolarHBondContact O-N 2.86Å; A31-A52 WeakPolarHBondContact CA-O 3.36Å; L32-A52 PolarHBondContact N-O 3.4Å
53	F	97.2	Very high	96.7	Very high	107 Å²	107	57.1 Å²	57.1	47%	0.469	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	158	171.2	69.8	-95.6	0	0	0	110.3	L32 G35 D55	L32-F53 HydrophobicContact CB-CB 4.13Å; L32-F53 CarbonylContact O-C 3.56Å; L32-F53 VanDerWaalsContact O-CA 3.28Å; L32-F53 WeakPolarHBondContact O-CA 3.2Å; G35-F53 WeakPolarHBondContact O-CB 3.33Å; F53-D55 HydrophobicContact CD2-CB 4.45Å
54	C	96.6	Very high	96.7	Very high	31 Å²	31	60 Å²	60	21%	0.209	30%	0.303	C	S	.	.			trans	-115.8	-25.8	-178.5	-53.7	0	0	0	0	113.9	L32 L33 A56	L32-C54 PolarHBondContact O-N 3.35Å; L33-C54 WeakPolarHBondContact O-CB 3.43Å; C54-A56 HydrophobicContact CB-CB 4.03Å; C54-A56 PolarHBondContact O-N 3.08Å
55	D	96.8	Very high	96.6	Very high	56 Å²	56	63.6 Å²	63.6	30%	0.299	32%	0.318	S	S	.	.			trans	55.8	28.6	-173.5	-160.3	26.7	0	0	0	113.8	L33 G35 R36 F53	L33-D55 PolarHBondContact O-N 3.42Å; G35-D55 PolarHBondContact O-N 3.16Å; R36-D55 VanDerWaalsContact CD-OD1 3.31Å; R36-D55 WeakPolarHBondContact CD-OD1 2.96Å; R36-D55 WeakPolarHBondContact CD-OD2 3.25Å; R36-D55 HydrophobicContact CG-CB 3.85Å; R36-D55 WeakPolarHBondContact CG-OD1 3.48Å; R36-D55 WeakPolarHBondContact CG-OD2 3.47Å; R36-D55 IonicContact CZ-OD2 3.6Å; R36-D55 VanDerWaalsContact CZ-OD2 3.27Å; R36-D55 IonicContact NE-OD2 3.34Å; R36-D55 IonicContact NH1-OD2 2.7Å; R36-D55 PolarHBondContact NH1-OD2 2.96Å; F53-D55 HydrophobicContact CD2-CB 4.45Å
56	A	97.1	Very high	96.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.322	C	S	.	.			trans	-92.2	125.7	-169.9	0	0	0	0	0	111.8	L33 D34 C54 E61 I62	L33-A56 PolarHBondContact O-N 3.2Å; D34-A56 WeakPolarHBondContact CA-O 3.46Å; D34-A56 WeakPolarHBondContact CB-O 3.35Å; C54-A56 HydrophobicContact CB-CB 4.03Å; C54-A56 PolarHBondContact O-N 3.08Å; A56-E61 WeakPolarHBondContact CA-OE2 3.48Å; A56-E61 HydrophobicContact CB-CB 3.75Å; A56-I62 HydrophobicContact CB-CG1 3.83Å
57	Q	94.9	Very high	96.7	Very high	100 Å²	100	59.5 Å²	59.5	47%	0.467	30%	0.302	S	S	.	.	S	Bend	trans	-88.6	-16.8	171.6	-53.7	-54.2	-40	0	0	112.1	E61 T78	Q57-E61 PolarHBondContact N-OE2 3.45Å; Q57-T78 PolarHBondContact OE1-OG1 2.84Å
58	S	95.8	Very high	96.7	Very high	34 Å²	34	58.8 Å²	58.8	24%	0.238	30%	0.299	C	S	.	.	S	Bend	trans	-138.4	156.3	175.6	74.7	0	0	0	0	112.3	Q60 E61	S58-Q60 PolarHBondContact O-N 2.81Å; S58-Q60 VanDerWaalsContact O-N 3.13Å; S58-Q60 PolarHBondContact OG-OE1 3.45Å; S58-E61 WeakPolarHBondContact CB-OE1 3.46Å; S58-E61 PolarHBondContact N-OE1 2.93Å; S58-E61 WeakPolarHBondContact O-CB 3.46Å; S58-E61 PolarHBondContact O-N 2.99Å; S58-E61 PolarHBondContact OG-OE1 2.82Å
59	T	94.6	Very high	96.8	Very high	6 Å²	6	62.3 Å²	62.3	4%	0.037	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-61.5	-22.3	177.7	-40.2	0	0	0	0	112.6	E61 I62 D85 K88	T59-E61 VanDerWaalsContact C-N 3.26Å; T59-E61 PolarHBondContact O-N 2.82Å; T59-I62 HydrophobicContact CG2-CD1 4.14Å; T59-I62 PolarHBondContact O-N 2.93Å; T59-D85 WeakPolarHBondContact CB-OD1 3.4Å; T59-D85 HydrophobicContact CG2-CB 3.89Å; T59-D85 WeakPolarHBondContact CG2-OD1 3.21Å; T59-D85 PolarHBondContact OG1-OD1 2.88Å; T59-K88 HydrophobicContact CG2-CD 3.78Å
60	Q	96.3	Very high	96.8	Very high	156 Å²	156	62.1 Å²	62.1	73%	0.729	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-67.4	-24.3	175.3	-68.9	79.2	-11.4	0	0	112.7	S58	S58-Q60 PolarHBondContact O-N 2.81Å; S58-Q60 VanDerWaalsContact O-N 3.13Å; S58-Q60 PolarHBondContact OG-OE1 3.45Å
61	E	97.1	Very high	96.8	Very high	99 Å²	99	60 Å²	60	46%	0.463	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-86.9	-13.8	177.6	-67.6	147.8	-123.4	0	0	112.6	A56 Q57 S58 T59 H63	A56-E61 WeakPolarHBondContact CA-OE2 3.48Å; A56-E61 HydrophobicContact CB-CB 3.75Å; Q57-E61 PolarHBondContact N-OE2 3.45Å; S58-E61 WeakPolarHBondContact CB-OE1 3.46Å; S58-E61 PolarHBondContact N-OE1 2.93Å; S58-E61 WeakPolarHBondContact O-CB 3.46Å; S58-E61 PolarHBondContact O-N 2.99Å; S58-E61 PolarHBondContact OG-OE1 2.82Å; T59-E61 VanDerWaalsContact C-N 3.26Å; T59-E61 PolarHBondContact O-N 2.82Å; E61-H63 PolarHBondContact O-N 3.49Å; E61-H63 VanDerWaalsContact O-N 3.14Å
62	I	97.1	Very high	96.9	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.036	29%	0.294	C	S	.	.	S	Bend	trans	-71.9	110.7	-179.5	-57.2	179.3	0	0	0	109.6	L33 A56 T59 E64 V66 L67 I79 F89	L33-I62 HydrophobicContact CD1-CD1 4.29Å; L33-I62 HydrophobicContact CD2-CD1 4.21Å; A56-I62 HydrophobicContact CB-CG1 3.83Å; T59-I62 HydrophobicContact CG2-CD1 4.14Å; T59-I62 PolarHBondContact O-N 2.93Å; I62-E64 PolarHBondContact O-N 3.21Å; I62-V66 HydrophobicContact CG2-CB 3.77Å; I62-V66 HydrophobicContact CG2-CG1 3.64Å; I62-L67 HydrophobicContact CB-CD2 4.1Å; I62-L67 HydrophobicContact CB-CG 4.4Å; I62-L67 HydrophobicContact CG2-CD2 3.71Å; I62-L67 HydrophobicContact CG2-CG 3.93Å; I62-I79 HydrophobicContact CD1-CD1 3.91Å; I62-I79 HydrophobicContact CG1-CD1 4.45Å; I62-F89 HydrophobicContact CD1-CZ 3.93Å
63	H	96.3	Very high	97	Very high	131 Å²	131	57.6 Å²	57.6	61%	0.606	28%	0.281	S	S	*	.			trans	-52.9	135.5	-179.4	-176.4	-85.5	0	0	0	112.4	E61 K65 V66 L67	E61-H63 PolarHBondContact O-N 3.49Å; E61-H63 VanDerWaalsContact O-N 3.14Å; H63-K65 VanDerWaalsContact ND1-CB 3.35Å; H63-K65 WeakPolarHBondContact ND1-CB 3.32Å; H63-K65 PolarHBondContact ND1-N 2.92Å; H63-K65 PolarHBondContact O-N 3.1Å; H63-V66 WeakPolarHBondContact O-CB 3.22Å; H63-V66 PolarHBondContact O-N 3.1Å; H63-L67 PolarHBondContact O-N 3.21Å
64	E	96.9	Very high	97.1	Very high	134 Å²	134	52.5 Å²	52.5	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-47.6	-41.2	-173.4	179.3	-179.3	-178.1	0	0	113.7	I62 V66 L67 N68	I62-E64 PolarHBondContact O-N 3.21Å; E64-V66 PolarHBondContact O-N 3.16Å; E64-L67 PolarHBondContact O-N 2.82Å; E64-L67 VanDerWaalsContact O-N 3.11Å; E64-N68 VanDerWaalsContact CG-ND2 3.34Å; E64-N68 WeakPolarHBondContact CG-ND2 3.04Å; E64-N68 PolarHBondContact O-N 3.12Å; E64-N68 PolarHBondContact OE1-ND2 3.25Å
65	K	96.3	Very high	97.2	Very high	110 Å²	110	51 Å²	51	48%	0.478	25%	0.249	S	C	.	.	H	α-helix	trans	-53	-39.7	176	-167.2	-177.1	179.4	-176.7	0	113.1	H63 N68 E69	H63-K65 VanDerWaalsContact ND1-CB 3.35Å; H63-K65 WeakPolarHBondContact ND1-CB 3.32Å; H63-K65 PolarHBondContact ND1-N 2.92Å; H63-K65 PolarHBondContact O-N 3.1Å; K65-N68 PolarHBondContact O-N 3.43Å; K65-E69 WeakPolarHBondContact CE-OE1 3.35Å; K65-E69 WeakPolarHBondContact CE-OE2 3.41Å; K65-E69 HydrophobicContact CG-CG 4.27Å; K65-E69 WeakPolarHBondContact CG-OE1 3.27Å; K65-E69 IonicContact NZ-OE2 3.67Å; K65-E69 VanDerWaalsContact O-CB 3.29Å; K65-E69 WeakPolarHBondContact O-CB 3.22Å; K65-E69 PolarHBondContact O-N 2.87Å
66	V	97.5	Very high	97.2	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-70.2	-43.8	178.6	174	0	0	0	0	110.3	L29 A31 L33 I62 H63 E64 N68 A70 F89	L29-V66 HydrophobicContact CD2-CG2 4.38Å; A31-V66 HydrophobicContact CB-CG1 3.55Å; A31-V66 HydrophobicContact CB-CG2 4.45Å; L33-V66 HydrophobicContact CD2-CG1 4.46Å; I62-V66 HydrophobicContact CG2-CB 3.77Å; I62-V66 HydrophobicContact CG2-CG1 3.64Å; H63-V66 WeakPolarHBondContact O-CB 3.22Å; H63-V66 PolarHBondContact O-N 3.1Å; E64-V66 PolarHBondContact O-N 3.16Å; V66-N68 VanDerWaalsContact C-N 3.28Å; V66-N68 PolarHBondContact O-N 3.31Å; V66-A70 HydrophobicContact CG1-CB 3.95Å; V66-A70 WeakPolarHBondContact O-CB 3.21Å; V66-A70 PolarHBondContact O-N 3.25Å; V66-F89 HydrophobicContact CG1-CE1 4.44Å
67	L	97.6	Very high	97.2	Very high	29 Å²	29	52.8 Å²	52.8	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-38.8	175.4	-59.7	175.6	0	0	0	111.7	I62 H63 E64 K88 F89 K90	I62-L67 HydrophobicContact CB-CD2 4.1Å; I62-L67 HydrophobicContact CB-CG 4.4Å; I62-L67 HydrophobicContact CG2-CD2 3.71Å; I62-L67 HydrophobicContact CG2-CG 3.93Å; H63-L67 PolarHBondContact O-N 3.21Å; E64-L67 PolarHBondContact O-N 2.82Å; E64-L67 VanDerWaalsContact O-N 3.11Å; L67-K88 HydrophobicContact CD1-CB 4.42Å; L67-K88 HydrophobicContact CD2-CB 4.17Å; L67-F89 HydrophobicContact CD2-CD1 4.08Å; L67-F89 HydrophobicContact CD2-CD2 4.26Å; L67-F89 HydrophobicContact CD2-CE1 3.81Å; L67-F89 HydrophobicContact CD2-CE2 3.98Å; L67-F89 HydrophobicContact CD2-CG 4.31Å; L67-F89 HydrophobicContact CD2-CZ 3.77Å; L67-F89 CarbonylContact O-C 3.6Å; L67-F89 WeakPolarHBondContact O-CA 3.32Å; L67-K90 PolarHBondContact O-N 2.89Å
68	N	97.5	Very high	97.3	Very high	67 Å²	67	51.1 Å²	51.1	36%	0.358	25%	0.25	S	S	.	.	H	α-helix	trans	-81.4	-40.6	-178.6	-73.1	-21	0	0	0	114	E64 K65 V66 A91	E64-N68 VanDerWaalsContact CG-ND2 3.34Å; E64-N68 WeakPolarHBondContact CG-ND2 3.04Å; E64-N68 PolarHBondContact O-N 3.12Å; E64-N68 PolarHBondContact OE1-ND2 3.25Å; K65-N68 PolarHBondContact O-N 3.43Å; V66-N68 VanDerWaalsContact C-N 3.28Å; V66-N68 PolarHBondContact O-N 3.31Å; N68-A91 WeakPolarHBondContact O-CB 3.45Å
69	E	97.7	Very high	97.4	Very high	100 Å²	100	49.6 Å²	49.6	47%	0.467	24%	0.239	S	C	.	.	H	α-helix	trans	-110.2	-16.7	-168.6	-62.4	179.2	-152.2	0	0	115.8	L29 K65 V71	L29-E69 HydrophobicContact CD2-CB 4.04Å; K65-E69 WeakPolarHBondContact CE-OE1 3.35Å; K65-E69 WeakPolarHBondContact CE-OE2 3.41Å; K65-E69 HydrophobicContact CG-CG 4.27Å; K65-E69 WeakPolarHBondContact CG-OE1 3.27Å; K65-E69 IonicContact NZ-OE2 3.67Å; K65-E69 VanDerWaalsContact O-CB 3.29Å; K65-E69 WeakPolarHBondContact O-CB 3.22Å; K65-E69 PolarHBondContact O-N 2.87Å; E69-V71 PolarHBondContact O-N 2.89Å
70	A	98	Very high	97.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	125.1	-175.1	0	0	0	0	0	111.6	L29 A31 V66 A91 L92	L29-A70 HydrophobicContact CD2-CB 4.25Å; L29-A70 HydrophobicContact CG-CB 4.25Å; A31-A70 HydrophobicContact CB-CB 4.48Å; V66-A70 HydrophobicContact CG1-CB 3.95Å; V66-A70 WeakPolarHBondContact O-CB 3.21Å; V66-A70 PolarHBondContact O-N 3.25Å; A70-A91 CarbonylContact O-C 3.5Å; A70-L92 WeakPolarHBondContact O-CA 3.13Å; A70-L92 PolarHBondContact O-N 3.17Å
71	V	98	Very high	97.7	Very high	28 Å²	28	45.8 Å²	45.8	17%	0.17	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-28.7	178.4	-178.7	0	0	0	0	110.9	I19 P28 L29 E69 R93 I94	I19-V71 HydrophobicContact CD1-CG1 4.15Å; P28-V71 HydrophobicContact CB-CB 4.01Å; P28-V71 HydrophobicContact CB-CG1 4.43Å; P28-V71 HydrophobicContact CB-CG2 3.92Å; L29-V71 PolarHBondContact O-N 2.87Å; E69-V71 PolarHBondContact O-N 2.89Å; V71-R93 HydrophobicContact CG1-CG 4.31Å; V71-R93 PolarHBondContact O-N 2.95Å; V71-I94 PolarHBondContact O-N 3.49Å
72	G	98.6	Very high	97.7	Very high	1 Å²	1	44 Å²	44	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.9	173.1	0	0	0	0	0	112.3	L29 V30 A31 I94	L29-G72 PolarHBondContact O-N 3.28Å; V30-G72 VanDerWaalsContact CA-O 3.3Å; V30-G72 WeakPolarHBondContact CA-O 3.41Å; A31-G72 PolarHBondContact N-O 3.34Å; G72-I94 CarbonylContact C-O 3.52Å; G72-I94 WeakPolarHBondContact CA-O 3.22Å
73	A	98.8	Very high	97.8	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.2	173.3	0	0	0	0	0	111.3	A31 L33 L92 I94 I95 V96	A31-A73 CarbonylContact O-C 3.54Å; A31-A73 WeakPolarHBondContact O-CA 3.49Å; L33-A73 HydrophobicContact CD1-CB 4.19Å; L33-A73 HydrophobicContact CD2-CB 4.29Å; L33-A73 HydrophobicContact CG-CB 4.23Å; A73-L92 HydrophobicContact CB-CD1 3.86Å; A73-I94 PolarHBondContact N-O 3.05Å; A73-I95 HydrophobicContact CB-CG1 4.28Å; A73-I95 CarbonylContact O-C 3.32Å; A73-I95 WeakPolarHBondContact O-CA 3.49Å; A73-V96 PolarHBondContact O-N 3.21Å
74	L	98.8	Very high	97.9	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.6	167.9	-67.5	-179.6	0	0	0	108.1	V30 A31 L32 L33 E41 V96 I98 A331 I335	V30-L74 HydrophobicContact CG1-CG 4.37Å; A31-L74 PolarHBondContact O-N 2.69Å; L32-L74 WeakPolarHBondContact CA-O 3.45Å; L32-L74 HydrophobicContact CB-CB 4.49Å; L32-L74 HydrophobicContact CD1-CB 3.82Å; L33-L74 PolarHBondContact N-O 2.98Å; E41-L74 HydrophobicContact CB-CD1 4.39Å; E41-L74 HydrophobicContact CG-CD1 3.69Å; L74-V96 HydrophobicContact CD2-CB 3.86Å; L74-V96 HydrophobicContact CD2-CG2 4.39Å; L74-I98 HydrophobicContact CB-CD1 4.02Å; L74-A331 HydrophobicContact CD2-CB 3.95Å; L74-I335 HydrophobicContact CD2-CD1 4.04Å; L74-I335 HydrophobicContact CD2-CG1 3.46Å; L74-I335 VanDerWaalsContact CD2-CG1 3.46Å; L74-I335 HydrophobicContact CG-CG1 4.06Å
75	M	98.7	Very high	97.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	147.1	176.9	54.5	-175.9	-78.5	0	0	114	L33 D34 I79 L81 I95 V96 R97 I98 N104 I105	L33-M75 HydrophobicContact CB-CB 4.33Å; L33-M75 HydrophobicContact CD1-CB 4.4Å; L33-M75 HydrophobicContact CD1-SD 4.16Å; L33-M75 HydrophobicContact CG-CB 4.46Å; D34-M75 WeakPolarHBondContact OD1-CA 3.4Å; D34-M75 WeakPolarHBondContact OD1-CB 3.47Å; M75-I79 HydrophobicContact CB-CG2 4.15Å; M75-I79 HydrophobicContact CE-CG2 3.69Å; M75-I79 WeakPolarHBondContact CE-O 3.12Å; M75-I79 HydrophobicContact SD-CG2 4.38Å; M75-L81 HydrophobicContact CE-CD1 4.25Å; M75-L81 HydrophobicContact CE-CG 4.18Å; M75-L81 HydrophobicContact SD-CD1 3.53Å; M75-L81 VanDerWaalsContact SD-CD1 3.53Å; M75-L81 HydrophobicContact SD-CG 4.11Å; M75-I95 HydrophobicContact CG-CG2 3.84Å; M75-I95 HydrophobicContact SD-CG2 3.57Å; M75-I95 VanDerWaalsContact SD-CG2 3.57Å; M75-V96 PolarHBondContact N-O 2.97Å; M75-V96 VanDerWaalsContact N-O 3.14Å; M75-R97 CarbonylContact O-C 3.31Å; M75-R97 WeakPolarHBondContact O-CA 3.35Å; M75-R97 PolarHBondContact O-NH1 2.82Å; M75-I98 PolarHBondContact O-N 2.83Å; M75-N104 WeakPolarHBondContact CE-ND2 3.43Å; M75-I105 HydrophobicContact CE-CD1 3.99Å; M75-I105 HydrophobicContact CE-CG1 3.7Å; M75-I105 HydrophobicContact SD-CD1 3.82Å; M75-I105 HydrophobicContact SD-CG1 4.06Å
76	Y	98.2	Very high	98	Very high	41 Å²	41	38.1 Å²	38.1	16%	0.161	19%	0.194	C	C	.	.			trans	-83.9	-146.4	170.5	-61.6	-79.9	0	0	0	109.9	L32 D34 R97 I98 N104 R328	L32-Y76 HydrophobicContact CD1-CD2 4.29Å; L32-Y76 HydrophobicContact CD1-CE2 3.84Å; L32-Y76 HydrophobicContact CD2-CE2 4.45Å; D34-Y76 VanDerWaalsContact CG-N 3.29Å; D34-Y76 PolarHBondContact OD1-N 2.87Å; D34-Y76 VanDerWaalsContact OD2-CA 3.32Å; D34-Y76 WeakPolarHBondContact OD2-CA 3.42Å; D34-Y76 WeakPolarHBondContact OD2-CB 3.37Å; D34-Y76 PolarHBondContact OD2-N 3.1Å; Y76-R97 VanDerWaalsContact CA-NH1 3.3Å; Y76-R97 WeakPolarHBondContact O-CD 3.16Å; Y76-R97 PolarHBondContact O-NE 3.4Å; Y76-R97 VanDerWaalsContact O-NE 3.1Å; Y76-R97 PolarHBondContact O-NH1 3.23Å; Y76-I98 HydrophobicContact CD1-CB 3.85Å; Y76-I98 HydrophobicContact CD1-CG2 3.91Å; Y76-I98 HydrophobicContact CE1-CB 3.78Å; Y76-I98 HydrophobicContact CE1-CD1 4.02Å; Y76-I98 HydrophobicContact CE1-CG2 3.43Å; Y76-I98 VanDerWaalsContact CE1-CG2 3.43Å; Y76-I98 HydrophobicContact CE2-CD1 4.05Å; Y76-N104 PolarHBondContact O-ND2 3.23Å; Y76-R328 WeakPolarHBondContact OH-CD 3.3Å
77	H	97.4	Very high	98.1	Very high	52 Å²	52	41.9 Å²	41.9	24%	0.241	21%	0.21	C	C	.	.	S	Bend	trans	-103.9	-6.6	-174.8	64.8	-100.5	0	0	0	113.6	H315	H77-H315 AromaticContact CD2-CE1 3.68Å; H77-H315 AromaticContact CD2-ND1 3.51Å; H77-H315 AromaticContact CE1-CG 3.8Å; H77-H315 AromaticContact CE1-ND1 3.79Å; H77-H315 AromaticContact CG-CE1 3.66Å; H77-H315 AromaticContact CG-ND1 3.92Å; H77-H315 AromaticContact ND1-CE1 3.89Å; H77-H315 AromaticContact NE2-CE1 3.97Å; H77-H315 AromaticContact NE2-CG 3.78Å; H77-H315 AromaticContact NE2-ND1 3.45Å; H77-H315 PolarHBondContact NE2-ND1 3.02Å
78	T	97.2	Very high	98.1	Very high	65 Å²	65	43.7 Å²	43.7	40%	0.399	22%	0.217	S	C	.	.	S	Bend	trans	-89.8	-23.1	-167.6	55	0	0	0	0	113.4	D34 Q57	D34-T78 WeakPolarHBondContact CB-OG1 3.42Å; D34-T78 PolarHBondContact OD2-N 2.88Å; D34-T78 PolarHBondContact OD2-OG1 3.41Å; Q57-T78 PolarHBondContact OE1-OG1 2.84Å
79	I	97.4	Very high	98.1	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.2	C	C	.	.	S	Bend	trans	-95.3	142.1	166.2	-163	169.1	0	0	0	111.6	L33 D34 I62 M75 N104	L33-I79 HydrophobicContact CB-CG2 4.27Å; D34-I79 HydrophobicContact CB-CB 3.92Å; D34-I79 HydrophobicContact CB-CG2 3.73Å; D34-I79 PolarHBondContact OD2-N 3.26Å; I62-I79 HydrophobicContact CD1-CD1 3.91Å; I62-I79 HydrophobicContact CG1-CD1 4.45Å; M75-I79 HydrophobicContact CB-CG2 4.15Å; M75-I79 HydrophobicContact CE-CG2 3.69Å; M75-I79 WeakPolarHBondContact CE-O 3.12Å; M75-I79 HydrophobicContact SD-CG2 4.38Å; I79-N104 PolarHBondContact O-ND2 3Å
80	T	97.9	Very high	98.1	Very high	82 Å²	82	41.4 Å²	41.4	50%	0.503	20%	0.202	S	C	.	.			trans	-109.8	138.2	172.4	-64.4	0	0	0	0	110.4	N104	T80-N104 CarbonylContact C-O 3.56Å; T80-N104 WeakPolarHBondContact CA-O 3.37Å
81	L	98.5	Very high	98.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-116.4	99.3	176.3	-64.3	-177.9	0	0	0	110.8	L33 M75 D85 L86 F89 I95 N104 D106	L33-L81 HydrophobicContact CD1-CD1 4.15Å; M75-L81 HydrophobicContact CE-CD1 4.25Å; M75-L81 HydrophobicContact CE-CG 4.18Å; M75-L81 HydrophobicContact SD-CD1 3.53Å; M75-L81 VanDerWaalsContact SD-CD1 3.53Å; M75-L81 HydrophobicContact SD-CG 4.11Å; L81-D85 HydrophobicContact CB-CB 4.46Å; L81-D85 HydrophobicContact CD2-CB 3.99Å; L81-L86 HydrophobicContact CB-CD2 4.15Å; L81-L86 HydrophobicContact CB-CG 4.26Å; L81-L86 HydrophobicContact CD1-CD2 4.18Å; L81-F89 HydrophobicContact CD2-CE2 4.24Å; L81-I95 HydrophobicContact CD1-CD1 3.9Å; L81-N104 PolarHBondContact N-O 2.99Å; L81-D106 PolarHBondContact O-N 3.24Å
82	T	98.2	Very high	98.1	Very high	62 Å²	62	41.4 Å²	41.4	38%	0.38	21%	0.205	S	C	.	.			trans	-75.5	174.3	171.1	73	0	0	0	0	111.3	E84 D85 L86	T82-E84 VanDerWaalsContact C-N 3.3Å; T82-E84 PolarHBondContact O-N 3.44Å; T82-E84 PolarHBondContact OG1-N 3.44Å; T82-D85 VanDerWaalsContact CB-OD2 3.32Å; T82-D85 WeakPolarHBondContact CB-OD2 3.37Å; T82-D85 WeakPolarHBondContact CG2-OD2 3.49Å; T82-D85 PolarHBondContact N-OD2 3.38Å; T82-D85 WeakPolarHBondContact O-CB 3.41Å; T82-D85 PolarHBondContact O-N 3.04Å; T82-D85 VanDerWaalsContact O-N 3.09Å; T82-D85 PolarHBondContact OG1-N 3.43Å; T82-D85 PolarHBondContact OG1-OD2 3.39Å; T82-L86 VanDerWaalsContact O-CG 3.31Å; T82-L86 WeakPolarHBondContact O-CG 3.46Å; T82-L86 PolarHBondContact O-N 2.85Å
83	R	98	Very high	98.1	Very high	95 Å²	95	43.8 Å²	43.8	36%	0.358	21%	0.214	S	C	.	.	H	α-helix	trans	-52.4	-46.9	169.9	-176	170.3	-163.7	113	-1.9	112.9	D85 L86 E87 S109 D112	R83-D85 PolarHBondContact O-N 2.94Å; R83-L86 PolarHBondContact O-N 3.42Å; R83-E87 HydrophobicContact CG-CG 4.39Å; R83-E87 WeakPolarHBondContact CG-OE1 3.38Å; R83-E87 IonicContact CZ-OE1 3.78Å; R83-E87 IonicContact NE-OE1 2.9Å; R83-E87 PolarHBondContact NE-OE1 3.11Å; R83-E87 IonicContact NH2-OE1 3.87Å; R83-E87 WeakPolarHBondContact O-CG 3.32Å; R83-E87 PolarHBondContact O-N 3.05Å; R83-S109 WeakPolarHBondContact CD-OG 3.49Å; R83-S109 PolarHBondContact NH1-OG 2.84Å; R83-D112 IonicContact CZ-OD2 3.58Å; R83-D112 IonicContact NH1-OD2 2.75Å; R83-D112 PolarHBondContact NH1-OD2 2.9Å; R83-D112 IonicContact NH2-OD2 3.46Å; R83-D112 PolarHBondContact NH2-OD2 3.35Å
84	E	98.1	Very high	98.1	Very high	148 Å²	148	43.9 Å²	43.9	69%	0.692	21%	0.214	S	C	*	.	H	α-helix	trans	-62.7	-30.7	179.9	-63	-174.2	-170.4	0	0	111.9	T82 K88	T82-E84 VanDerWaalsContact C-N 3.3Å; T82-E84 PolarHBondContact O-N 3.44Å; T82-E84 PolarHBondContact OG1-N 3.44Å; E84-K88 WeakPolarHBondContact O-CE 3.26Å; E84-K88 WeakPolarHBondContact O-CG 3.43Å
85	D	98.4	Very high	98.1	Very high	15 Å²	15	43.9 Å²	43.9	8%	0.08	21%	0.214	C	C	.	.	H	α-helix	trans	-73.8	-45.2	175.3	-60	-59.8	0	0	0	112.3	T59 L81 T82 R83 E87 K88 F89	T59-D85 WeakPolarHBondContact CB-OD1 3.4Å; T59-D85 HydrophobicContact CG2-CB 3.89Å; T59-D85 WeakPolarHBondContact CG2-OD1 3.21Å; T59-D85 PolarHBondContact OG1-OD1 2.88Å; L81-D85 HydrophobicContact CB-CB 4.46Å; L81-D85 HydrophobicContact CD2-CB 3.99Å; T82-D85 VanDerWaalsContact CB-OD2 3.32Å; T82-D85 WeakPolarHBondContact CB-OD2 3.37Å; T82-D85 WeakPolarHBondContact CG2-OD2 3.49Å; T82-D85 PolarHBondContact N-OD2 3.38Å; T82-D85 WeakPolarHBondContact O-CB 3.41Å; T82-D85 PolarHBondContact O-N 3.04Å; T82-D85 VanDerWaalsContact O-N 3.09Å; T82-D85 PolarHBondContact OG1-N 3.43Å; T82-D85 PolarHBondContact OG1-OD2 3.39Å; R83-D85 PolarHBondContact O-N 2.94Å; D85-E87 VanDerWaalsContact C-N 3.3Å; D85-E87 PolarHBondContact O-N 3.2Å; D85-K88 VanDerWaalsContact O-CB 3.3Å; D85-K88 WeakPolarHBondContact O-CB 3.24Å; D85-K88 PolarHBondContact O-N 2.83Å; D85-K88 VanDerWaalsContact O-N 3.09Å; D85-K88 IonicContact OD1-NZ 3.67Å; D85-K88 PolarHBondContact OD1-NZ 3.44Å; D85-F89 WeakPolarHBondContact O-CD2 3.18Å
86	L	98.4	Very high	98.1	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-37.4	178	-66	163.9	0	0	0	111.7	L81 T82 R83 K88 F89 I95 D106 A110 L113 I115	L81-L86 HydrophobicContact CB-CD2 4.15Å; L81-L86 HydrophobicContact CB-CG 4.26Å; L81-L86 HydrophobicContact CD1-CD2 4.18Å; T82-L86 VanDerWaalsContact O-CG 3.31Å; T82-L86 WeakPolarHBondContact O-CG 3.46Å; T82-L86 PolarHBondContact O-N 2.85Å; R83-L86 PolarHBondContact O-N 3.42Å; L86-K88 PolarHBondContact O-N 3.44Å; L86-F89 PolarHBondContact O-N 2.7Å; L86-F89 VanDerWaalsContact O-N 3.09Å; L86-I95 HydrophobicContact CD2-CD1 3.53Å; L86-D106 HydrophobicContact CD1-CB 4.19Å; L86-D106 WeakPolarHBondContact CD1-O 3.25Å; L86-A110 HydrophobicContact CD1-CB 3.95Å; L86-A110 HydrophobicContact CD2-CB 4.38Å; L86-L113 HydrophobicContact CB-CD1 3.6Å; L86-I115 HydrophobicContact CD2-CD1 4.31Å
87	E	98	Very high	98.1	Very high	92 Å²	92	42.1 Å²	42.1	43%	0.43	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.2	176.1	-72.2	-179.2	-170.5	0	0	113.5	R83 D85 F89 K90 L113	R83-E87 HydrophobicContact CG-CG 4.39Å; R83-E87 WeakPolarHBondContact CG-OE1 3.38Å; R83-E87 IonicContact CZ-OE1 3.78Å; R83-E87 IonicContact NE-OE1 2.9Å; R83-E87 PolarHBondContact NE-OE1 3.11Å; R83-E87 IonicContact NH2-OE1 3.87Å; R83-E87 WeakPolarHBondContact O-CG 3.32Å; R83-E87 PolarHBondContact O-N 3.05Å; D85-E87 VanDerWaalsContact C-N 3.3Å; D85-E87 PolarHBondContact O-N 3.2Å; E87-F89 VanDerWaalsContact C-N 3.34Å; E87-K90 PolarHBondContact O-NZ 3.4Å; E87-L113 HydrophobicContact CG-CD1 3.83Å; E87-L113 HydrophobicContact CG-CD2 3.98Å
88	K	98.2	Very high	98.1	Very high	67 Å²	67	39.9 Å²	39.9	29%	0.291	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-29	171.5	-62.9	159.7	-162.8	163.1	0	111.8	T59 L67 E84 D85 L86 K90	T59-K88 HydrophobicContact CG2-CD 3.78Å; L67-K88 HydrophobicContact CD1-CB 4.42Å; L67-K88 HydrophobicContact CD2-CB 4.17Å; E84-K88 WeakPolarHBondContact O-CE 3.26Å; E84-K88 WeakPolarHBondContact O-CG 3.43Å; D85-K88 VanDerWaalsContact O-CB 3.3Å; D85-K88 WeakPolarHBondContact O-CB 3.24Å; D85-K88 PolarHBondContact O-N 2.83Å; D85-K88 VanDerWaalsContact O-N 3.09Å; D85-K88 IonicContact OD1-NZ 3.67Å; D85-K88 PolarHBondContact OD1-NZ 3.44Å; L86-K88 PolarHBondContact O-N 3.44Å; K88-K90 WeakPolarHBondContact O-CD 3.46Å; K88-K90 WeakPolarHBondContact O-CE 3.19Å; K88-K90 PolarHBondContact O-N 3.02Å
89	F	98.2	Very high	98.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.			trans	-81.2	111.9	-175.8	-71.3	-89.5	0	0	0	113.7	R16 L33 I62 V66 L67 L81 D85 L86 E87 L92	R16-F89 PolarHBondContact NH1-O 2.7Å; R16-F89 PolarHBondContact NH2-O 2.76Å; L33-F89 HydrophobicContact CD1-CZ 4.34Å; I62-F89 HydrophobicContact CD1-CZ 3.93Å; V66-F89 HydrophobicContact CG1-CE1 4.44Å; L67-F89 HydrophobicContact CD2-CD1 4.08Å; L67-F89 HydrophobicContact CD2-CD2 4.26Å; L67-F89 HydrophobicContact CD2-CE1 3.81Å; L67-F89 HydrophobicContact CD2-CE2 3.98Å; L67-F89 HydrophobicContact CD2-CG 4.31Å; L67-F89 HydrophobicContact CD2-CZ 3.77Å; L67-F89 CarbonylContact O-C 3.6Å; L67-F89 WeakPolarHBondContact O-CA 3.32Å; L81-F89 HydrophobicContact CD2-CE2 4.24Å; D85-F89 WeakPolarHBondContact O-CD2 3.18Å; L86-F89 PolarHBondContact O-N 2.7Å; L86-F89 VanDerWaalsContact O-N 3.09Å; E87-F89 VanDerWaalsContact C-N 3.34Å; F89-L92 HydrophobicContact CB-CB 3.67Å; F89-L92 HydrophobicContact CB-CD2 3.88Å; F89-L92 HydrophobicContact CB-CG 4.45Å; F89-L92 HydrophobicContact CD1-CB 4.22Å; F89-L92 HydrophobicContact CD1-CD2 3.79Å; F89-L92 HydrophobicContact CD2-CD2 4.08Å; F89-L92 HydrophobicContact CE1-CD2 4.28Å; F89-L92 HydrophobicContact CG-CB 4.21Å; F89-L92 HydrophobicContact CG-CD2 3.66Å
90	K	97.4	Very high	98.2	Very high	119 Å²	119	40.6 Å²	40.6	52%	0.517	21%	0.207	S	C	.	.	S	Bend	trans	-87.7	-28.3	-171.5	-47.7	-51.5	176.3	-167.5	0	114.3	R16 L67 E87 K88	R16-K90 PolarHBondContact NH1-O 2.87Å; R16-K90 PolarHBondContact NH2-O 2.92Å; L67-K90 PolarHBondContact O-N 2.89Å; E87-K90 PolarHBondContact O-NZ 3.4Å; K88-K90 WeakPolarHBondContact O-CD 3.46Å; K88-K90 WeakPolarHBondContact O-CE 3.19Å; K88-K90 PolarHBondContact O-N 3.02Å
91	A	97.4	Very high	98.1	Very high	28 Å²	28	37.4 Å²	37.4	23%	0.231	19%	0.19	C	C	.	.	S	Bend	trans	-109.7	-15	-179.6	0	0	0	0	0	115.3	N68 A70 R93	N68-A91 WeakPolarHBondContact O-CB 3.45Å; A70-A91 CarbonylContact O-C 3.5Å; A91-R93 WeakPolarHBondContact O-CG 3.47Å
92	L	98.3	Very high	98.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.			trans	-58.9	137.1	-169.5	-170.2	63.8	0	0	0	113.1	R16 A70 A73 F89 I94 I95 I115	R16-L92 VanDerWaalsContact NH1-N 3.18Å; R16-L92 PolarHBondContact NH1-O 3.21Å; A70-L92 WeakPolarHBondContact O-CA 3.13Å; A70-L92 PolarHBondContact O-N 3.17Å; A73-L92 HydrophobicContact CB-CD1 3.86Å; F89-L92 HydrophobicContact CB-CB 3.67Å; F89-L92 HydrophobicContact CB-CD2 3.88Å; F89-L92 HydrophobicContact CB-CG 4.45Å; F89-L92 HydrophobicContact CD1-CB 4.22Å; F89-L92 HydrophobicContact CD1-CD2 3.79Å; F89-L92 HydrophobicContact CD2-CD2 4.08Å; F89-L92 HydrophobicContact CE1-CD2 4.28Å; F89-L92 HydrophobicContact CG-CB 4.21Å; F89-L92 HydrophobicContact CG-CD2 3.66Å; L92-I94 VanDerWaalsContact CD1-O 3.29Å; L92-I94 WeakPolarHBondContact CD1-O 3.31Å; L92-I95 HydrophobicContact CD2-CD1 4.09Å; L92-I95 HydrophobicContact CD2-CG1 3.8Å; L92-I95 HydrophobicContact CG-CG1 4.43Å; L92-I115 HydrophobicContact CD2-CD1 4.32Å; L92-I115 HydrophobicContact CD2-CG2 4.26Å; L92-I115 HydrophobicContact CG-CG2 4.13Å
93	R	97.9	Very high	98	Very high	50 Å²	50	40.3 Å²	40.3	19%	0.189	20%	0.2	C	C	.	.			trans	-129.3	-19.9	178.4	-57.7	-164.3	68.8	-141.5	-2.4	113.9	V71 A91 A116 I343	V71-R93 HydrophobicContact CG1-CG 4.31Å; V71-R93 PolarHBondContact O-N 2.95Å; A91-R93 WeakPolarHBondContact O-CG 3.47Å; R93-A116 PolarHBondContact O-N 3.33Å; R93-I343 HydrophobicContact CB-CD1 3.82Å
94	I	98.7	Very high	98	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	139.7	174.9	-175	169	0	0	0	111.7	V71 G72 A73 L92 V96 A116 E334 I335 A338 I343 L347	V71-I94 PolarHBondContact O-N 3.49Å; G72-I94 CarbonylContact C-O 3.52Å; G72-I94 WeakPolarHBondContact CA-O 3.22Å; A73-I94 PolarHBondContact N-O 3.05Å; L92-I94 VanDerWaalsContact CD1-O 3.29Å; L92-I94 WeakPolarHBondContact CD1-O 3.31Å; I94-V96 HydrophobicContact CD1-CG2 3.7Å; I94-V96 HydrophobicContact CG1-CG2 3.87Å; I94-A116 CarbonylContact C-O 3.49Å; I94-A116 VanDerWaalsContact CA-O 3.27Å; I94-A116 WeakPolarHBondContact CA-O 3.4Å; I94-A116 HydrophobicContact CG1-CB 4.49Å; I94-E334 HydrophobicContact CD1-CG 4.31Å; I94-I335 HydrophobicContact CG2-CD1 3.77Å; I94-A338 HydrophobicContact CB-CB 4.19Å; I94-A338 HydrophobicContact CD1-CB 3.5Å; I94-A338 HydrophobicContact CG1-CB 4.43Å; I94-A338 HydrophobicContact CG2-CB 3.76Å; I94-I343 HydrophobicContact CB-CD1 4.4Å; I94-L347 HydrophobicContact CD1-CD1 3.98Å; I94-L347 HydrophobicContact CD1-CD2 3.83Å
95	I	98.8	Very high	98	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.7	162.2	-58.8	160.5	0	0	0	107.3	A73 M75 L81 L86 L92 I105 I115 A116 V117 C118	A73-I95 HydrophobicContact CB-CG1 4.28Å; A73-I95 CarbonylContact O-C 3.32Å; A73-I95 WeakPolarHBondContact O-CA 3.49Å; M75-I95 HydrophobicContact CG-CG2 3.84Å; M75-I95 HydrophobicContact SD-CG2 3.57Å; M75-I95 VanDerWaalsContact SD-CG2 3.57Å; L81-I95 HydrophobicContact CD1-CD1 3.9Å; L86-I95 HydrophobicContact CD2-CD1 3.53Å; L92-I95 HydrophobicContact CD2-CD1 4.09Å; L92-I95 HydrophobicContact CD2-CG1 3.8Å; L92-I95 HydrophobicContact CG-CG1 4.43Å; I95-I105 HydrophobicContact CD1-CG2 4.37Å; I95-I105 HydrophobicContact CG2-CD1 3.66Å; I95-I115 HydrophobicContact CD1-CG2 3.85Å; I95-I115 HydrophobicContact CG1-CG2 3.91Å; I95-A116 PolarHBondContact N-O 2.8Å; I95-V117 HydrophobicContact CD1-CG2 4.47Å; I95-V117 CarbonylContact O-C 3.6Å; I95-V117 WeakPolarHBondContact O-CA 3.31Å; I95-C118 PolarHBondContact O-N 3.45Å
96	V	98.9	Very high	98	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.2	170.7	-167.7	0	0	0	0	109.7	A73 L74 M75 I94 I98 C118 A331 E334 I335	A73-V96 PolarHBondContact O-N 3.21Å; L74-V96 HydrophobicContact CD2-CB 3.86Å; L74-V96 HydrophobicContact CD2-CG2 4.39Å; M75-V96 PolarHBondContact N-O 2.97Å; M75-V96 VanDerWaalsContact N-O 3.14Å; I94-V96 HydrophobicContact CD1-CG2 3.7Å; I94-V96 HydrophobicContact CG1-CG2 3.87Å; V96-I98 PolarHBondContact O-N 2.95Å; V96-C118 WeakPolarHBondContact CA-O 3.43Å; V96-C118 HydrophobicContact CB-CB 4.38Å; V96-C118 HydrophobicContact CG1-CB 3.97Å; V96-C118 HydrophobicContact CG2-CB 4.11Å; V96-A331 HydrophobicContact CG1-CB 3.85Å; V96-E334 HydrophobicContact CG1-CB 4.17Å; V96-E334 HydrophobicContact CG1-CG 4.37Å; V96-E334 HydrophobicContact CG2-CB 4.08Å; V96-E334 HydrophobicContact CG2-CG 4.05Å; V96-I335 HydrophobicContact CG2-CD1 3.61Å; V96-I335 HydrophobicContact CG2-CG1 3.87Å
97	R	98.7	Very high	98	Very high	5 Å²	5	33.4 Å²	33.4	2%	0.019	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	116.8	168.8	-82.2	-72.3	-63.9	92.2	10.8	109.6	M75 Y76 G99 G101 F102 N104 I105 C118 N119 V120	M75-R97 CarbonylContact O-C 3.31Å; M75-R97 WeakPolarHBondContact O-CA 3.35Å; M75-R97 PolarHBondContact O-NH1 2.82Å; Y76-R97 VanDerWaalsContact CA-NH1 3.3Å; Y76-R97 WeakPolarHBondContact O-CD 3.16Å; Y76-R97 PolarHBondContact O-NE 3.4Å; Y76-R97 VanDerWaalsContact O-NE 3.1Å; Y76-R97 PolarHBondContact O-NH1 3.23Å; R97-G99 PolarHBondContact O-N 2.93Å; R97-G99 VanDerWaalsContact O-N 3.11Å; R97-G101 VanDerWaalsContact CZ-O 3.27Å; R97-G101 PolarHBondContact NE-O 3.23Å; R97-G101 PolarHBondContact NH2-O 2.87Å; R97-F102 HydrophobicContact CG-CB 4.13Å; R97-N104 WeakPolarHBondContact CD-OD1 3.45Å; R97-N104 PolarHBondContact NE-OD1 2.9Å; R97-I105 HydrophobicContact CG-CD1 3.58Å; R97-C118 PolarHBondContact N-O 3.04Å; R97-N119 HydrophobicContact CB-CB 4.31Å; R97-V120 PolarHBondContact O-N 2.61Å
98	I	98.7	Very high	97.9	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.026	18%	0.179	C	C	.	.	S	Bend	trans	-74.4	95.7	167.5	-56.4	167.2	0	0	0	106.6	L32 L74 M75 Y76 V96 M327 R328 A331	L32-I98 HydrophobicContact CD1-CD1 3.8Å; L74-I98 HydrophobicContact CB-CD1 4.02Å; M75-I98 PolarHBondContact O-N 2.83Å; Y76-I98 HydrophobicContact CD1-CB 3.85Å; Y76-I98 HydrophobicContact CD1-CG2 3.91Å; Y76-I98 HydrophobicContact CE1-CB 3.78Å; Y76-I98 HydrophobicContact CE1-CD1 4.02Å; Y76-I98 HydrophobicContact CE1-CG2 3.43Å; Y76-I98 VanDerWaalsContact CE1-CG2 3.43Å; Y76-I98 HydrophobicContact CE2-CD1 4.05Å; V96-I98 PolarHBondContact O-N 2.95Å; I98-M327 HydrophobicContact CG2-CB 4.17Å; I98-M327 HydrophobicContact CG2-CG 3.54Å; I98-M327 HydrophobicContact CG2-SD 3.62Å; I98-R328 HydrophobicContact CG2-CG 4.05Å; I98-A331 HydrophobicContact CG1-CB 3.74Å
99	G	97.7	Very high	97.9	Very high	11 Å²	11	31.9 Å²	31.9	11%	0.113	17%	0.167	C	C	.	.	S	Bend	trans	122.9	-179.8	-170.8	0	0	0	0	0	113.4	R97 V120	R97-G99 PolarHBondContact O-N 2.93Å; R97-G99 VanDerWaalsContact O-N 3.11Å; G99-V120 CarbonylContact C-O 3.58Å; G99-V120 VanDerWaalsContact C-O 3.27Å; G99-V120 PolarHBondContact O-N 2.91Å
100	S	97.4	Very high	97.9	Very high	70 Å²	70	31.9 Å²	31.9	49%	0.49	17%	0.167	S	C	.	.	S	Bend	trans	-90.5	-47.8	-165.7	56.7	0	0	0	0	115.2	N119 V120	S100-N119 PolarHBondContact O-ND2 2.83Å; S100-V120 PolarHBondContact N-O 3.25Å
101	G	96.2	Very high	97.9	Very high	15 Å²	15	26.2 Å²	26.2	16%	0.155	14%	0.143	C	C	.	.			trans	-81.1	133.7	179.7	0	0	0	0	0	112.9	R97 R266	R97-G101 VanDerWaalsContact CZ-O 3.27Å; R97-G101 PolarHBondContact NE-O 3.23Å; R97-G101 PolarHBondContact NH2-O 2.87Å; G101-R266 PolarHBondContact O-NH2 3.36Å
102	F	97.9	Very high	97.8	Very high	67 Å²	67	28.4 Å²	28.4	29%	0.294	15%	0.151	S	C	.	.			trans	-120.7	15.4	-173.1	49.5	-98.7	0	0	0	112.9	R97 N104 I105 I107 N119 V351	R97-F102 HydrophobicContact CG-CB 4.13Å; F102-N104 PolarHBondContact O-N 2.89Å; F102-I105 PolarHBondContact O-N 2.57Å; F102-I105 VanDerWaalsContact O-N 3.13Å; F102-I107 HydrophobicContact CD2-CD1 4.12Å; F102-I107 HydrophobicContact CD2-CG2 3.94Å; F102-I107 HydrophobicContact CE2-CD1 3.84Å; F102-N119 HydrophobicContact CD1-CB 4.27Å; F102-V351 HydrophobicContact CD1-CB 4.41Å; F102-V351 HydrophobicContact CD1-CG1 4.03Å; F102-V351 HydrophobicContact CD1-CG2 4.09Å; F102-V351 HydrophobicContact CD2-CG2 4.12Å; F102-V351 HydrophobicContact CE1-CB 4.19Å; F102-V351 HydrophobicContact CE1-CG1 3.87Å; F102-V351 HydrophobicContact CE1-CG2 4.3Å; F102-V351 HydrophobicContact CE2-CG2 4.34Å; F102-V351 HydrophobicContact CG-CG2 3.99Å; F102-V351 HydrophobicContact CZ-CB 4.32Å; F102-V351 HydrophobicContact CZ-CG1 4.46Å; F102-V351 HydrophobicContact CZ-CG2 4.42Å
103	D	97.5	Very high	97.8	Very high	56 Å²	56	29.9 Å²	29.9	30%	0.299	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.3	178.7	47.2	-63.8	0	0	0	114.1	I105 L239 R266	D103-I105 PolarHBondContact O-N 2.9Å; D103-L239 HydrophobicContact CB-CB 4.05Å; D103-R266 VanDerWaalsContact CG-NE 3.27Å; D103-R266 IonicContact OD1-CZ 3.78Å; D103-R266 IonicContact OD1-NE 3.73Å; D103-R266 PolarHBondContact OD1-NE 3.34Å; D103-R266 IonicContact OD1-NH2 2.86Å; D103-R266 WeakPolarHBondContact OD2-CD 3.47Å; D103-R266 WeakPolarHBondContact OD2-CG 3.41Å; D103-R266 IonicContact OD2-NE 2.63Å; D103-R266 PolarHBondContact OD2-NE 3.42Å
104	N	97.9	Very high	97.7	Very high	12 Å²	12	29 Å²	29	6%	0.064	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	13.6	171.7	63.7	-45.6	0	0	0	114.3	M75 Y76 I79 T80 L81 R97 F102	M75-N104 WeakPolarHBondContact CE-ND2 3.43Å; Y76-N104 PolarHBondContact O-ND2 3.23Å; I79-N104 PolarHBondContact O-ND2 3Å; T80-N104 CarbonylContact C-O 3.56Å; T80-N104 WeakPolarHBondContact CA-O 3.37Å; L81-N104 PolarHBondContact N-O 2.99Å; R97-N104 WeakPolarHBondContact CD-OD1 3.45Å; R97-N104 PolarHBondContact NE-OD1 2.9Å; F102-N104 PolarHBondContact O-N 2.89Å
105	I	98.5	Very high	97.7	Very high	11 Å²	11	28.9 Å²	28.9	6%	0.056	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-135.1	132.6	176.4	-55.4	168.6	0	0	0	109.3	M75 I95 R97 F102 D103 I107 V117	M75-I105 HydrophobicContact CE-CD1 3.99Å; M75-I105 HydrophobicContact CE-CG1 3.7Å; M75-I105 HydrophobicContact SD-CD1 3.82Å; M75-I105 HydrophobicContact SD-CG1 4.06Å; I95-I105 HydrophobicContact CD1-CG2 4.37Å; I95-I105 HydrophobicContact CG2-CD1 3.66Å; R97-I105 HydrophobicContact CG-CD1 3.58Å; F102-I105 PolarHBondContact O-N 2.57Å; F102-I105 VanDerWaalsContact O-N 3.13Å; D103-I105 PolarHBondContact O-N 2.9Å; I105-I107 HydrophobicContact CB-CG2 4.18Å; I105-I107 HydrophobicContact CG2-CG2 4.23Å; I105-I107 WeakPolarHBondContact O-CG2 3.47Å; I105-I107 PolarHBondContact O-N 2.96Å; I105-V117 HydrophobicContact CD1-CG1 3.81Å; I105-V117 HydrophobicContact CG2-CG2 4.07Å
106	D	97.7	Very high	97.7	Very high	56 Å²	56	28.9 Å²	28.9	30%	0.299	17%	0.165	S	C	.	.			trans	-70.7	83.9	164.2	-177.1	-10.5	0	0	0	110	L81 L86 K108 S109 A110	L81-D106 PolarHBondContact O-N 3.24Å; L86-D106 HydrophobicContact CD1-CB 4.19Å; L86-D106 WeakPolarHBondContact CD1-O 3.25Å; D106-K108 PolarHBondContact O-N 3.37Å; D106-K108 PolarHBondContact OD1-N 2.8Å; D106-S109 VanDerWaalsContact CG-CB 3.4Å; D106-S109 VanDerWaalsContact CG-OG 3.23Å; D106-S109 PolarHBondContact O-N 3.02Å; D106-S109 PolarHBondContact OD1-N 2.9Å; D106-S109 PolarHBondContact OD1-OG 3.37Å; D106-S109 WeakPolarHBondContact OD2-CB 3.22Å; D106-S109 PolarHBondContact OD2-OG 2.98Å; D106-A110 WeakPolarHBondContact O-CB 3.49Å; D106-A110 PolarHBondContact O-N 3.05Å
107	I	97.9	Very high	97.7	Very high	34 Å²	34	28.9 Å²	28.9	17%	0.174	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-20.3	-175.9	68.3	167.6	0	0	0	113.5	F102 I105 G111 V117 V351 N352	F102-I107 HydrophobicContact CD2-CD1 4.12Å; F102-I107 HydrophobicContact CD2-CG2 3.94Å; F102-I107 HydrophobicContact CE2-CD1 3.84Å; I105-I107 HydrophobicContact CB-CG2 4.18Å; I105-I107 HydrophobicContact CG2-CG2 4.23Å; I105-I107 WeakPolarHBondContact O-CG2 3.47Å; I105-I107 PolarHBondContact O-N 2.96Å; I107-G111 PolarHBondContact O-N 3.08Å; I107-G111 VanDerWaalsContact O-N 3.15Å; I107-V117 HydrophobicContact CB-CG2 4.45Å; I107-V117 HydrophobicContact CG2-CB 4.17Å; I107-V117 HydrophobicContact CG2-CG1 3.95Å; I107-V117 HydrophobicContact CG2-CG2 4.21Å; I107-V351 HydrophobicContact CD1-CG2 4.44Å; I107-V351 HydrophobicContact CG2-CG2 4.44Å; I107-N352 HydrophobicContact CB-CB 4.08Å; I107-N352 WeakPolarHBondContact O-CB 3.43Å; I107-N352 PolarHBondContact O-ND2 2.7Å
108	K	96.7	Very high	97.7	Very high	121 Å²	121	28.7 Å²	28.7	53%	0.526	16%	0.164	S	C	.	.	H	α-helix	trans	-79	-53.2	178.1	175.6	178.8	175.5	-178.2	0	109.9	D106 A110 G111 D112	D106-K108 PolarHBondContact O-N 3.37Å; D106-K108 PolarHBondContact OD1-N 2.8Å; K108-A110 VanDerWaalsContact C-N 3.26Å; K108-A110 PolarHBondContact O-N 3.21Å; K108-G111 WeakPolarHBondContact O-CA 3.49Å; K108-G111 PolarHBondContact O-N 3.34Å; K108-D112 PolarHBondContact O-N 3.33Å
109	S	97.4	Very high	97.7	Very high	6 Å²	6	29.1 Å²	29.1	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-33	172.9	-63.2	0	0	0	0	112.2	R83 D106 G111 D112 L113	R83-S109 WeakPolarHBondContact CD-OG 3.49Å; R83-S109 PolarHBondContact NH1-OG 2.84Å; D106-S109 VanDerWaalsContact CG-CB 3.4Å; D106-S109 VanDerWaalsContact CG-OG 3.23Å; D106-S109 PolarHBondContact O-N 3.02Å; D106-S109 PolarHBondContact OD1-N 2.9Å; D106-S109 PolarHBondContact OD1-OG 3.37Å; D106-S109 WeakPolarHBondContact OD2-CB 3.22Å; D106-S109 PolarHBondContact OD2-OG 2.98Å; S109-G111 VanDerWaalsContact C-N 3.31Å; S109-G111 PolarHBondContact O-N 2.82Å; S109-D112 PolarHBondContact O-N 2.9Å; S109-L113 WeakPolarHBondContact O-CB 3.49Å; S109-L113 WeakPolarHBondContact O-CD1 3.35Å; S109-L113 WeakPolarHBondContact O-CG 3.23Å; S109-L113 PolarHBondContact O-N 2.86Å
110	A	98.3	Very high	97.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.3	-44	170.1	0	0	0	0	0	111.1	L86 D106 K108 L113 G114 I115 V117	L86-A110 HydrophobicContact CD1-CB 3.95Å; L86-A110 HydrophobicContact CD2-CB 4.38Å; D106-A110 WeakPolarHBondContact O-CB 3.49Å; D106-A110 PolarHBondContact O-N 3.05Å; K108-A110 VanDerWaalsContact C-N 3.26Å; K108-A110 PolarHBondContact O-N 3.21Å; A110-L113 PolarHBondContact O-N 2.88Å; A110-G114 PolarHBondContact O-N 3.01Å; A110-I115 CarbonylContact C-O 3.2Å; A110-I115 HydrophobicContact CB-CB 4.2Å; A110-I115 WeakPolarHBondContact O-CA 3.44Å; A110-I115 WeakPolarHBondContact O-CB 3.15Å; A110-I115 PolarHBondContact O-N 2.82Å; A110-I115 VanDerWaalsContact O-O 3.14Å; A110-V117 HydrophobicContact CB-CG2 3.65Å
111	G	97.8	Very high	97.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.7	-46.4	175.3	0	0	0	0	0	113.5	I107 K108 S109 L113 G114 N352	I107-G111 PolarHBondContact O-N 3.08Å; I107-G111 VanDerWaalsContact O-N 3.15Å; K108-G111 WeakPolarHBondContact O-CA 3.49Å; K108-G111 PolarHBondContact O-N 3.34Å; S109-G111 VanDerWaalsContact C-N 3.31Å; S109-G111 PolarHBondContact O-N 2.82Å; G111-L113 PolarHBondContact O-N 2.89Å; G111-G114 PolarHBondContact O-N 2.98Å; G111-N352 PolarHBondContact N-ND2 3.44Å
112	D	96.1	Very high	97.7	Very high	75 Å²	75	28.3 Å²	28.3	40%	0.401	16%	0.159	S	C	.	.	H	α-helix	trans	-53.6	-38.7	173.6	-67.3	-10.9	0	0	0	111.9	R83 K108 S109 G114	R83-D112 IonicContact CZ-OD2 3.58Å; R83-D112 IonicContact NH1-OD2 2.75Å; R83-D112 PolarHBondContact NH1-OD2 2.9Å; R83-D112 IonicContact NH2-OD2 3.46Å; R83-D112 PolarHBondContact NH2-OD2 3.35Å; K108-D112 PolarHBondContact O-N 3.33Å; S109-D112 PolarHBondContact O-N 2.9Å; D112-G114 VanDerWaalsContact C-N 3.29Å; D112-G114 PolarHBondContact O-N 3.38Å
113	L	96.7	Very high	97	Very high	30 Å²	30	25.4 Å²	25.4	16%	0.157	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.1	-179.3	-65.5	167.5	0	0	0	113.7	L86 E87 S109 A110 G111 I115	L86-L113 HydrophobicContact CB-CD1 3.6Å; E87-L113 HydrophobicContact CG-CD1 3.83Å; E87-L113 HydrophobicContact CG-CD2 3.98Å; S109-L113 WeakPolarHBondContact O-CB 3.49Å; S109-L113 WeakPolarHBondContact O-CD1 3.35Å; S109-L113 WeakPolarHBondContact O-CG 3.23Å; S109-L113 PolarHBondContact O-N 2.86Å; A110-L113 PolarHBondContact O-N 2.88Å; G111-L113 PolarHBondContact O-N 2.89Å; L113-I115 HydrophobicContact CB-CD1 3.95Å; L113-I115 HydrophobicContact CB-CG1 4.13Å; L113-I115 HydrophobicContact CD1-CD1 4.41Å
114	G	96.8	Very high	97	Very high	33 Å²	33	23.5 Å²	23.5	34%	0.34	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	23.4	-178.2	0	0	0	0	0	114.4	A110 G111 D112	A110-G114 PolarHBondContact O-N 3.01Å; G111-G114 PolarHBondContact O-N 2.98Å; D112-G114 VanDerWaalsContact C-N 3.29Å; D112-G114 PolarHBondContact O-N 3.38Å
115	I	98.4	Very high	97	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.144	C	C	.	.			trans	-101.9	114.4	179.7	-52.9	168.5	0	0	0	108.9	L86 L92 I95 A110 L113 N352	L86-I115 HydrophobicContact CD2-CD1 4.31Å; L92-I115 HydrophobicContact CD2-CD1 4.32Å; L92-I115 HydrophobicContact CD2-CG2 4.26Å; L92-I115 HydrophobicContact CG-CG2 4.13Å; I95-I115 HydrophobicContact CD1-CG2 3.85Å; I95-I115 HydrophobicContact CG1-CG2 3.91Å; A110-I115 CarbonylContact C-O 3.2Å; A110-I115 HydrophobicContact CB-CB 4.2Å; A110-I115 WeakPolarHBondContact O-CA 3.44Å; A110-I115 WeakPolarHBondContact O-CB 3.15Å; A110-I115 PolarHBondContact O-N 2.82Å; A110-I115 VanDerWaalsContact O-O 3.14Å; L113-I115 HydrophobicContact CB-CD1 3.95Å; L113-I115 HydrophobicContact CB-CG1 4.13Å; L113-I115 HydrophobicContact CD1-CD1 4.41Å; I115-N352 PolarHBondContact O-ND2 3.14Å
116	A	98.6	Very high	97	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	139.1	172.8	0	0	0	0	0	110.9	R93 I94 I95 I343 L347 L356	R93-A116 PolarHBondContact O-N 3.33Å; I94-A116 CarbonylContact C-O 3.49Å; I94-A116 VanDerWaalsContact CA-O 3.27Å; I94-A116 WeakPolarHBondContact CA-O 3.4Å; I94-A116 HydrophobicContact CG1-CB 4.49Å; I95-A116 PolarHBondContact N-O 2.8Å; A116-I343 HydrophobicContact CB-CG2 3.59Å; A116-L347 HydrophobicContact CB-CD1 3.56Å; A116-L356 HydrophobicContact CB-CD1 3.84Å
117	V	98.8	Very high	97.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.1	172.8	-176.4	0	0	0	0	108.8	I95 I105 I107 A110 C350 V351 N352	I95-V117 HydrophobicContact CD1-CG2 4.47Å; I95-V117 CarbonylContact O-C 3.6Å; I95-V117 WeakPolarHBondContact O-CA 3.31Å; I105-V117 HydrophobicContact CD1-CG1 3.81Å; I105-V117 HydrophobicContact CG2-CG2 4.07Å; I107-V117 HydrophobicContact CB-CG2 4.45Å; I107-V117 HydrophobicContact CG2-CB 4.17Å; I107-V117 HydrophobicContact CG2-CG1 3.95Å; I107-V117 HydrophobicContact CG2-CG2 4.21Å; A110-V117 HydrophobicContact CB-CG2 3.65Å; V117-C350 CarbonylContact O-C 3.56Å; V117-C350 VanDerWaalsContact O-CA 3.31Å; V117-C350 WeakPolarHBondContact O-CA 3.4Å; V117-V351 HydrophobicContact CB-CG2 4.21Å; V117-V351 HydrophobicContact CG1-CG2 4.07Å; V117-V351 WeakPolarHBondContact O-CG2 3.3Å; V117-V351 PolarHBondContact O-N 2.83Å; V117-N352 PolarHBondContact N-OD1 2.94Å
118	C	98.8	Very high	97.1	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	160.4	174.5	-66.4	0	0	0	0	111.6	I95 V96 R97 E334 N349 C350	I95-C118 PolarHBondContact O-N 3.45Å; V96-C118 WeakPolarHBondContact CA-O 3.43Å; V96-C118 HydrophobicContact CB-CB 4.38Å; V96-C118 HydrophobicContact CG1-CB 3.97Å; V96-C118 HydrophobicContact CG2-CB 4.11Å; R97-C118 PolarHBondContact N-O 3.04Å; C118-E334 HydrophobicContact CB-CG 3.73Å; C118-N349 VanDerWaalsContact CA-O 3.22Å; C118-N349 WeakPolarHBondContact CA-O 3.14Å; C118-C350 WeakPolarHBondContact SG-CA 3.39Å; C118-C350 VanDerWaalsContact SG-CB 3.59Å
119	N	98.5	Very high	97.2	Very high	15 Å²	15	22.3 Å²	22.3	8%	0.08	14%	0.135	C	C	.	.			trans	-128.9	175	170.4	70.6	-8.4	0	0	0	111.9	R97 S100 F102 P121 N349 V351	R97-N119 HydrophobicContact CB-CB 4.31Å; S100-N119 PolarHBondContact O-ND2 2.83Å; F102-N119 HydrophobicContact CD1-CB 4.27Å; N119-P121 WeakPolarHBondContact O-CD 3.48Å; N119-N349 PolarHBondContact N-O 3.36Å; N119-N349 WeakPolarHBondContact O-CB 3.36Å; N119-N349 PolarHBondContact O-ND2 3.22Å; N119-V351 HydrophobicContact CB-CG1 4.47Å
120	V	98.5	Very high	97.3	Very high	6 Å²	6	25.9 Å²	25.9	4%	0.036	15%	0.154	C	C	.	.			trans	-113.4	94.7	167.2	-174.5	0	0	0	0	108.9	R97 G99 S100 A122 A123 M327 E330 A331	R97-V120 PolarHBondContact O-N 2.61Å; G99-V120 CarbonylContact C-O 3.58Å; G99-V120 VanDerWaalsContact C-O 3.27Å; G99-V120 PolarHBondContact O-N 2.91Å; S100-V120 PolarHBondContact N-O 3.25Å; V120-A122 PolarHBondContact O-N 2.64Å; V120-A123 HydrophobicContact CG1-CB 3.82Å; V120-M327 HydrophobicContact CB-CB 4.46Å; V120-M327 HydrophobicContact CG1-CB 4.18Å; V120-E330 HydrophobicContact CG1-CB 4.02Å; V120-E330 HydrophobicContact CG1-CG 4.09Å; V120-E330 HydrophobicContact CG2-CB 4.29Å; V120-E330 HydrophobicContact CG2-CG 4.36Å; V120-A331 HydrophobicContact CG2-CB 4.02Å
121	P	97.1	Very high	97.3	Very high	17 Å²	17	27.7 Å²	27.7	11%	0.11	17%	0.166	C	C	.	.			trans	-87.6	0.7	-164.3	33.9	-37.2	0	0	0	115.3	N119 R184 N349	N119-P121 WeakPolarHBondContact O-CD 3.48Å; P121-R184 WeakPolarHBondContact O-CD 3.39Å; P121-N349 WeakPolarHBondContact CD-ND2 3.48Å
122	A	95.2	Very high	97.4	Very high	56 Å²	56	27.7 Å²	27.7	46%	0.463	17%	0.166	S	C	.	.	S	Bend	trans	-119.7	-36.5	-170	0	0	0	0	0	115.1	V120 S124 V125	V120-A122 PolarHBondContact O-N 2.64Å; A122-S124 PolarHBondContact O-N 3.39Å; A122-V125 WeakPolarHBondContact O-CG2 3.12Å; A122-V125 PolarHBondContact O-N 3.44Å; A122-V125 VanDerWaalsContact O-N 3.15Å
123	A	83.4	Confident	97.5	Very high	6 Å²	6	24.5 Å²	24.5	5%	0.05	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	13.3	-161.9	0	0	0	0	0	117.2	V120 A323 E326 M327	V120-A123 HydrophobicContact CG1-CB 3.82Å; A123-A323 VanDerWaalsContact O-CA 3.32Å; A123-A323 WeakPolarHBondContact O-CA 3.32Å; A123-A323 WeakPolarHBondContact O-CB 3.3Å; A123-E326 HydrophobicContact CB-CB 4.04Å; A123-E326 HydrophobicContact CB-CG 3.95Å; A123-E326 WeakPolarHBondContact CB-OE1 3.38Å; A123-M327 HydrophobicContact CB-CB 3.76Å
124	S	97.4	Very high	97.6	Very high	16 Å²	16	26.3 Å²	26.3	11%	0.112	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-154.9	20.4	174.2	-39	0	0	0	0	112.6	A122 E126 E127 T128 W318 M327	A122-S124 PolarHBondContact O-N 3.39Å; S124-E126 VanDerWaalsContact C-N 3.29Å; S124-E126 PolarHBondContact O-N 3.41Å; S124-E127 WeakPolarHBondContact CA-OE2 3.12Å; S124-T128 WeakPolarHBondContact O-CB 3.2Å; S124-T128 PolarHBondContact O-N 2.79Å; S124-T128 PolarHBondContact O-OG1 3.43Å; S124-W318 WeakPolarHBondContact CB-O 3.46Å; S124-W318 PolarHBondContact OG-O 3.24Å; S124-M327 WeakPolarHBondContact OG-CE 3.17Å
125	V	98.7	Very high	97.7	Very high	28 Å²	28	25.2 Å²	25.2	17%	0.17	15%	0.149	C	C	.	.	H	α-helix	trans	-64.2	-37	-174.9	166	0	0	0	0	111.4	A122 A129 R184 A188	A122-V125 WeakPolarHBondContact O-CG2 3.12Å; A122-V125 PolarHBondContact O-N 3.44Å; A122-V125 VanDerWaalsContact O-N 3.15Å; V125-A129 WeakPolarHBondContact O-CB 3.48Å; V125-A129 PolarHBondContact O-N 3.24Å; V125-R184 HydrophobicContact CB-CB 4.48Å; V125-R184 HydrophobicContact CG1-CB 3.87Å; V125-R184 HydrophobicContact CG2-CB 3.68Å; V125-R184 HydrophobicContact CG2-CG 4.47Å; V125-A188 HydrophobicContact CG1-CB 4.2Å
126	E	98.7	Very high	97.7	Very high	109 Å²	109	25.2 Å²	25.2	51%	0.509	15%	0.149	S	C	.	.	H	α-helix	trans	-81.5	-45.2	-178.3	-60.1	-125.6	73.5	0	0	110.9	S124 T128 A129 D130 R192	S124-E126 VanDerWaalsContact C-N 3.29Å; S124-E126 PolarHBondContact O-N 3.41Å; E126-T128 VanDerWaalsContact C-N 3.3Å; E126-T128 PolarHBondContact O-N 3.11Å; E126-A129 CarbonylContact O-C 3.58Å; E126-A129 WeakPolarHBondContact O-CA 3.28Å; E126-A129 WeakPolarHBondContact O-CB 3.42Å; E126-A129 PolarHBondContact O-N 3.29Å; E126-D130 PolarHBondContact O-N 3.22Å; E126-R192 IonicContact OE1-CZ 2.77Å; E126-R192 IonicContact OE1-NH1 2.71Å; E126-R192 PolarHBondContact OE1-NH1 3.35Å; E126-R192 IonicContact OE1-NH2 3.56Å; E126-R192 PolarHBondContact OE1-NH2 3.28Å
127	E	98.8	Very high	97.8	Very high	53 Å²	53	27.3 Å²	27.3	25%	0.248	16%	0.16	C	C	.	.	H	α-helix	trans	-52.4	-46.6	172.2	-74.2	78.8	178.1	0	0	112.2	S124 A129 D130 S131 A317 S320 A323	S124-E127 WeakPolarHBondContact CA-OE2 3.12Å; E127-A129 VanDerWaalsContact C-N 3.31Å; E127-A129 PolarHBondContact O-N 3.43Å; E127-D130 PolarHBondContact O-N 2.72Å; E127-S131 VanDerWaalsContact O-CB 3.23Å; E127-S131 WeakPolarHBondContact O-CB 3.39Å; E127-S131 PolarHBondContact O-N 2.71Å; E127-S131 PolarHBondContact O-OG 2.63Å; E127-A317 CarbonylContact C-O 3.53Å; E127-A317 VanDerWaalsContact O-O 3.08Å; E127-S320 WeakPolarHBondContact OE1-CB 3.45Å; E127-S320 PolarHBondContact OE1-OG 3.36Å; E127-A323 HydrophobicContact CG-CB 4.28Å
128	T	98.8	Very high	97.8	Very high	18 Å²	18	28.5 Å²	28.5	11%	0.11	17%	0.167	C	C	.	.	H	α-helix	trans	-66.1	-37.1	179.3	-48.1	0	0	0	0	110.8	S124 E126 T132 V185 A317	S124-T128 WeakPolarHBondContact O-CB 3.2Å; S124-T128 PolarHBondContact O-N 2.79Å; S124-T128 PolarHBondContact O-OG1 3.43Å; E126-T128 VanDerWaalsContact C-N 3.3Å; E126-T128 PolarHBondContact O-N 3.11Å; T128-T132 WeakPolarHBondContact O-CB 3.45Å; T128-T132 PolarHBondContact O-N 3.09Å; T128-T132 PolarHBondContact O-OG1 3.31Å; T128-V185 HydrophobicContact CG2-CG1 3.81Å; T128-V185 HydrophobicContact CG2-CG2 4.16Å; T128-A317 WeakPolarHBondContact CA-O 3.45Å; T128-A317 HydrophobicContact CG2-CB 4.27Å; T128-A317 PolarHBondContact N-O 2.7Å; T128-A317 VanDerWaalsContact N-O 3.13Å
129	A	98.9	Very high	97.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-71.6	-40.5	178	0	0	0	0	0	112.5	V125 E126 E127 T132 L133 V185 A188 V189	V125-A129 WeakPolarHBondContact O-CB 3.48Å; V125-A129 PolarHBondContact O-N 3.24Å; E126-A129 CarbonylContact O-C 3.58Å; E126-A129 WeakPolarHBondContact O-CA 3.28Å; E126-A129 WeakPolarHBondContact O-CB 3.42Å; E126-A129 PolarHBondContact O-N 3.29Å; E127-A129 VanDerWaalsContact C-N 3.31Å; E127-A129 PolarHBondContact O-N 3.43Å; A129-T132 WeakPolarHBondContact O-CB 3.48Å; A129-T132 PolarHBondContact O-N 3.26Å; A129-L133 WeakPolarHBondContact O-CD2 3.39Å; A129-L133 PolarHBondContact O-N 2.86Å; A129-V185 HydrophobicContact CB-CG1 4.48Å; A129-A188 HydrophobicContact CB-CB 3.58Å; A129-V189 HydrophobicContact CB-CG2 3.7Å
130	D	98.9	Very high	97.8	Very high	82 Å²	82	27.8 Å²	27.8	44%	0.439	16%	0.163	S	C	.	.	H	α-helix	trans	-68.4	-39.1	175.9	-75.5	-44.7	0	0	0	111.4	E126 E127 L133 C134 R192	E126-D130 PolarHBondContact O-N 3.22Å; E127-D130 PolarHBondContact O-N 2.72Å; D130-L133 PolarHBondContact O-N 2.95Å; D130-C134 WeakPolarHBondContact O-CB 3.36Å; D130-C134 PolarHBondContact O-N 2.82Å; D130-R192 IonicContact OD1-CZ 3.49Å; D130-R192 IonicContact OD1-NE 2.97Å; D130-R192 PolarHBondContact OD1-NE 3.14Å; D130-R192 IonicContact OD1-NH2 2.9Å; D130-R192 PolarHBondContact OD1-NH2 3.4Å; D130-R192 IonicContact OD2-CZ 2.82Å; D130-R192 IonicContact OD2-NE 2.76Å; D130-R192 IonicContact OD2-NH2 3.46Å; D130-R192 PolarHBondContact OD2-NH2 2.77Å
131	S	98.9	Very high	97.8	Very high	38 Å²	38	33.4 Å²	33.4	27%	0.266	18%	0.184	S	C	.	.	H	α-helix	trans	-64.2	-39.9	171.4	-61.3	0	0	0	0	112.1	E127 C134 H135 A317	E127-S131 VanDerWaalsContact O-CB 3.23Å; E127-S131 WeakPolarHBondContact O-CB 3.39Å; E127-S131 PolarHBondContact O-N 2.71Å; E127-S131 PolarHBondContact O-OG 2.63Å; S131-C134 WeakPolarHBondContact O-CB 3.49Å; S131-C134 PolarHBondContact O-N 3.2Å; S131-H135 PolarHBondContact O-N 2.79Å; S131-A317 PolarHBondContact OG-O 2.77Å
132	T	98.9	Very high	97.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-47.7	172.4	-57.1	0	0	0	0	111.1	T128 A129 C134 H135 I136 V189 T234 H236 V262 T264	T128-T132 WeakPolarHBondContact O-CB 3.45Å; T128-T132 PolarHBondContact O-N 3.09Å; T128-T132 PolarHBondContact O-OG1 3.31Å; A129-T132 WeakPolarHBondContact O-CB 3.48Å; A129-T132 PolarHBondContact O-N 3.26Å; T132-C134 VanDerWaalsContact C-N 3.3Å; T132-C134 PolarHBondContact O-N 3.24Å; T132-H135 PolarHBondContact O-N 3.42Å; T132-I136 HydrophobicContact CG2-CD1 3.9Å; T132-I136 HydrophobicContact CG2-CG1 4.41Å; T132-I136 WeakPolarHBondContact O-CG1 3.01Å; T132-I136 PolarHBondContact O-N 3.49Å; T132-V189 HydrophobicContact CG2-CG1 4.22Å; T132-V189 HydrophobicContact CG2-CG2 3.9Å; T132-T234 WeakPolarHBondContact CG2-OG1 3.32Å; T132-H236 VanDerWaalsContact CG2-CE1 3.46Å; T132-H236 WeakPolarHBondContact CG2-CE1 3.37Å; T132-H236 PolarHBondContact OG1-CE1 2.75Å; T132-V262 HydrophobicContact CG2-CG1 4.15Å; T132-T264 PolarHBondContact OG1-OG1 3.47Å; T132-T264 VanDerWaalsContact OG1-OG1 3.07Å
133	L	98.9	Very high	98	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-37.7	177.6	-96.2	-63.3	0	0	0	111.3	A129 D130 I136 L137 V189 R192 F196	A129-L133 WeakPolarHBondContact O-CD2 3.39Å; A129-L133 PolarHBondContact O-N 2.86Å; D130-L133 PolarHBondContact O-N 2.95Å; L133-I136 PolarHBondContact O-N 3.29Å; L133-L137 VanDerWaalsContact O-CB 3.3Å; L133-L137 WeakPolarHBondContact O-CB 3.47Å; L133-L137 WeakPolarHBondContact O-CG 3.17Å; L133-L137 PolarHBondContact O-N 2.84Å; L133-V189 HydrophobicContact CD2-CB 4.16Å; L133-V189 HydrophobicContact CD2-CG1 3.84Å; L133-V189 HydrophobicContact CD2-CG2 4.1Å; L133-R192 HydrophobicContact CD2-CB 3.86Å; L133-R192 HydrophobicContact CG-CB 3.88Å; L133-F196 HydrophobicContact CD1-CD2 4.22Å; L133-F196 HydrophobicContact CD1-CE2 4.1Å
134	C	98.9	Very high	98.8	Very high	68 Å²	68	36 Å²	36	46%	0.459	19%	0.194	S	C	.	.	H	α-helix	trans	-58.7	-47.4	172.2	-170.1	0	0	0	0	111.3	D130 S131 T132 L137 N138	D130-C134 WeakPolarHBondContact O-CB 3.36Å; D130-C134 PolarHBondContact O-N 2.82Å; S131-C134 WeakPolarHBondContact O-CB 3.49Å; S131-C134 PolarHBondContact O-N 3.2Å; T132-C134 VanDerWaalsContact C-N 3.3Å; T132-C134 PolarHBondContact O-N 3.24Å; C134-L137 PolarHBondContact O-N 2.81Å; C134-N138 VanDerWaalsContact O-CB 3.32Å; C134-N138 WeakPolarHBondContact O-CB 3.46Å; C134-N138 VanDerWaalsContact O-CG 3.29Å; C134-N138 PolarHBondContact O-N 3.19Å; C134-N138 PolarHBondContact O-ND2 3.03Å; C134-N138 PolarHBondContact SG-ND2 3.47Å; C134-N138 VanDerWaalsContact SG-ND2 3.44Å
135	H	98.9	Very high	98.8	Very high	10 Å²	10	37 Å²	37	5%	0.046	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-48.5	175.3	-82.6	-40.5	0	0	0	112.9	S131 T132 L137 N138 L139 V262 A288 T313	S131-H135 PolarHBondContact O-N 2.79Å; T132-H135 PolarHBondContact O-N 3.42Å; H135-L137 PolarHBondContact O-N 3.48Å; H135-N138 PolarHBondContact O-N 3.31Å; H135-L139 WeakPolarHBondContact O-CG 3.47Å; H135-L139 PolarHBondContact O-N 2.83Å; H135-V262 HydrophobicContact CB-CG1 3.97Å; H135-A288 HydrophobicContact CB-CB 3.72Å; H135-T313 PolarHBondContact CE1-OG1 2.92Å; H135-T313 PolarHBondContact NE2-OG1 3.46Å
136	I	98.9	Very high	98.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.5	-50.4	174.9	-66.9	168.3	0	0	0	110.2	T132 L133 N138 L139 Y140 L177 F198 V262	T132-I136 HydrophobicContact CG2-CD1 3.9Å; T132-I136 HydrophobicContact CG2-CG1 4.41Å; T132-I136 WeakPolarHBondContact O-CG1 3.01Å; T132-I136 PolarHBondContact O-N 3.49Å; L133-I136 PolarHBondContact O-N 3.29Å; I136-N138 VanDerWaalsContact C-N 3.33Å; I136-N138 PolarHBondContact O-N 3.45Å; I136-L139 PolarHBondContact O-N 2.88Å; I136-Y140 HydrophobicContact CG2-CD2 3.8Å; I136-Y140 HydrophobicContact CG2-CE2 4.05Å; I136-Y140 WeakPolarHBondContact O-CD2 3.31Å; I136-Y140 PolarHBondContact O-N 2.75Å; I136-L177 HydrophobicContact CD1-CD1 3.86Å; I136-L177 HydrophobicContact CD1-CD2 4.12Å; I136-F198 HydrophobicContact CG2-CE2 3.85Å; I136-F198 HydrophobicContact CG2-CZ 3.58Å; I136-V262 HydrophobicContact CG1-CG2 3.85Å
137	L	98.9	Very high	98.8	Very high	44 Å²	44	37.7 Å²	37.7	23%	0.23	20%	0.197	C	C	.	.	H	α-helix	trans	-64.8	-35.6	-179.6	-68.3	172.6	0	0	0	112.2	L133 C134 H135 Y140 R141 I172 F196	L133-L137 VanDerWaalsContact O-CB 3.3Å; L133-L137 WeakPolarHBondContact O-CB 3.47Å; L133-L137 WeakPolarHBondContact O-CG 3.17Å; L133-L137 PolarHBondContact O-N 2.84Å; C134-L137 PolarHBondContact O-N 2.81Å; H135-L137 PolarHBondContact O-N 3.48Å; L137-Y140 PolarHBondContact O-N 3.48Å; L137-R141 WeakPolarHBondContact O-CB 3.24Å; L137-R141 WeakPolarHBondContact O-CG 3.35Å; L137-R141 PolarHBondContact O-N 3.22Å; L137-I172 HydrophobicContact CD2-CD1 3.49Å; L137-I172 VanDerWaalsContact CD2-CD1 3.49Å; L137-F196 HydrophobicContact CD1-CE1 3.87Å; L137-F196 HydrophobicContact CD1-CE2 4.48Å; L137-F196 HydrophobicContact CD1-CZ 3.76Å; L137-F196 HydrophobicContact CD2-CD1 3.89Å; L137-F196 HydrophobicContact CD2-CE1 3.83Å; L137-F196 HydrophobicContact CD2-CG 4.48Å; L137-F196 HydrophobicContact CD2-CZ 4.37Å; L137-F196 HydrophobicContact CG-CE1 4.49Å
138	N	98.9	Very high	98.8	Very high	25 Å²	25	39.3 Å²	39.3	13%	0.134	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-39.6	174.5	-81.2	-41.8	0	0	0	112.3	C134 H135 I136 R142 T144 I311	C134-N138 VanDerWaalsContact O-CB 3.32Å; C134-N138 WeakPolarHBondContact O-CB 3.46Å; C134-N138 VanDerWaalsContact O-CG 3.29Å; C134-N138 PolarHBondContact O-N 3.19Å; C134-N138 PolarHBondContact O-ND2 3.03Å; C134-N138 PolarHBondContact SG-ND2 3.47Å; C134-N138 VanDerWaalsContact SG-ND2 3.44Å; H135-N138 PolarHBondContact O-N 3.31Å; I136-N138 VanDerWaalsContact C-N 3.33Å; I136-N138 PolarHBondContact O-N 3.45Å; N138-R142 WeakPolarHBondContact O-CA 3.12Å; N138-R142 PolarHBondContact O-N 2.86Å; N138-T144 PolarHBondContact ND2-OG1 2.88Å; N138-T144 PolarHBondContact OD1-OG1 2.83Å; N138-I311 HydrophobicContact CB-CD1 3.77Å
139	L	98.9	Very high	98.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-50.4	172.8	-66.8	-179.3	0	0	0	111.5	H135 I136 R141 W145 F260 V262 A288 I311	H135-L139 WeakPolarHBondContact O-CG 3.47Å; H135-L139 PolarHBondContact O-N 2.83Å; I136-L139 PolarHBondContact O-N 2.88Å; L139-R141 PolarHBondContact O-N 3.37Å; L139-W145 HydrophobicContact CD2-CH2 3.47Å; L139-W145 VanDerWaalsContact CD2-CH2 3.47Å; L139-W145 HydrophobicContact CD2-CZ2 4Å; L139-W145 HydrophobicContact CD2-CZ3 4.32Å; L139-F260 HydrophobicContact CB-CD1 3.73Å; L139-F260 HydrophobicContact CB-CD2 4.34Å; L139-F260 HydrophobicContact CB-CE1 3.72Å; L139-F260 HydrophobicContact CB-CE2 4.32Å; L139-F260 HydrophobicContact CB-CG 4.04Å; L139-F260 HydrophobicContact CB-CZ 4Å; L139-F260 HydrophobicContact CD1-CB 3.93Å; L139-F260 HydrophobicContact CD1-CD1 3.91Å; L139-F260 HydrophobicContact CD1-CG 4.1Å; L139-F260 HydrophobicContact CD2-CD1 4.29Å; L139-F260 HydrophobicContact CD2-CE1 4.41Å; L139-F260 HydrophobicContact CG-CD1 4.19Å; L139-F260 HydrophobicContact CG-CE1 4.48Å; L139-F260 VanDerWaalsContact O-CZ 3.27Å; L139-F260 WeakPolarHBondContact O-CZ 3.37Å; L139-V262 HydrophobicContact CD1-CG2 3.75Å; L139-A288 HydrophobicContact CD1-CB 3.89Å; L139-A288 HydrophobicContact CD2-CB 4.2Å; L139-A288 HydrophobicContact CG-CB 4.03Å; L139-I311 HydrophobicContact CD2-CD1 4.11Å
140	Y	98.9	Very high	98.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-32.2	-177.8	-89.2	-84.4	0	0	0	114.5	I136 L137 A169 A170 I172 E175 F198 C232 F260	I136-Y140 HydrophobicContact CG2-CD2 3.8Å; I136-Y140 HydrophobicContact CG2-CE2 4.05Å; I136-Y140 WeakPolarHBondContact O-CD2 3.31Å; I136-Y140 PolarHBondContact O-N 2.75Å; L137-Y140 PolarHBondContact O-N 3.48Å; Y140-A169 CarbonylContact O-C 3.59Å; Y140-A169 WeakPolarHBondContact O-CA 3.32Å; Y140-A170 HydrophobicContact CD1-CB 3.88Å; Y140-A170 HydrophobicContact CE1-CB 4.2Å; Y140-A170 PolarHBondContact O-N 3.24Å; Y140-I172 HydrophobicContact CD1-CG1 3.69Å; Y140-I172 HydrophobicContact CD2-CG1 4.46Å; Y140-I172 HydrophobicContact CE1-CG1 4.42Å; Y140-I172 HydrophobicContact CG-CD1 4.42Å; Y140-I172 HydrophobicContact CG-CG1 3.74Å; Y140-E175 HydrophobicContact CE1-CB 4.22Å; Y140-E175 HydrophobicContact CE1-CG 3.74Å; Y140-E175 WeakPolarHBondContact CE1-OE2 3.48Å; Y140-E175 PolarHBondContact OH-OE2 3.3Å; Y140-F198 HydrophobicContact CD2-CZ 4.02Å; Y140-F198 AromaticContact CE2-CE1 3.78Å; Y140-F198 HydrophobicContact CE2-CE1 3.78Å; Y140-F198 AromaticContact CE2-CZ 3.64Å; Y140-F198 HydrophobicContact CE2-CZ 3.64Å; Y140-F198 AromaticContact CZ-CE1 3.78Å; Y140-C232 HydrophobicContact CE2-CB 3.84Å; Y140-F260 HydrophobicContact CD1-CE2 4.05Å; Y140-F260 AromaticContact CD2-CD2 3.98Å; Y140-F260 HydrophobicContact CD2-CD2 3.98Å; Y140-F260 AromaticContact CD2-CE2 3.99Å; Y140-F260 HydrophobicContact CD2-CE2 3.99Å; Y140-F260 HydrophobicContact CE1-CD2 4.26Å; Y140-F260 HydrophobicContact CE1-CE2 4.03Å; Y140-F260 AromaticContact CE2-CD2 3.63Å; Y140-F260 HydrophobicContact CE2-CD2 3.63Å; Y140-F260 HydrophobicContact CE2-CE2 4.02Å; Y140-F260 HydrophobicContact CG-CD2 4.44Å; Y140-F260 HydrophobicContact CG-CE2 4.01Å; Y140-F260 AromaticContact CZ-CD2 3.78Å
141	R	98.8	Very high	98.7	Very high	125 Å²	125	49.8 Å²	49.8	47%	0.472	25%	0.247	S	C	.	.	H	α-helix	trans	-109.9	-4.7	-174.6	-52.5	-51.5	-54.5	135.9	9.6	113.8	L137 L139 A143 A170	L137-R141 WeakPolarHBondContact O-CB 3.24Å; L137-R141 WeakPolarHBondContact O-CG 3.35Å; L137-R141 PolarHBondContact O-N 3.22Å; L139-R141 PolarHBondContact O-N 3.37Å; R141-A143 PolarHBondContact O-N 3Å; R141-A170 PolarHBondContact NH1-O 2.81Å
142	R	98.6	Very high	98.6	Very high	35 Å²	35	54.2 Å²	54.2	13%	0.132	26%	0.263	C	S	.	.			trans	57.5	19.6	-179.3	-56.2	-167	71.9	88.7	-4.3	115.2	N138 T144 W145 L146 S167 A169 N309	N138-R142 WeakPolarHBondContact O-CA 3.12Å; N138-R142 PolarHBondContact O-N 2.86Å; R142-T144 PolarHBondContact O-N 3.46Å; R142-W145 HydrophobicContact CB-CE3 3.82Å; R142-W145 HydrophobicContact CB-CZ3 4.46Å; R142-W145 HydrophobicContact CG-CE3 3.77Å; R142-W145 HydrophobicContact CG-CZ3 3.97Å; R142-W145 VanDerWaalsContact NH1-CZ3 3.28Å; R142-W145 PolarHBondContact O-N 3.07Å; R142-W145 VanDerWaalsContact O-N 3.12Å; R142-L146 HydrophobicContact CB-CD1 4.42Å; R142-L146 HydrophobicContact CB-CG 4.36Å; R142-L146 WeakPolarHBondContact O-CG 3.46Å; R142-L146 PolarHBondContact O-N 3.13Å; R142-S167 WeakPolarHBondContact CD-O 3.38Å; R142-S167 PolarHBondContact NE-O 2.56Å; R142-A169 HydrophobicContact CG-CB 4.04Å; R142-N309 PolarHBondContact NH1-OD1 2.99Å; R142-N309 PolarHBondContact NH2-OD1 2.96Å
143	A	98.8	Very high	98.6	Very high	48 Å²	48	56.6 Å²	56.6	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-43.9	-166.9	0	0	0	0	0	114	R141 W145 L146 H147	R141-A143 PolarHBondContact O-N 3Å; A143-W145 PolarHBondContact O-N 2.9Å; A143-L146 PolarHBondContact O-N 3.24Å; A143-H147 PolarHBondContact O-N 2.69Å
144	T	98.7	Very high	98.5	Very high	51 Å²	51	59.2 Å²	59.2	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-46.7	173.1	-53.2	0	0	0	0	112.4	N138 R142 H147 Q148	N138-T144 PolarHBondContact ND2-OG1 2.88Å; N138-T144 PolarHBondContact OD1-OG1 2.83Å; R142-T144 PolarHBondContact O-N 3.46Å; T144-H147 PolarHBondContact O-N 3.35Å; T144-Q148 WeakPolarHBondContact O-CB 3.39Å; T144-Q148 PolarHBondContact O-N 2.67Å
145	W	98.6	Very high	98.3	Very high	36 Å²	36	66 Å²	66	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-69.8	-31.3	179.6	-58.6	-48.6	0	0	0	112.6	L139 R142 A143 Q148 A149 N309 L310 I311	L139-W145 HydrophobicContact CD2-CH2 3.47Å; L139-W145 VanDerWaalsContact CD2-CH2 3.47Å; L139-W145 HydrophobicContact CD2-CZ2 4Å; L139-W145 HydrophobicContact CD2-CZ3 4.32Å; R142-W145 HydrophobicContact CB-CE3 3.82Å; R142-W145 HydrophobicContact CB-CZ3 4.46Å; R142-W145 HydrophobicContact CG-CE3 3.77Å; R142-W145 HydrophobicContact CG-CZ3 3.97Å; R142-W145 VanDerWaalsContact NH1-CZ3 3.28Å; R142-W145 PolarHBondContact O-N 3.07Å; R142-W145 VanDerWaalsContact O-N 3.12Å; A143-W145 PolarHBondContact O-N 2.9Å; W145-Q148 PolarHBondContact O-N 3.42Å; W145-A149 WeakPolarHBondContact O-CB 3.42Å; W145-A149 PolarHBondContact O-N 3.08Å; W145-N309 HydrophobicContact CH2-CB 4.21Å; W145-N309 VanDerWaalsContact CZ2-C 3.4Å; W145-N309 HydrophobicContact CZ2-CB 4.22Å; W145-N309 VanDerWaalsContact CZ2-O 3.3Å; W145-N309 WeakPolarHBondContact CZ2-O 3.36Å; W145-L310 PolarHBondContact NE1-O 3.12Å; W145-L310 VanDerWaalsContact NE1-O 3.08Å; W145-I311 HydrophobicContact CH2-CD1 4.4Å; W145-I311 HydrophobicContact CZ2-CD1 3.93Å; W145-I311 HydrophobicContact CZ2-CG1 3.62Å
146	L	98.6	Very high	98.2	Very high	49 Å²	49	68 Å²	68	26%	0.257	33%	0.333	S	S	.	.	H	α-helix	trans	-68.2	-41.5	172.7	-71.1	170.3	0	0	0	111.7	R142 A143 Q148 L150 V165 A166	R142-L146 HydrophobicContact CB-CD1 4.42Å; R142-L146 HydrophobicContact CB-CG 4.36Å; R142-L146 WeakPolarHBondContact O-CG 3.46Å; R142-L146 PolarHBondContact O-N 3.13Å; A143-L146 PolarHBondContact O-N 3.24Å; L146-Q148 VanDerWaalsContact C-N 3.34Å; L146-L150 WeakPolarHBondContact O-CG 3.42Å; L146-L150 PolarHBondContact O-N 3.14Å; L146-V165 HydrophobicContact CD2-CB 4.39Å; L146-V165 HydrophobicContact CD2-CG1 3.78Å; L146-V165 HydrophobicContact CD2-CG2 4.09Å; L146-A166 HydrophobicContact CD1-CB 4.38Å; L146-A166 HydrophobicContact CD2-CB 4.15Å
147	H	98.6	Very high	98	Very high	102 Å²	102	76.1 Å²	76.1	47%	0.472	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-43.9	170.1	166	-102	0	0	0	111.2	A143 T144 L150 R151	A143-H147 PolarHBondContact O-N 2.69Å; T144-H147 PolarHBondContact O-N 3.35Å; H147-L150 PolarHBondContact O-N 2.77Å; H147-R151 PolarHBondContact NE2-NE 2.62Å; H147-R151 PolarHBondContact NE2-NH2 2.8Å; H147-R151 WeakPolarHBondContact O-CG 3.26Å; H147-R151 PolarHBondContact O-N 3.42Å
148	Q	98.3	Very high	97.9	Very high	88 Å²	88	76 Å²	76	41%	0.411	37%	0.374	S	S	.	.	H	α-helix	trans	-60	-50	177.2	178.9	177.4	-8.5	0	0	112.1	T144 W145 L146 L150 R151 E152	T144-Q148 WeakPolarHBondContact O-CB 3.39Å; T144-Q148 PolarHBondContact O-N 2.67Å; W145-Q148 PolarHBondContact O-N 3.42Å; L146-Q148 VanDerWaalsContact C-N 3.34Å; Q148-L150 VanDerWaalsContact C-N 3.27Å; Q148-L150 PolarHBondContact O-N 2.94Å; Q148-R151 CarbonylContact O-C 3.56Å; Q148-R151 WeakPolarHBondContact O-CA 3.21Å; Q148-R151 WeakPolarHBondContact O-CB 3.21Å; Q148-R151 PolarHBondContact O-N 2.82Å; Q148-E152 HydrophobicContact CG-CG 4.37Å; Q148-E152 VanDerWaalsContact CG-OE1 3.22Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.36Å; Q148-E152 PolarHBondContact NE2-OE1 3.27Å; Q148-E152 WeakPolarHBondContact O-CG 3.22Å; Q148-E152 PolarHBondContact O-N 2.7Å
149	A	98.2	Very high	97.9	Very high	13 Å²	13	78.7 Å²	78.7	11%	0.107	39%	0.391	C	S	.	.	H	α-helix	trans	-58	-38.5	178.7	0	0	0	0	0	112.5	W145 E152 G153 T154 V165	W145-A149 WeakPolarHBondContact O-CB 3.42Å; W145-A149 PolarHBondContact O-N 3.08Å; A149-E152 CarbonylContact O-C 3.06Å; A149-E152 PolarHBondContact O-N 3.49Å; A149-G153 PolarHBondContact O-N 3.16Å; A149-T154 WeakPolarHBondContact O-CB 3.46Å; A149-T154 PolarHBondContact O-N 2.97Å; A149-T154 PolarHBondContact O-OG1 3.39Å; A149-T154 VanDerWaalsContact O-OG1 3.1Å; A149-V165 HydrophobicContact CB-CG2 4.02Å
150	L	98.2	Very high	97.8	Very high	111 Å²	111	83.2 Å²	83.2	58%	0.581	41%	0.412	S	S	*	.	H	α-helix	trans	-68.2	-35.4	173.9	-67.5	174.6	0	0	0	112.7	L146 H147 Q148 E152 G153	L146-L150 WeakPolarHBondContact O-CG 3.42Å; L146-L150 PolarHBondContact O-N 3.14Å; H147-L150 PolarHBondContact O-N 2.77Å; Q148-L150 VanDerWaalsContact C-N 3.27Å; Q148-L150 PolarHBondContact O-N 2.94Å; L150-E152 VanDerWaalsContact C-N 3.35Å; L150-G153 PolarHBondContact O-N 3.29Å
151	R	98	Very high	97.7	Very high	195 Å²	195	86.3 Å²	86.3	74%	0.736	43%	0.427	S	S	*	.	H	α-helix	trans	-67.6	-34.5	172.6	-69.3	-70.1	-174.7	167.1	3	112.6	H147 Q148 G153	H147-R151 PolarHBondContact NE2-NE 2.62Å; H147-R151 PolarHBondContact NE2-NH2 2.8Å; H147-R151 WeakPolarHBondContact O-CG 3.26Å; H147-R151 PolarHBondContact O-N 3.42Å; Q148-R151 CarbonylContact O-C 3.56Å; Q148-R151 WeakPolarHBondContact O-CA 3.21Å; Q148-R151 WeakPolarHBondContact O-CB 3.21Å; Q148-R151 PolarHBondContact O-N 2.82Å; R151-G153 PolarHBondContact O-N 3.46Å
152	E	98	Very high	97.7	Very high	131 Å²	131	84.7 Å²	84.7	61%	0.612	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-2.4	174	-68.7	167.6	176.4	0	0	112.6	Q148 A149 L150	Q148-E152 HydrophobicContact CG-CG 4.37Å; Q148-E152 VanDerWaalsContact CG-OE1 3.22Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.36Å; Q148-E152 PolarHBondContact NE2-OE1 3.27Å; Q148-E152 WeakPolarHBondContact O-CG 3.22Å; Q148-E152 PolarHBondContact O-N 2.7Å; A149-E152 CarbonylContact O-C 3.06Å; A149-E152 PolarHBondContact O-N 3.49Å; L150-E152 VanDerWaalsContact C-N 3.35Å
153	G	97.7	Very high	97.7	Very high	51 Å²	51	90.1 Å²	90.1	53%	0.526	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	10.6	172.5	0	0	0	0	0	115.2	A149 L150 R151 R155	A149-G153 PolarHBondContact O-N 3.16Å; L150-G153 PolarHBondContact O-N 3.29Å; R151-G153 PolarHBondContact O-N 3.46Å; G153-R155 PolarHBondContact O-N 3.4Å
154	T	96.8	Very high	97.6	Very high	62 Å²	62	94.3 Å²	94.3	38%	0.38	46%	0.458	S	S	.	.			trans	-57.4	124.4	173.7	-57.7	0	0	0	0	110.5	A149 V156 V165	A149-T154 WeakPolarHBondContact O-CB 3.46Å; A149-T154 PolarHBondContact O-N 2.97Å; A149-T154 PolarHBondContact O-OG1 3.39Å; A149-T154 VanDerWaalsContact O-OG1 3.1Å; T154-V156 HydrophobicContact CG2-CG2 4.14Å; T154-V165 HydrophobicContact CG2-CG2 4.34Å
155	R	96	Very high	97.6	Very high	210 Å²	210	94 Å²	94	79%	0.792	46%	0.457	S	S	*	.			trans	-97.4	125.3	177.4	-64.8	-173.9	179.1	-161.7	-1.7	110.2	G153	G153-R155 PolarHBondContact O-N 3.4Å
156	V	95	Very high	97.6	Very high	51 Å²	51	93.5 Å²	93.5	31%	0.309	46%	0.46	S	S	.	.			trans	-121.3	114.5	-177.2	-175	0	0	0	0	107.8	T154 Q161 I162 V165	T154-V156 HydrophobicContact CG2-CG2 4.14Å; V156-Q161 HydrophobicContact CG1-CB 4.05Å; V156-I162 HydrophobicContact CG1-CB 4.33Å; V156-I162 HydrophobicContact CG1-CG1 3.43Å; V156-I162 VanDerWaalsContact CG1-CG1 3.43Å; V156-V165 HydrophobicContact CG1-CG1 4.41Å; V156-V165 HydrophobicContact CG2-CG1 4Å
157	Q	96.3	Very high	97.5	Very high	172 Å²	172	95 Å²	95	80%	0.804	47%	0.474	S	S	*	.			trans	-127.1	-44.3	-175.8	-65.8	-174.9	-25.6	0	0	112.5
158	S	96.9	Very high	97.5	Very high	41 Å²	41	91.6 Å²	91.6	29%	0.287	47%	0.467	S	S	.	.	S	Bend	trans	-88.5	160.3	178.4	69.7	0	0	0	0	112.5	E160 Q161 I162	S158-E160 PolarHBondContact O-N 3.01Å; S158-Q161 PolarHBondContact O-N 3.29Å; S158-Q161 WeakPolarHBondContact OG-CG 3.46Å; S158-Q161 PolarHBondContact OG-N 3.31Å; S158-Q161 VanDerWaalsContact OG-N 3.09Å; S158-I162 WeakPolarHBondContact O-CG1 3.39Å; S158-I162 PolarHBondContact O-N 2.85Å; S158-I162 VanDerWaalsContact O-N 3.1Å
159	V	97.4	Very high	97.5	Very high	82 Å²	82	89 Å²	89	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-65.6	-28.4	174.4	-170.1	0	0	0	0	110.4	I162 R163	V159-I162 WeakPolarHBondContact O-CB 3.38Å; V159-I162 PolarHBondContact O-N 3.4Å; V159-R163 WeakPolarHBondContact O-CG 3.45Å; V159-R163 PolarHBondContact O-N 3.42Å
160	E	97.7	Very high	97.5	Very high	94 Å²	94	89.4 Å²	89.4	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-63.9	-49.5	175.1	-65.9	56	-122.6	0	0	110.1	S158 I162 R163 E164	S158-E160 PolarHBondContact O-N 3.01Å; E160-I162 VanDerWaalsContact C-N 3.28Å; E160-I162 PolarHBondContact O-N 3.02Å; E160-R163 WeakPolarHBondContact O-CB 3.34Å; E160-R163 PolarHBondContact O-N 3.3Å; E160-R163 IonicContact OE1-CZ 3.51Å; E160-R163 IonicContact OE1-NH1 2.69Å; E160-R163 PolarHBondContact OE1-NH1 2.84Å; E160-R163 IonicContact OE1-NH2 3.31Å; E160-R163 PolarHBondContact OE1-NH2 2.92Å; E160-E164 WeakPolarHBondContact O-CG 3.45Å; E160-E164 PolarHBondContact O-N 3.27Å
161	Q	97.6	Very high	97.5	Very high	66 Å²	66	94 Å²	94	31%	0.308	47%	0.474	S	S	.	.	H	α-helix	trans	-61.3	-34.8	173.8	-72.8	168.7	-24.9	0	0	112.5	V156 S158 E164 V165	V156-Q161 HydrophobicContact CG1-CB 4.05Å; S158-Q161 PolarHBondContact O-N 3.29Å; S158-Q161 WeakPolarHBondContact OG-CG 3.46Å; S158-Q161 PolarHBondContact OG-N 3.31Å; S158-Q161 VanDerWaalsContact OG-N 3.09Å; Q161-E164 PolarHBondContact O-N 3.2Å; Q161-V165 VanDerWaalsContact O-CG1 3.3Å; Q161-V165 WeakPolarHBondContact O-CG1 3.39Å; Q161-V165 PolarHBondContact O-N 2.88Å
162	I	98	Very high	97.6	Very high	91 Å²	91	85.6 Å²	85.6	47%	0.467	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-44	172.5	-65.2	170.9	0	0	0	110.6	V156 S158 V159 E160 E164 A166	V156-I162 HydrophobicContact CG1-CB 4.33Å; V156-I162 HydrophobicContact CG1-CG1 3.43Å; V156-I162 VanDerWaalsContact CG1-CG1 3.43Å; S158-I162 WeakPolarHBondContact O-CG1 3.39Å; S158-I162 PolarHBondContact O-N 2.85Å; S158-I162 VanDerWaalsContact O-N 3.1Å; V159-I162 WeakPolarHBondContact O-CB 3.38Å; V159-I162 PolarHBondContact O-N 3.4Å; E160-I162 VanDerWaalsContact C-N 3.28Å; E160-I162 PolarHBondContact O-N 3.02Å; I162-E164 VanDerWaalsContact C-N 3.35Å; I162-A166 WeakPolarHBondContact O-CB 3.43Å; I162-A166 PolarHBondContact O-N 2.77Å; I162-A166 VanDerWaalsContact O-N 3.08Å
163	R	97.9	Very high	97.6	Very high	149 Å²	149	87.6 Å²	87.6	56%	0.562	45%	0.446	S	S	*	.	H	α-helix	trans	-66.8	-35.3	177.2	-66.5	-175.3	-151.1	98.3	-0.8	112.4	V159 E160 S167	V159-R163 WeakPolarHBondContact O-CG 3.45Å; V159-R163 PolarHBondContact O-N 3.42Å; E160-R163 WeakPolarHBondContact O-CB 3.34Å; E160-R163 PolarHBondContact O-N 3.3Å; E160-R163 IonicContact OE1-CZ 3.51Å; E160-R163 IonicContact OE1-NH1 2.69Å; E160-R163 PolarHBondContact OE1-NH1 2.84Å; E160-R163 IonicContact OE1-NH2 3.31Å; E160-R163 PolarHBondContact OE1-NH2 2.92Å; R163-S167 WeakPolarHBondContact O-CA 3.24Å; R163-S167 WeakPolarHBondContact O-CB 3.24Å; R163-S167 PolarHBondContact O-N 3.46Å; R163-S167 VanDerWaalsContact O-N 3.14Å
164	E	97.8	Very high	97.7	Very high	135 Å²	135	88 Å²	88	63%	0.631	45%	0.449	S	S	*	.	H	α-helix	trans	-67.6	-55.3	177.3	-72.3	163.1	-174.1	0	0	111.5	E160 Q161 I162 A166 S167	E160-E164 WeakPolarHBondContact O-CG 3.45Å; E160-E164 PolarHBondContact O-N 3.27Å; Q161-E164 PolarHBondContact O-N 3.2Å; I162-E164 VanDerWaalsContact C-N 3.35Å; E164-A166 VanDerWaalsContact C-N 3.35Å; E164-A166 PolarHBondContact O-N 3.35Å; E164-S167 WeakPolarHBondContact O-CB 3.37Å; E164-S167 PolarHBondContact O-N 3.03Å; E164-S167 VanDerWaalsContact O-N 3.12Å
165	V	97.7	Very high	97.7	Very high	46 Å²	46	87.9 Å²	87.9	28%	0.279	44%	0.444	S	S	.	.	H	α-helix	trans	-70	-30.3	-176.2	76.7	0	0	0	0	112.8	L146 A149 T154 V156 Q161 S167	L146-V165 HydrophobicContact CD2-CB 4.39Å; L146-V165 HydrophobicContact CD2-CG1 3.78Å; L146-V165 HydrophobicContact CD2-CG2 4.09Å; A149-V165 HydrophobicContact CB-CG2 4.02Å; T154-V165 HydrophobicContact CG2-CG2 4.34Å; V156-V165 HydrophobicContact CG1-CG1 4.41Å; V156-V165 HydrophobicContact CG2-CG1 4Å; Q161-V165 VanDerWaalsContact O-CG1 3.3Å; Q161-V165 WeakPolarHBondContact O-CG1 3.39Å; Q161-V165 PolarHBondContact O-N 2.88Å; V165-S167 VanDerWaalsContact C-N 3.34Å
166	A	98.3	Very high	97.9	Very high	25 Å²	25	78.5 Å²	78.5	21%	0.207	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	10.6	173.7	0	0	0	0	0	113.5	L146 I162 E164 G168 A169	L146-A166 HydrophobicContact CD1-CB 4.38Å; L146-A166 HydrophobicContact CD2-CB 4.15Å; I162-A166 WeakPolarHBondContact O-CB 3.43Å; I162-A166 PolarHBondContact O-N 2.77Å; I162-A166 VanDerWaalsContact O-N 3.08Å; E164-A166 VanDerWaalsContact C-N 3.35Å; E164-A166 PolarHBondContact O-N 3.35Å; A166-G168 PolarHBondContact O-N 3.42Å; A166-A169 WeakPolarHBondContact O-CB 3.18Å; A166-A169 PolarHBondContact O-N 2.7Å; A166-A169 VanDerWaalsContact O-N 3.08Å
167	S	98.2	Very high	98.1	Very high	79 Å²	79	76 Å²	76	55%	0.552	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	138	-176.3	-174	0	0	0	0	112	R142 R163 E164 V165 A169	R142-S167 WeakPolarHBondContact CD-O 3.38Å; R142-S167 PolarHBondContact NE-O 2.56Å; R163-S167 WeakPolarHBondContact O-CA 3.24Å; R163-S167 WeakPolarHBondContact O-CB 3.24Å; R163-S167 PolarHBondContact O-N 3.46Å; R163-S167 VanDerWaalsContact O-N 3.14Å; E164-S167 WeakPolarHBondContact O-CB 3.37Å; E164-S167 PolarHBondContact O-N 3.03Å; E164-S167 VanDerWaalsContact O-N 3.12Å; V165-S167 VanDerWaalsContact C-N 3.34Å; S167-A169 VanDerWaalsContact C-N 3.33Å
168	G	97.5	Very high	98.2	Very high	31 Å²	31	67.9 Å²	67.9	32%	0.32	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-4.8	-173.9	0	0	0	0	0	115.6	A166	A166-G168 PolarHBondContact O-N 3.42Å
169	A	98.5	Very high	98.3	Very high	34 Å²	34	65.9 Å²	65.9	28%	0.281	34%	0.344	S	S	.	.			trans	-67	131.8	168.8	0	0	0	0	0	111	Y140 R142 A166 S167	Y140-A169 CarbonylContact O-C 3.59Å; Y140-A169 WeakPolarHBondContact O-CA 3.32Å; R142-A169 HydrophobicContact CG-CB 4.04Å; A166-A169 WeakPolarHBondContact O-CB 3.18Å; A166-A169 PolarHBondContact O-N 2.7Å; A166-A169 VanDerWaalsContact O-N 3.08Å; S167-A169 VanDerWaalsContact C-N 3.33Å
170	A	98.6	Very high	98.4	Very high	22 Å²	22	62.1 Å²	62.1	18%	0.182	32%	0.321	C	S	.	.			trans	-116.3	164.2	-167.6	0	0	0	0	0	113.6	Y140 R141	Y140-A170 HydrophobicContact CD1-CB 3.88Å; Y140-A170 HydrophobicContact CE1-CB 4.2Å; Y140-A170 PolarHBondContact O-N 3.24Å; R141-A170 PolarHBondContact NH1-O 2.81Å
171	R	98.7	Very high	98.4	Very high	206 Å²	206	57.9 Å²	57.9	78%	0.777	30%	0.302	S	S	*	.			trans	-87.3	122.6	172.5	169	179.9	-71.6	-177.1	-1.3	108.4	E175	R171-E175 WeakPolarHBondContact O-CG 2.95Å
172	I	98.8	Very high	98.5	Very high	20 Å²	20	54.7 Å²	54.7	10%	0.103	29%	0.287	C	S	.	.			trans	-73.9	-35.1	-176.5	-66.3	157.3	0	0	0	113.3	L137 Y140 G174 E175 F196 F198	L137-I172 HydrophobicContact CD2-CD1 3.49Å; L137-I172 VanDerWaalsContact CD2-CD1 3.49Å; Y140-I172 HydrophobicContact CD1-CG1 3.69Å; Y140-I172 HydrophobicContact CD2-CG1 4.46Å; Y140-I172 HydrophobicContact CE1-CG1 4.42Å; Y140-I172 HydrophobicContact CG-CD1 4.42Å; Y140-I172 HydrophobicContact CG-CG1 3.74Å; I172-G174 PolarHBondContact O-N 3.49Å; I172-G174 VanDerWaalsContact O-N 3.11Å; I172-E175 WeakPolarHBondContact O-CB 3.07Å; I172-E175 WeakPolarHBondContact O-CG 3.47Å; I172-E175 PolarHBondContact O-N 2.9Å; I172-F196 HydrophobicContact CG2-CB 3.78Å; I172-F198 HydrophobicContact CB-CZ 4.5Å; I172-F198 HydrophobicContact CG1-CZ 4.4Å; I172-F198 HydrophobicContact CG2-CD1 4.07Å; I172-F198 HydrophobicContact CG2-CD2 3.62Å; I172-F198 HydrophobicContact CG2-CE1 3.84Å; I172-F198 HydrophobicContact CG2-CE2 3.37Å; I172-F198 HydrophobicContact CG2-CG 3.97Å; I172-F198 HydrophobicContact CG2-CZ 3.49Å; I172-F198 VanDerWaalsContact CG2-CZ 3.49Å
173	R	98.7	Very high	98.4	Very high	173 Å²	173	51.9 Å²	51.9	65%	0.653	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	114.7	-175.9	-179.7	176	-61.1	-71.2	-5.8	111.1	G197	R173-G197 WeakPolarHBondContact CA-O 3.32Å
174	G	98.4	Very high	98.4	Very high	59 Å²	59	52 Å²	52	61%	0.608	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.8	-12.9	-177.4	0	0	0	0	0	114.3	I172 G197	I172-G174 PolarHBondContact O-N 3.49Å; I172-G174 VanDerWaalsContact O-N 3.11Å; G174-G197 PolarHBondContact N-O 2.78Å
175	E	98.8	Very high	98.5	Very high	59 Å²	59	46.8 Å²	46.8	28%	0.276	26%	0.258	S	S	.	.			trans	-72.8	158.1	174.7	-56.6	-80.7	111	0	0	110.7	Y140 R171 I172 F198 N199 D231	Y140-E175 HydrophobicContact CE1-CB 4.22Å; Y140-E175 HydrophobicContact CE1-CG 3.74Å; Y140-E175 WeakPolarHBondContact CE1-OE2 3.48Å; Y140-E175 PolarHBondContact OH-OE2 3.3Å; R171-E175 WeakPolarHBondContact O-CG 2.95Å; I172-E175 WeakPolarHBondContact O-CB 3.07Å; I172-E175 WeakPolarHBondContact O-CG 3.47Å; I172-E175 PolarHBondContact O-N 2.9Å; E175-F198 HydrophobicContact CB-CD1 4.03Å; E175-F198 HydrophobicContact CB-CE1 3.97Å; E175-F198 WeakPolarHBondContact O-CA 3.46Å; E175-N199 PolarHBondContact O-N 2.9Å; E175-D231 HydrophobicContact CB-CB 4.4Å
176	T	98.9	Very high	98.5	Very high	13 Å²	13	44.6 Å²	44.6	8%	0.08	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.2	-173.4	-43	0	0	0	0	111.3	N199 L201 H229 D231 C232	T176-N199 CarbonylContact C-O 3.56Å; T176-N199 WeakPolarHBondContact CA-O 3.48Å; T176-N199 HydrophobicContact CG2-CB 4.42Å; T176-L201 HydrophobicContact CG2-CD1 3.48Å; T176-L201 VanDerWaalsContact CG2-CD1 3.48Å; T176-H229 VanDerWaalsContact CB-O 3.26Å; T176-H229 WeakPolarHBondContact CB-O 3.4Å; T176-H229 WeakPolarHBondContact CG2-O 3.48Å; T176-D231 WeakPolarHBondContact CA-OD2 3.47Å; T176-D231 WeakPolarHBondContact CB-OD2 3.17Å; T176-D231 PolarHBondContact N-OD2 2.77Å; T176-D231 PolarHBondContact O-N 2.91Å; T176-D231 PolarHBondContact OG1-OD2 2.69Å; T176-C232 PolarHBondContact O-N 2.92Å
177	L	98.9	Very high	98.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.3	175.3	-178.3	65.7	0	0	0	110.1	I136 I179 V189 A193 F198 N199 V200 L201 C232 T234	I136-L177 HydrophobicContact CD1-CD1 3.86Å; I136-L177 HydrophobicContact CD1-CD2 4.12Å; L177-I179 HydrophobicContact CG-CG1 4.39Å; L177-V189 HydrophobicContact CD2-CG1 4.29Å; L177-A193 HydrophobicContact CD2-CB 3.52Å; L177-F198 HydrophobicContact CB-CB 4.21Å; L177-F198 HydrophobicContact CB-CD1 3.84Å; L177-F198 HydrophobicContact CB-CE1 4.33Å; L177-F198 HydrophobicContact CB-CG 4.02Å; L177-N199 PolarHBondContact N-O 2.63Å; L177-V200 WeakPolarHBondContact O-CA 3.39Å; L177-L201 PolarHBondContact O-N 3.1Å; L177-C232 CarbonylContact C-O 3.59Å; L177-C232 WeakPolarHBondContact CA-O 3.33Å; L177-C232 HydrophobicContact CD1-CB 3.95Å; L177-T234 HydrophobicContact CD1-CG2 3.92Å; L177-T234 HydrophobicContact CG-CG2 4.37Å
178	G	98.9	Very high	98.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	116.3	174.4	0	0	0	0	0	111.9	S230 C232 V233 T234	G178-S230 WeakPolarHBondContact CA-OG 3.27Å; G178-S230 PolarHBondContact N-OG 3.13Å; G178-C232 PolarHBondContact N-O 2.76Å; G178-V233 CarbonylContact O-C 3.58Å; G178-V233 WeakPolarHBondContact O-CA 3.3Å; G178-T234 PolarHBondContact O-N 3.47Å
179	I	98.9	Very high	98.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.4	177.6	-66.6	171.8	0	0	0	110.2	L177 G181 L182 V189 A190 V200 L201 F202 Y203 L226 T234	L177-I179 HydrophobicContact CG-CG1 4.39Å; I179-G181 VanDerWaalsContact CG2-O 3.29Å; I179-G181 WeakPolarHBondContact CG2-O 3.32Å; I179-L182 HydrophobicContact CD1-CD1 4.43Å; I179-L182 HydrophobicContact CG2-CD1 4Å; I179-V189 HydrophobicContact CD1-CG1 4.14Å; I179-A190 HydrophobicContact CD1-CB 3.68Å; I179-V200 HydrophobicContact CD1-CG1 3.63Å; I179-V200 HydrophobicContact CG1-CG1 4.38Å; I179-L201 PolarHBondContact N-O 2.92Å; I179-F202 HydrophobicContact CB-CB 4.04Å; I179-F202 HydrophobicContact CG2-CB 4.38Å; I179-F202 CarbonylContact O-C 3.41Å; I179-F202 WeakPolarHBondContact O-CA 3.31Å; I179-F202 WeakPolarHBondContact O-CB 3.37Å; I179-Y203 PolarHBondContact O-N 3.02Å; I179-L226 WeakPolarHBondContact O-CD1 3.48Å; I179-T234 HydrophobicContact CB-CG2 4.42Å; I179-T234 HydrophobicContact CG1-CG2 3.69Å
180	I	98.9	Very high	98.7	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.6	173	-65.7	171.3	0	0	0	108.3	L223 L226 L227 V233 T234 L235 H236 C237 L246 I247	I180-L223 HydrophobicContact CD1-CD1 3.48Å; I180-L223 VanDerWaalsContact CD1-CD1 3.48Å; I180-L223 HydrophobicContact CG1-CD1 4.11Å; I180-L226 HydrophobicContact CD1-CD2 4.01Å; I180-L226 HydrophobicContact CG1-CD1 3.98Å; I180-L226 HydrophobicContact CG1-CD2 3.79Å; I180-L227 HydrophobicContact CD1-CD2 4.2Å; I180-V233 HydrophobicContact CD1-CG1 3.67Å; I180-V233 HydrophobicContact CG1-CG1 4.34Å; I180-T234 PolarHBondContact N-O 3.34Å; I180-L235 HydrophobicContact CB-CD2 3.9Å; I180-L235 HydrophobicContact CD1-CD2 3.62Å; I180-L235 HydrophobicContact CG1-CD2 4.25Å; I180-L235 HydrophobicContact CG2-CD2 4.29Å; I180-H236 CarbonylContact O-C 3.27Å; I180-H236 PolarHBondContact O-N 3.13Å; I180-C237 PolarHBondContact O-N 2.91Å; I180-C237 VanDerWaalsContact O-N 3.1Å; I180-L246 HydrophobicContact CG2-CD2 3.69Å; I180-I247 HydrophobicContact CD1-CD1 4.21Å
181	G	98.7	Very high	98.6	Very high	4 Å²	4	43.9 Å²	43.9	4%	0.041	22%	0.215	C	C	.	.			trans	85.5	109.5	-169.8	0	0	0	0	0	112.3	I179 G183 Y203 D204	I179-G181 VanDerWaalsContact CG2-O 3.29Å; I179-G181 WeakPolarHBondContact CG2-O 3.32Å; G181-G183 VanDerWaalsContact C-N 3.35Å; G181-G183 PolarHBondContact O-N 3.46Å; G181-Y203 PolarHBondContact N-O 3.47Å; G181-D204 WeakPolarHBondContact CA-OD2 3.5Å
182	L	98.6	Very high	98.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.			trans	-102.9	42.8	179.2	-162.7	79.7	0	0	0	111.2	I179 Q187 A190 F202 D204 L207 V211 L215 L217	I179-L182 HydrophobicContact CD1-CD1 4.43Å; I179-L182 HydrophobicContact CG2-CD1 4Å; L182-Q187 HydrophobicContact CD1-CG 4.28Å; L182-Q187 HydrophobicContact CD2-CG 4.3Å; L182-Q187 HydrophobicContact CG-CG 3.78Å; L182-Q187 WeakPolarHBondContact O-CG 3.3Å; L182-Q187 PolarHBondContact O-NE2 3.14Å; L182-A190 HydrophobicContact CD1-CB 4.39Å; L182-F202 HydrophobicContact CB-CB 4.25Å; L182-F202 HydrophobicContact CB-CD2 3.5Å; L182-F202 HydrophobicContact CB-CE2 3.99Å; L182-F202 HydrophobicContact CB-CG 3.96Å; L182-F202 HydrophobicContact CD1-CB 4.03Å; L182-F202 HydrophobicContact CD1-CD1 4.47Å; L182-F202 HydrophobicContact CD1-CD2 4.5Å; L182-F202 HydrophobicContact CD1-CG 4.1Å; L182-F202 HydrophobicContact CD2-CD1 3.84Å; L182-F202 HydrophobicContact CD2-CD2 3.74Å; L182-F202 HydrophobicContact CD2-CE1 3.79Å; L182-F202 HydrophobicContact CD2-CE2 3.69Å; L182-F202 HydrophobicContact CD2-CG 3.8Å; L182-F202 HydrophobicContact CD2-CZ 3.71Å; L182-F202 HydrophobicContact CG-CD2 4.08Å; L182-F202 HydrophobicContact CG-CE2 4.43Å; L182-F202 HydrophobicContact CG-CG 4.15Å; L182-D204 HydrophobicContact CB-CB 4.43Å; L182-D204 PolarHBondContact N-OD2 3.45Å; L182-L207 HydrophobicContact CB-CD1 3.79Å; L182-V211 HydrophobicContact CD2-CG1 4.21Å; L182-V211 HydrophobicContact CD2-CG2 3.94Å; L182-L215 HydrophobicContact CD2-CD1 4.27Å; L182-L217 HydrophobicContact CD1-CD1 4.03Å; L182-L217 HydrophobicContact CD2-CD1 3.96Å
183	G	97.4	Very high	98.6	Very high	31 Å²	31	35.8 Å²	35.8	32%	0.32	18%	0.184	S	C	.	.	S	Bend	trans	-71	-168.2	166.3	0	0	0	0	0	112.4	G181 V185 G186 Q187	G181-G183 VanDerWaalsContact C-N 3.35Å; G181-G183 PolarHBondContact O-N 3.46Å; G183-V185 PolarHBondContact O-N 2.91Å; G183-G186 PolarHBondContact O-N 2.8Å; G183-Q187 WeakPolarHBondContact O-CG 3.16Å; G183-Q187 PolarHBondContact O-N 3.36Å
184	R	98.2	Very high	98.6	Very high	151 Å²	151	31.7 Å²	31.7	57%	0.57	17%	0.17	S	C	*	.	H	α-helix	trans	-49.5	-50.8	-173.1	-61.9	177	-174	83.3	2.8	113.7	P121 V125 Q187 A188	P121-R184 WeakPolarHBondContact O-CD 3.39Å; V125-R184 HydrophobicContact CB-CB 4.48Å; V125-R184 HydrophobicContact CG1-CB 3.87Å; V125-R184 HydrophobicContact CG2-CB 3.68Å; V125-R184 HydrophobicContact CG2-CG 4.47Å; R184-Q187 PolarHBondContact O-N 2.78Å; R184-A188 PolarHBondContact O-N 3.22Å; R184-A188 VanDerWaalsContact O-N 3.12Å
185	V	98.7	Very high	98.6	Very high	27 Å²	27	32.7 Å²	32.7	16%	0.164	17%	0.173	C	C	.	.	H	α-helix	trans	-66.5	-45.9	178.2	180	0	0	0	0	111.1	T128 A129 G183 Q187 A188 V189	T128-V185 HydrophobicContact CG2-CG1 3.81Å; T128-V185 HydrophobicContact CG2-CG2 4.16Å; A129-V185 HydrophobicContact CB-CG1 4.48Å; G183-V185 PolarHBondContact O-N 2.91Å; V185-Q187 VanDerWaalsContact C-N 3.28Å; V185-Q187 PolarHBondContact O-N 2.93Å; V185-A188 PolarHBondContact O-N 3Å; V185-A188 VanDerWaalsContact O-N 3.14Å; V185-V189 HydrophobicContact CG1-CG2 4.15Å; V185-V189 WeakPolarHBondContact O-CB 3.33Å; V185-V189 WeakPolarHBondContact O-CG2 3.46Å; V185-V189 PolarHBondContact O-N 2.76Å
186	G	98.7	Very high	98.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.6	-38.3	177.6	0	0	0	0	0	113.3	G183 A190	G183-G186 PolarHBondContact O-N 2.8Å; G186-A190 VanDerWaalsContact O-CB 3.29Å; G186-A190 WeakPolarHBondContact O-CB 3.35Å; G186-A190 PolarHBondContact O-N 3.19Å
187	Q	98.5	Very high	98.6	Very high	63 Å²	63	34 Å²	34	29%	0.294	18%	0.181	S	C	.	.	H	α-helix	trans	-69.1	-44.3	174.7	-64.8	177.9	27.6	0	0	112.1	L182 G183 R184 V185 V189 A190 L191 L215	L182-Q187 HydrophobicContact CD1-CG 4.28Å; L182-Q187 HydrophobicContact CD2-CG 4.3Å; L182-Q187 HydrophobicContact CG-CG 3.78Å; L182-Q187 WeakPolarHBondContact O-CG 3.3Å; L182-Q187 PolarHBondContact O-NE2 3.14Å; G183-Q187 WeakPolarHBondContact O-CG 3.16Å; G183-Q187 PolarHBondContact O-N 3.36Å; R184-Q187 PolarHBondContact O-N 2.78Å; V185-Q187 VanDerWaalsContact C-N 3.28Å; V185-Q187 PolarHBondContact O-N 2.93Å; Q187-V189 VanDerWaalsContact C-N 3.34Å; Q187-V189 PolarHBondContact O-N 3.43Å; Q187-A190 PolarHBondContact O-N 3.2Å; Q187-L191 WeakPolarHBondContact O-CG 3.45Å; Q187-L191 PolarHBondContact O-N 3.49Å; Q187-L215 HydrophobicContact CB-CD1 4.14Å; Q187-L215 HydrophobicContact CG-CD1 3.7Å
188	A	98.7	Very high	98.6	Very high	11 Å²	11	34.6 Å²	34.6	9%	0.091	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-40.6	176.4	0	0	0	0	0	112.2	V125 A129 R184 V185 R192	V125-A188 HydrophobicContact CG1-CB 4.2Å; A129-A188 HydrophobicContact CB-CB 3.58Å; R184-A188 PolarHBondContact O-N 3.22Å; R184-A188 VanDerWaalsContact O-N 3.12Å; V185-A188 PolarHBondContact O-N 3Å; V185-A188 VanDerWaalsContact O-N 3.14Å; A188-R192 WeakPolarHBondContact O-CD 3.37Å; A188-R192 VanDerWaalsContact O-CG 3.31Å; A188-R192 WeakPolarHBondContact O-CG 3.47Å; A188-R192 PolarHBondContact O-N 2.81Å
189	V	98.9	Very high	98.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-46.6	172.8	168.1	0	0	0	0	111.2	A129 T132 L133 L177 I179 V185 Q187 L191 R192 A193 T234	A129-V189 HydrophobicContact CB-CG2 3.7Å; T132-V189 HydrophobicContact CG2-CG1 4.22Å; T132-V189 HydrophobicContact CG2-CG2 3.9Å; L133-V189 HydrophobicContact CD2-CB 4.16Å; L133-V189 HydrophobicContact CD2-CG1 3.84Å; L133-V189 HydrophobicContact CD2-CG2 4.1Å; L177-V189 HydrophobicContact CD2-CG1 4.29Å; I179-V189 HydrophobicContact CD1-CG1 4.14Å; V185-V189 HydrophobicContact CG1-CG2 4.15Å; V185-V189 WeakPolarHBondContact O-CB 3.33Å; V185-V189 WeakPolarHBondContact O-CG2 3.46Å; V185-V189 PolarHBondContact O-N 2.76Å; Q187-V189 VanDerWaalsContact C-N 3.34Å; Q187-V189 PolarHBondContact O-N 3.43Å; V189-L191 VanDerWaalsContact C-N 3.35Å; V189-L191 PolarHBondContact O-N 3.12Å; V189-R192 PolarHBondContact O-N 3.27Å; V189-A193 VanDerWaalsContact O-CB 3.27Å; V189-A193 WeakPolarHBondContact O-CB 3.49Å; V189-A193 PolarHBondContact O-N 2.91Å; V189-T234 HydrophobicContact CG1-CG2 4.43Å
190	A	98.8	Very high	98.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-43	179.1	0	0	0	0	0	112.8	I179 L182 G186 Q187 K194 V200 L217	I179-A190 HydrophobicContact CD1-CB 3.68Å; L182-A190 HydrophobicContact CD1-CB 4.39Å; G186-A190 VanDerWaalsContact O-CB 3.29Å; G186-A190 WeakPolarHBondContact O-CB 3.35Å; G186-A190 PolarHBondContact O-N 3.19Å; Q187-A190 PolarHBondContact O-N 3.2Å; A190-K194 WeakPolarHBondContact O-CG 3.45Å; A190-K194 PolarHBondContact O-N 2.82Å; A190-V200 HydrophobicContact CB-CG1 3.98Å; A190-L217 HydrophobicContact CB-CD1 3.79Å; A190-L217 HydrophobicContact CB-CD2 3.98Å
191	L	98.4	Very high	98.6	Very high	100 Å²	100	38.4 Å²	38.4	52%	0.524	20%	0.204	S	C	.	.	H	α-helix	trans	-64.3	-44.8	177.7	-69.6	172.3	0	0	0	111.8	Q187 V189 L215	Q187-L191 WeakPolarHBondContact O-CG 3.45Å; Q187-L191 PolarHBondContact O-N 3.49Å; V189-L191 VanDerWaalsContact C-N 3.35Å; V189-L191 PolarHBondContact O-N 3.12Å; L191-L215 HydrophobicContact CD2-CD2 4.37Å
192	R	98.8	Very high	98.6	Very high	57 Å²	57	38.2 Å²	38.2	22%	0.215	20%	0.202	C	C	.	.	H	α-helix	trans	-65	-45.5	177.1	-71	163.8	161.2	74.7	-5.2	112.1	E126 D130 L133 A188 V189 K194 A195 F196	E126-R192 IonicContact OE1-CZ 2.77Å; E126-R192 IonicContact OE1-NH1 2.71Å; E126-R192 PolarHBondContact OE1-NH1 3.35Å; E126-R192 IonicContact OE1-NH2 3.56Å; E126-R192 PolarHBondContact OE1-NH2 3.28Å; D130-R192 IonicContact OD1-CZ 3.49Å; D130-R192 IonicContact OD1-NE 2.97Å; D130-R192 PolarHBondContact OD1-NE 3.14Å; D130-R192 IonicContact OD1-NH2 2.9Å; D130-R192 PolarHBondContact OD1-NH2 3.4Å; D130-R192 IonicContact OD2-CZ 2.82Å; D130-R192 IonicContact OD2-NE 2.76Å; D130-R192 IonicContact OD2-NH2 3.46Å; D130-R192 PolarHBondContact OD2-NH2 2.77Å; L133-R192 HydrophobicContact CD2-CB 3.86Å; L133-R192 HydrophobicContact CG-CB 3.88Å; A188-R192 WeakPolarHBondContact O-CD 3.37Å; A188-R192 VanDerWaalsContact O-CG 3.31Å; A188-R192 WeakPolarHBondContact O-CG 3.47Å; A188-R192 PolarHBondContact O-N 2.81Å; V189-R192 PolarHBondContact O-N 3.27Å; R192-K194 VanDerWaalsContact C-N 3.3Å; R192-K194 PolarHBondContact O-N 3.33Å; R192-A195 WeakPolarHBondContact O-CB 3.41Å; R192-A195 PolarHBondContact O-N 3.05Å; R192-F196 WeakPolarHBondContact O-CD2 3.33Å
193	A	98.8	Very high	98.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-35.7	-177.2	0	0	0	0	0	113.5	L177 V189 A195 F196 F198 V200	L177-A193 HydrophobicContact CD2-CB 3.52Å; V189-A193 VanDerWaalsContact O-CB 3.27Å; V189-A193 WeakPolarHBondContact O-CB 3.49Å; V189-A193 PolarHBondContact O-N 2.91Å; A193-A195 PolarHBondContact O-N 2.97Å; A193-F196 PolarHBondContact O-N 3.37Å; A193-F196 VanDerWaalsContact O-N 3.11Å; A193-F198 HydrophobicContact CB-CB 4.38Å; A193-F198 HydrophobicContact CB-CD2 3.91Å; A193-V200 HydrophobicContact CB-CG2 4.06Å
194	K	98.2	Very high	98.6	Very high	86 Å²	86	39.9 Å²	39.9	37%	0.374	20%	0.2	S	C	.	.	H	α-helix	trans	-59.2	-31.7	179	-75.8	168.6	64.6	156.7	0	113.1	A190 R192 F196 G197 V200 L215 G216 L217	A190-K194 WeakPolarHBondContact O-CG 3.45Å; A190-K194 PolarHBondContact O-N 2.82Å; R192-K194 VanDerWaalsContact C-N 3.3Å; R192-K194 PolarHBondContact O-N 3.33Å; K194-F196 VanDerWaalsContact C-N 3.32Å; K194-F196 PolarHBondContact O-N 2.97Å; K194-G197 PolarHBondContact O-N 3.36Å; K194-G197 VanDerWaalsContact O-N 3.14Å; K194-V200 HydrophobicContact CG-CG2 4.04Å; K194-L215 PolarHBondContact NZ-O 2.95Å; K194-G216 PolarHBondContact NZ-O 2.95Å; K194-L217 HydrophobicContact CD-CD2 3.79Å
195	A	98.5	Very high	98.6	Very high	81 Å²	81	36 Å²	36	67%	0.669	20%	0.195	S	C	*	.	H	α-helix	trans	-64.8	-34.4	177.3	0	0	0	0	0	112.9	R192 A193 G197	R192-A195 WeakPolarHBondContact O-CB 3.41Å; R192-A195 PolarHBondContact O-N 3.05Å; A193-A195 PolarHBondContact O-N 2.97Å; A195-G197 PolarHBondContact O-N 3Å
196	F	98.8	Very high	98.5	Very high	87 Å²	87	42.2 Å²	42.2	38%	0.382	22%	0.216	S	C	.	.	H	α-helix	trans	-76.2	-11.7	176.6	-63.7	-87.6	0	0	0	113.2	L133 L137 I172 R192 A193 K194 F198	L133-F196 HydrophobicContact CD1-CD2 4.22Å; L133-F196 HydrophobicContact CD1-CE2 4.1Å; L137-F196 HydrophobicContact CD1-CE1 3.87Å; L137-F196 HydrophobicContact CD1-CE2 4.48Å; L137-F196 HydrophobicContact CD1-CZ 3.76Å; L137-F196 HydrophobicContact CD2-CD1 3.89Å; L137-F196 HydrophobicContact CD2-CE1 3.83Å; L137-F196 HydrophobicContact CD2-CG 4.48Å; L137-F196 HydrophobicContact CD2-CZ 4.37Å; L137-F196 HydrophobicContact CG-CE1 4.49Å; I172-F196 HydrophobicContact CG2-CB 3.78Å; R192-F196 WeakPolarHBondContact O-CD2 3.33Å; A193-F196 PolarHBondContact O-N 3.37Å; A193-F196 VanDerWaalsContact O-N 3.11Å; K194-F196 VanDerWaalsContact C-N 3.32Å; K194-F196 PolarHBondContact O-N 2.97Å; F196-F198 HydrophobicContact CB-CD2 4.28Å
197	G	98.5	Very high	98.4	Very high	13 Å²	13	44.8 Å²	44.8	13%	0.134	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	23.1	179.2	0	0	0	0	0	114.8	R173 G174 K194 A195	R173-G197 WeakPolarHBondContact CA-O 3.32Å; G174-G197 PolarHBondContact N-O 2.78Å; K194-G197 PolarHBondContact O-N 3.36Å; K194-G197 VanDerWaalsContact O-N 3.14Å; A195-G197 PolarHBondContact O-N 3Å
198	F	98.9	Very high	98.2	Very high	12 Å²	12	46.4 Å²	46.4	5%	0.053	25%	0.248	C	C	.	.			trans	-64.8	142.5	165.1	-78.7	-71.1	0	0	0	111.1	I136 Y140 I172 E175 L177 A193 F196 V200	I136-F198 HydrophobicContact CG2-CE2 3.85Å; I136-F198 HydrophobicContact CG2-CZ 3.58Å; Y140-F198 HydrophobicContact CD2-CZ 4.02Å; Y140-F198 AromaticContact CE2-CE1 3.78Å; Y140-F198 HydrophobicContact CE2-CE1 3.78Å; Y140-F198 AromaticContact CE2-CZ 3.64Å; Y140-F198 HydrophobicContact CE2-CZ 3.64Å; Y140-F198 AromaticContact CZ-CE1 3.78Å; I172-F198 HydrophobicContact CB-CZ 4.5Å; I172-F198 HydrophobicContact CG1-CZ 4.4Å; I172-F198 HydrophobicContact CG2-CD1 4.07Å; I172-F198 HydrophobicContact CG2-CD2 3.62Å; I172-F198 HydrophobicContact CG2-CE1 3.84Å; I172-F198 HydrophobicContact CG2-CE2 3.37Å; I172-F198 HydrophobicContact CG2-CG 3.97Å; I172-F198 HydrophobicContact CG2-CZ 3.49Å; I172-F198 VanDerWaalsContact CG2-CZ 3.49Å; E175-F198 HydrophobicContact CB-CD1 4.03Å; E175-F198 HydrophobicContact CB-CE1 3.97Å; E175-F198 WeakPolarHBondContact O-CA 3.46Å; L177-F198 HydrophobicContact CB-CB 4.21Å; L177-F198 HydrophobicContact CB-CD1 3.84Å; L177-F198 HydrophobicContact CB-CE1 4.33Å; L177-F198 HydrophobicContact CB-CG 4.02Å; A193-F198 HydrophobicContact CB-CB 4.38Å; A193-F198 HydrophobicContact CB-CD2 3.91Å; F196-F198 HydrophobicContact CB-CD2 4.28Å; F198-V200 HydrophobicContact CB-CG2 4.11Å
199	N	98.6	Very high	98	Very high	76 Å²	76	52 Å²	52	41%	0.406	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130	153.4	-176.5	27.7	0	0	0	108.1	E175 T176 L177 L201	E175-N199 PolarHBondContact O-N 2.9Å; T176-N199 CarbonylContact C-O 3.56Å; T176-N199 WeakPolarHBondContact CA-O 3.48Å; T176-N199 HydrophobicContact CG2-CB 4.42Å; L177-N199 PolarHBondContact N-O 2.63Å; N199-L201 WeakPolarHBondContact ND2-CD1 3.37Å
200	V	98.8	Very high	97.9	Very high	5 Å²	5	53 Å²	53	3%	0.03	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.4	-173.6	-176.4	0	0	0	0	110.6	L177 I179 A190 A193 K194 F198 L217 Q218	L177-V200 WeakPolarHBondContact O-CA 3.39Å; I179-V200 HydrophobicContact CD1-CG1 3.63Å; I179-V200 HydrophobicContact CG1-CG1 4.38Å; A190-V200 HydrophobicContact CB-CG1 3.98Å; A193-V200 HydrophobicContact CB-CG2 4.06Å; K194-V200 HydrophobicContact CG-CG2 4.04Å; F198-V200 HydrophobicContact CB-CG2 4.11Å; V200-L217 HydrophobicContact CB-CD2 3.92Å; V200-L217 HydrophobicContact CG1-CD2 3.93Å; V200-Q218 PolarHBondContact O-N 3.05Å
201	L	98.4	Very high	97.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	156.4	170.6	-76.3	70.1	0	0	0	110.1	T176 L177 I179 N199 Q218 V220 H229	T176-L201 HydrophobicContact CG2-CD1 3.48Å; T176-L201 VanDerWaalsContact CG2-CD1 3.48Å; L177-L201 PolarHBondContact O-N 3.1Å; I179-L201 PolarHBondContact N-O 2.92Å; N199-L201 WeakPolarHBondContact ND2-CD1 3.37Å; L201-Q218 CarbonylContact C-O 3.53Å; L201-Q218 WeakPolarHBondContact CA-O 3.32Å; L201-Q218 HydrophobicContact CD1-CB 4.38Å; L201-Q218 HydrophobicContact CD2-CG 4.44Å; L201-Q218 HydrophobicContact CG-CB 3.99Å; L201-Q218 HydrophobicContact CG-CG 3.96Å; L201-V220 HydrophobicContact CD2-CG1 3.9Å; L201-H229 HydrophobicContact CD2-CB 3.87Å
202	F	98.9	Very high	97.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	150.5	168	75.5	-80.9	0	0	0	113.9	I179 L182 D204 V211 E212 L217 Q218 R219 V220	I179-F202 HydrophobicContact CB-CB 4.04Å; I179-F202 HydrophobicContact CG2-CB 4.38Å; I179-F202 CarbonylContact O-C 3.41Å; I179-F202 WeakPolarHBondContact O-CA 3.31Å; I179-F202 WeakPolarHBondContact O-CB 3.37Å; L182-F202 HydrophobicContact CB-CB 4.25Å; L182-F202 HydrophobicContact CB-CD2 3.5Å; L182-F202 HydrophobicContact CB-CE2 3.99Å; L182-F202 HydrophobicContact CB-CG 3.96Å; L182-F202 HydrophobicContact CD1-CB 4.03Å; L182-F202 HydrophobicContact CD1-CD1 4.47Å; L182-F202 HydrophobicContact CD1-CD2 4.5Å; L182-F202 HydrophobicContact CD1-CG 4.1Å; L182-F202 HydrophobicContact CD2-CD1 3.84Å; L182-F202 HydrophobicContact CD2-CD2 3.74Å; L182-F202 HydrophobicContact CD2-CE1 3.79Å; L182-F202 HydrophobicContact CD2-CE2 3.69Å; L182-F202 HydrophobicContact CD2-CG 3.8Å; L182-F202 HydrophobicContact CD2-CZ 3.71Å; L182-F202 HydrophobicContact CG-CD2 4.08Å; L182-F202 HydrophobicContact CG-CE2 4.43Å; L182-F202 HydrophobicContact CG-CG 4.15Å; F202-D204 HydrophobicContact CD2-CB 4.12Å; F202-D204 HydrophobicContact CE2-CB 4.35Å; F202-V211 HydrophobicContact CE2-CG1 4.2Å; F202-V211 HydrophobicContact CZ-CG1 3.79Å; F202-E212 HydrophobicContact CE1-CB 3.65Å; F202-E212 HydrophobicContact CZ-CB 3.87Å; F202-L217 HydrophobicContact CD1-CB 4.17Å; F202-L217 HydrophobicContact CD1-CD1 4.46Å; F202-L217 HydrophobicContact CE1-CB 4.2Å; F202-Q218 WeakPolarHBondContact CD1-O 3.04Å; F202-Q218 PolarHBondContact N-O 3.08Å; F202-R219 HydrophobicContact CD1-CB 4.38Å; F202-R219 HydrophobicContact CD2-CG 4.35Å; F202-R219 HydrophobicContact CE1-CB 3.66Å; F202-R219 HydrophobicContact CE1-CG 4.08Å; F202-R219 HydrophobicContact CE2-CB 4.22Å; F202-R219 HydrophobicContact CE2-CG 3.69Å; F202-R219 HydrophobicContact CZ-CB 3.57Å; F202-R219 HydrophobicContact CZ-CG 3.53Å; F202-V220 PolarHBondContact O-N 2.93Å
203	Y	98.8	Very high	97.6	Very high	49 Å²	49	57.2 Å²	57.2	19%	0.192	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.3	167.7	171.5	-112	0	0	0	108.1	I179 G181 P205 S221 T222 L223 L226	I179-Y203 PolarHBondContact O-N 3.02Å; G181-Y203 PolarHBondContact N-O 3.47Å; Y203-P205 HydrophobicContact CE1-CG 4.36Å; Y203-P205 HydrophobicContact CE2-CB 4.31Å; Y203-S221 WeakPolarHBondContact CE2-O 3.46Å; Y203-T222 VanDerWaalsContact CD2-C 3.48Å; Y203-L223 HydrophobicContact CD1-CB 4.14Å; Y203-L223 HydrophobicContact CD1-CD1 4.2Å; Y203-L223 HydrophobicContact CE1-CB 3.95Å; Y203-L226 VanDerWaalsContact N-CD1 3.31Å
204	D	98.5	Very high	97.5	Very high	16 Å²	16	61.3 Å²	61.3	9%	0.086	33%	0.334	C	S	.	.			trans	-147.7	113.1	171	-167	-46.6	0	0	0	107.4	G181 L182 F202 Y206 L207 R219	G181-D204 WeakPolarHBondContact CA-OD2 3.5Å; L182-D204 HydrophobicContact CB-CB 4.43Å; L182-D204 PolarHBondContact N-OD2 3.45Å; F202-D204 HydrophobicContact CD2-CB 4.12Å; F202-D204 HydrophobicContact CE2-CB 4.35Å; D204-Y206 VanDerWaalsContact C-N 3.33Å; D204-Y206 PolarHBondContact OD1-N 2.75Å; D204-L207 HydrophobicContact CB-CD1 3.9Å; D204-L207 HydrophobicContact CB-CG 4.19Å; D204-L207 PolarHBondContact OD1-N 3.09Å; D204-R219 PolarHBondContact O-NH2 3.39Å
205	P	97.5	Very high	97.4	Very high	70 Å²	70	59 Å²	59	46%	0.455	33%	0.325	S	S	.	.	S	Bend	trans	-83.1	-7.7	-177.1	33.2	-34.6	0	0	0	113.4	Y203	Y203-P205 HydrophobicContact CE1-CG 4.36Å; Y203-P205 HydrophobicContact CE2-CB 4.31Å
206	Y	96.6	Very high	97.4	Very high	157 Å²	157	57.6 Å²	57.6	62%	0.616	32%	0.318	S	S	*	.	S	Bend	trans	-103.6	-15.8	-173.4	-54.6	-67.3	0	0	0	113.6	D204	D204-Y206 VanDerWaalsContact C-N 3.33Å; D204-Y206 PolarHBondContact OD1-N 2.75Å
207	L	96.4	Very high	97.3	Very high	54 Å²	54	54.5 Å²	54.5	28%	0.283	31%	0.305	S	S	.	.	S	Bend	trans	-77.6	143.3	176.2	-67.3	175.3	0	0	0	113.1	L182 D204 V211 R219	L182-L207 HydrophobicContact CB-CD1 3.79Å; D204-L207 HydrophobicContact CB-CD1 3.9Å; D204-L207 HydrophobicContact CB-CG 4.19Å; D204-L207 PolarHBondContact OD1-N 3.09Å; L207-V211 HydrophobicContact CD1-CG1 4.23Å; L207-R219 PolarHBondContact O-NH1 3.11Å; L207-R219 PolarHBondContact O-NH2 3.49Å
208	S	95.1	Very high	97.3	Very high	98 Å²	98	58.3 Å²	58.3	69%	0.685	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-68.1	150.3	166.4	57.7	0	0	0	0	112
209	D	94.8	Very high	97.3	Very high	127 Å²	127	60.6 Å²	60.6	68%	0.679	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	149.3	175.5	-61.7	-29.1	0	0	0	113.1	R219	D209-R219 IonicContact OD1-CZ 3.72Å; D209-R219 IonicContact OD1-NH1 3.67Å; D209-R219 PolarHBondContact OD1-NH1 3.06Å
210	G	95.8	Very high	97.3	Very high	22 Å²	22	57.7 Å²	57.7	23%	0.227	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	116.5	-24.7	175.7	0	0	0	0	0	114	E212 R213 A214	G210-E212 VanDerWaalsContact C-N 3.27Å; G210-E212 WeakPolarHBondContact CA-OE1 3.39Å; G210-E212 WeakPolarHBondContact CA-OE2 3.4Å; G210-E212 PolarHBondContact N-OE1 3.44Å; G210-E212 VanDerWaalsContact N-OE1 3.1Å; G210-E212 PolarHBondContact N-OE2 2.77Å; G210-E212 PolarHBondContact O-N 2.93Å; G210-R213 PolarHBondContact O-N 3.1Å; G210-R213 VanDerWaalsContact O-N 3.15Å; G210-A214 PolarHBondContact O-N 2.85Å
211	V	96.2	Very high	97.2	Very high	28 Å²	28	62.7 Å²	62.7	17%	0.17	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-34.2	179.5	66	0	0	0	0	112.1	L182 F202 L207 R213 A214 L215	L182-V211 HydrophobicContact CD2-CG1 4.21Å; L182-V211 HydrophobicContact CD2-CG2 3.94Å; F202-V211 HydrophobicContact CE2-CG1 4.2Å; F202-V211 HydrophobicContact CZ-CG1 3.79Å; L207-V211 HydrophobicContact CD1-CG1 4.23Å; V211-R213 VanDerWaalsContact C-N 3.34Å; V211-R213 PolarHBondContact O-N 3.4Å; V211-A214 PolarHBondContact O-N 2.83Å; V211-L215 HydrophobicContact CG2-CD1 3.97Å; V211-L215 PolarHBondContact O-N 2.75Å; V211-L215 VanDerWaalsContact O-N 3.09Å
212	E	96.2	Very high	97.2	Very high	27 Å²	27	65.3 Å²	65.3	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-61.5	-40.7	174.7	72.7	-58.8	137.8	0	0	112.3	F202 G210 G216 L217 R219	F202-E212 HydrophobicContact CE1-CB 3.65Å; F202-E212 HydrophobicContact CZ-CB 3.87Å; G210-E212 VanDerWaalsContact C-N 3.27Å; G210-E212 WeakPolarHBondContact CA-OE1 3.39Å; G210-E212 WeakPolarHBondContact CA-OE2 3.4Å; G210-E212 PolarHBondContact N-OE1 3.44Å; G210-E212 VanDerWaalsContact N-OE1 3.1Å; G210-E212 PolarHBondContact N-OE2 2.77Å; G210-E212 PolarHBondContact O-N 2.93Å; E212-G216 WeakPolarHBondContact O-CA 3.48Å; E212-G216 PolarHBondContact O-N 3.1Å; E212-L217 PolarHBondContact O-N 2.87Å; E212-R219 HydrophobicContact CB-CB 3.97Å; E212-R219 HydrophobicContact CG-CB 4.24Å
213	R	96.6	Very high	97.2	Very high	192 Å²	192	66.5 Å²	66.5	73%	0.725	37%	0.371	S	S	*	.	H	α-helix	trans	-75.1	-37.6	177.1	-75.2	174.8	-74.9	168.8	-0.7	112.2	G210 V211	G210-R213 PolarHBondContact O-N 3.1Å; G210-R213 VanDerWaalsContact O-N 3.15Å; V211-R213 VanDerWaalsContact C-N 3.34Å; V211-R213 PolarHBondContact O-N 3.4Å
214	A	97.1	Very high	97.2	Very high	85 Å²	85	69.7 Å²	69.7	70%	0.702	39%	0.387	S	S	*	.	H	α-helix	trans	-64.8	-38	178.6	0	0	0	0	0	113	G210 V211	G210-A214 PolarHBondContact O-N 2.85Å; V211-A214 PolarHBondContact O-N 2.83Å
215	L	96.9	Very high	97.2	Very high	39 Å²	39	71.9 Å²	71.9	20%	0.204	40%	0.399	C	S	.	.	H	α-helix	trans	-96.8	-9	-178.8	-61.7	177	0	0	0	113.7	L182 Q187 L191 K194 V211 L217	L182-L215 HydrophobicContact CD2-CD1 4.27Å; Q187-L215 HydrophobicContact CB-CD1 4.14Å; Q187-L215 HydrophobicContact CG-CD1 3.7Å; L191-L215 HydrophobicContact CD2-CD2 4.37Å; K194-L215 PolarHBondContact NZ-O 2.95Å; V211-L215 HydrophobicContact CG2-CD1 3.97Å; V211-L215 PolarHBondContact O-N 2.75Å; V211-L215 VanDerWaalsContact O-N 3.09Å; L215-L217 HydrophobicContact CB-CD1 3.68Å; L215-L217 HydrophobicContact CB-CG 3.73Å; L215-L217 HydrophobicContact CD1-CD1 3.92Å; L215-L217 HydrophobicContact CG-CD1 4.47Å
216	G	97.4	Very high	97.3	Very high	50 Å²	50	68.5 Å²	68.5	52%	0.515	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	58.2	-174.3	0	0	0	0	0	111.8	K194 E212	K194-G216 PolarHBondContact NZ-O 2.95Å; E212-G216 WeakPolarHBondContact O-CA 3.48Å; E212-G216 PolarHBondContact O-N 3.1Å
217	L	98.1	Very high	97.4	Very high	22 Å²	22	61 Å²	61	12%	0.115	35%	0.348	C	S	.	.			trans	-126.1	163.7	-179.1	-54	175.8	0	0	0	109.6	L182 A190 K194 V200 F202 E212 L215	L182-L217 HydrophobicContact CD1-CD1 4.03Å; L182-L217 HydrophobicContact CD2-CD1 3.96Å; A190-L217 HydrophobicContact CB-CD1 3.79Å; A190-L217 HydrophobicContact CB-CD2 3.98Å; K194-L217 HydrophobicContact CD-CD2 3.79Å; V200-L217 HydrophobicContact CB-CD2 3.92Å; V200-L217 HydrophobicContact CG1-CD2 3.93Å; F202-L217 HydrophobicContact CD1-CB 4.17Å; F202-L217 HydrophobicContact CD1-CD1 4.46Å; F202-L217 HydrophobicContact CE1-CB 4.2Å; E212-L217 PolarHBondContact O-N 2.87Å; L215-L217 HydrophobicContact CB-CD1 3.68Å; L215-L217 HydrophobicContact CB-CG 3.73Å; L215-L217 HydrophobicContact CD1-CD1 3.92Å; L215-L217 HydrophobicContact CG-CD1 4.47Å
218	Q	98.2	Very high	97.5	Very high	93 Å²	93	64.8 Å²	64.8	44%	0.435	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.3	173.5	176.6	177.1	-11.5	0	0	110.6	V200 L201 F202	V200-Q218 PolarHBondContact O-N 3.05Å; L201-Q218 CarbonylContact C-O 3.53Å; L201-Q218 WeakPolarHBondContact CA-O 3.32Å; L201-Q218 HydrophobicContact CD1-CB 4.38Å; L201-Q218 HydrophobicContact CD2-CG 4.44Å; L201-Q218 HydrophobicContact CG-CB 3.99Å; L201-Q218 HydrophobicContact CG-CG 3.96Å; F202-Q218 WeakPolarHBondContact CD1-O 3.04Å; F202-Q218 PolarHBondContact N-O 3.08Å
219	R	98.6	Very high	97.6	Very high	60 Å²	60	63.6 Å²	63.6	23%	0.226	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	145.5	169.8	-166.5	173	-171.5	178.6	7.7	110.1	F202 D204 L207 D209 E212	F202-R219 HydrophobicContact CD1-CB 4.38Å; F202-R219 HydrophobicContact CD2-CG 4.35Å; F202-R219 HydrophobicContact CE1-CB 3.66Å; F202-R219 HydrophobicContact CE1-CG 4.08Å; F202-R219 HydrophobicContact CE2-CB 4.22Å; F202-R219 HydrophobicContact CE2-CG 3.69Å; F202-R219 HydrophobicContact CZ-CB 3.57Å; F202-R219 HydrophobicContact CZ-CG 3.53Å; D204-R219 PolarHBondContact O-NH2 3.39Å; L207-R219 PolarHBondContact O-NH1 3.11Å; L207-R219 PolarHBondContact O-NH2 3.49Å; D209-R219 IonicContact OD1-CZ 3.72Å; D209-R219 IonicContact OD1-NH1 3.67Å; D209-R219 PolarHBondContact OD1-NH1 3.06Å; E212-R219 HydrophobicContact CB-CB 3.97Å; E212-R219 HydrophobicContact CG-CB 4.24Å
220	V	98.5	Very high	97.8	Very high	15 Å²	15	57.6 Å²	57.6	9%	0.091	31%	0.313	C	S	.	.			trans	-123.4	150.4	164.3	-64.9	0	0	0	0	111.1	L201 F202 D225 L226	L201-V220 HydrophobicContact CD2-CG1 3.9Å; F202-V220 PolarHBondContact O-N 2.93Å; V220-D225 HydrophobicContact CB-CB 3.81Å; V220-D225 HydrophobicContact CG1-CB 4.15Å; V220-D225 HydrophobicContact CG2-CB 4.1Å; V220-L226 HydrophobicContact CG2-CB 3.81Å
221	S	97.6	Very high	98	Very high	111 Å²	111	58 Å²	58	78%	0.776	31%	0.311	S	S	*	.	S	Bend	trans	-86.5	-17.2	-170.7	-53	0	0	0	0	114	Y203	Y203-S221 WeakPolarHBondContact CE2-O 3.46Å
222	T	98.5	Very high	98.1	Very high	57 Å²	57	56.7 Å²	56.7	35%	0.35	30%	0.302	S	S	.	.	S	Bend	trans	-129.5	156.3	178.9	80	0	0	0	0	112.1	Y203 Q224 D225 L226	Y203-T222 VanDerWaalsContact CD2-C 3.48Å; T222-Q224 VanDerWaalsContact C-N 3.31Å; T222-Q224 PolarHBondContact OG1-N 3.35Å; T222-D225 WeakPolarHBondContact CB-OD2 3.41Å; T222-D225 WeakPolarHBondContact CG2-OD2 3.42Å; T222-D225 PolarHBondContact N-OD2 3.19Å; T222-D225 PolarHBondContact O-N 3.4Å; T222-D225 PolarHBondContact OG1-N 2.9Å; T222-D225 PolarHBondContact OG1-OD2 2.87Å; T222-L226 PolarHBondContact O-N 3.22Å
223	L	98.6	Very high	98.2	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.126	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-41.6	170.1	177.7	63.6	0	0	0	111.3	I180 Y203 D225 L226 L227 L246 T251	I180-L223 HydrophobicContact CD1-CD1 3.48Å; I180-L223 VanDerWaalsContact CD1-CD1 3.48Å; I180-L223 HydrophobicContact CG1-CD1 4.11Å; Y203-L223 HydrophobicContact CD1-CB 4.14Å; Y203-L223 HydrophobicContact CD1-CD1 4.2Å; Y203-L223 HydrophobicContact CE1-CB 3.95Å; L223-D225 VanDerWaalsContact C-N 3.33Å; L223-D225 PolarHBondContact O-N 3.46Å; L223-L226 WeakPolarHBondContact O-CB 3.44Å; L223-L226 PolarHBondContact O-N 2.97Å; L223-L226 VanDerWaalsContact O-N 3.09Å; L223-L227 HydrophobicContact CD1-CD1 4.07Å; L223-L227 HydrophobicContact CD1-CD2 4.3Å; L223-L227 HydrophobicContact CD1-CG 4.05Å; L223-L227 HydrophobicContact CD2-CD1 4.32Å; L223-L227 HydrophobicContact CG-CD1 3.82Å; L223-L227 HydrophobicContact CG-CG 4.19Å; L223-L227 WeakPolarHBondContact O-CG 3.28Å; L223-L227 PolarHBondContact O-N 3.15Å; L223-L246 HydrophobicContact CD2-CD1 3.75Å; L223-L246 HydrophobicContact CD2-CG 4.07Å; L223-T251 HydrophobicContact CD2-CG2 3.88Å
224	Q	98.5	Very high	98.3	Very high	116 Å²	116	46.2 Å²	46.2	54%	0.542	26%	0.262	S	S	.	.	H	α-helix	trans	-59	-43.2	-179.8	179.9	178.5	-26.3	0	0	111.8	T222 L226 L227 F228	T222-Q224 VanDerWaalsContact C-N 3.31Å; T222-Q224 PolarHBondContact OG1-N 3.35Å; Q224-L226 VanDerWaalsContact C-N 3.28Å; Q224-L226 PolarHBondContact O-N 3.47Å; Q224-L227 PolarHBondContact O-N 3.14Å; Q224-F228 VanDerWaalsContact O-CB 3.28Å; Q224-F228 WeakPolarHBondContact O-CB 3.37Å; Q224-F228 PolarHBondContact O-N 3.29Å
225	D	98.4	Very high	98.4	Very high	62 Å²	62	42.2 Å²	42.2	33%	0.332	23%	0.229	S	C	.	.	H	α-helix	trans	-59.7	-39.9	176.1	-66.1	-53.1	0	0	0	111.6	V220 T222 L223 H229	V220-D225 HydrophobicContact CB-CB 3.81Å; V220-D225 HydrophobicContact CG1-CB 4.15Å; V220-D225 HydrophobicContact CG2-CB 4.1Å; T222-D225 WeakPolarHBondContact CB-OD2 3.41Å; T222-D225 WeakPolarHBondContact CG2-OD2 3.42Å; T222-D225 PolarHBondContact N-OD2 3.19Å; T222-D225 PolarHBondContact O-N 3.4Å; T222-D225 PolarHBondContact OG1-N 2.9Å; T222-D225 PolarHBondContact OG1-OD2 2.87Å; L223-D225 VanDerWaalsContact C-N 3.33Å; L223-D225 PolarHBondContact O-N 3.46Å; D225-H229 WeakPolarHBondContact O-CB 3.26Å; D225-H229 PolarHBondContact O-N 3.12Å; D225-H229 PolarHBondContact O-ND1 2.76Å
226	L	98.8	Very high	98.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.5	-51.2	177.4	-174.5	146.1	0	0	0	111.1	I179 I180 Y203 V220 T222 L223 Q224 F228 H229 S230 V233	I179-L226 WeakPolarHBondContact O-CD1 3.48Å; I180-L226 HydrophobicContact CD1-CD2 4.01Å; I180-L226 HydrophobicContact CG1-CD1 3.98Å; I180-L226 HydrophobicContact CG1-CD2 3.79Å; Y203-L226 VanDerWaalsContact N-CD1 3.31Å; V220-L226 HydrophobicContact CG2-CB 3.81Å; T222-L226 PolarHBondContact O-N 3.22Å; L223-L226 WeakPolarHBondContact O-CB 3.44Å; L223-L226 PolarHBondContact O-N 2.97Å; L223-L226 VanDerWaalsContact O-N 3.09Å; Q224-L226 VanDerWaalsContact C-N 3.28Å; Q224-L226 PolarHBondContact O-N 3.47Å; L226-F228 VanDerWaalsContact C-N 3.3Å; L226-F228 PolarHBondContact O-N 3.24Å; L226-H229 PolarHBondContact O-N 3.48Å; L226-S230 VanDerWaalsContact O-CB 3.26Å; L226-S230 WeakPolarHBondContact O-CB 3.28Å; L226-S230 PolarHBondContact O-N 3.29Å; L226-S230 PolarHBondContact O-OG 2.84Å; L226-V233 HydrophobicContact CD2-CG1 4.1Å; L226-V233 HydrophobicContact CD2-CG2 4.1Å
227	L	98.8	Very high	98.6	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-38	-175.9	-60.8	177.3	0	0	0	111.7	I180 L223 Q224 V233 I247 T251 Q254 M255 R256	I180-L227 HydrophobicContact CD1-CD2 4.2Å; L223-L227 HydrophobicContact CD1-CD1 4.07Å; L223-L227 HydrophobicContact CD1-CD2 4.3Å; L223-L227 HydrophobicContact CD1-CG 4.05Å; L223-L227 HydrophobicContact CD2-CD1 4.32Å; L223-L227 HydrophobicContact CG-CD1 3.82Å; L223-L227 HydrophobicContact CG-CG 4.19Å; L223-L227 WeakPolarHBondContact O-CG 3.28Å; L223-L227 PolarHBondContact O-N 3.15Å; Q224-L227 PolarHBondContact O-N 3.14Å; L227-V233 HydrophobicContact CD2-CG1 4.04Å; L227-V233 HydrophobicContact CD2-CG2 3.89Å; L227-I247 HydrophobicContact CD2-CD1 4.2Å; L227-T251 HydrophobicContact CD1-CG2 4.41Å; L227-T251 WeakPolarHBondContact CD1-O 3.32Å; L227-Q254 CarbonylContact C-O 3.51Å; L227-Q254 VanDerWaalsContact C-O 3.31Å; L227-Q254 HydrophobicContact CB-CB 4.14Å; L227-Q254 HydrophobicContact CD1-CB 4.21Å; L227-M255 HydrophobicContact CB-CG 4.16Å; L227-M255 HydrophobicContact CD2-CG 3.95Å; L227-M255 HydrophobicContact CG-CG 4.43Å; L227-M255 WeakPolarHBondContact O-CA 3.48Å; L227-R256 PolarHBondContact O-N 2.86Å
228	F	98.3	Very high	98.6	Very high	133 Å²	133	41.4 Å²	41.4	58%	0.583	23%	0.225	S	C	*	.	H	α-helix	trans	-70.2	-32.6	178	-176.5	-97.8	0	0	0	113.5	Q224 L226 Q254 R256	Q224-F228 VanDerWaalsContact O-CB 3.28Å; Q224-F228 WeakPolarHBondContact O-CB 3.37Å; Q224-F228 PolarHBondContact O-N 3.29Å; L226-F228 VanDerWaalsContact C-N 3.3Å; L226-F228 PolarHBondContact O-N 3.24Å; F228-Q254 WeakPolarHBondContact CA-O 3.34Å; F228-Q254 PolarHBondContact N-O 2.88Å; F228-R256 VanDerWaalsContact O-CG 3.24Å; F228-R256 WeakPolarHBondContact O-CG 3.39Å; F228-R256 PolarHBondContact O-NE 3.32Å
229	H	98.5	Very high	98.6	Very high	73 Å²	73	39 Å²	39	34%	0.338	22%	0.215	S	C	.	.	H	α-helix	trans	-92	-11.3	-178.6	-68.5	97.2	0	0	0	114.6	T176 L201 D225 L226 R256	T176-H229 VanDerWaalsContact CB-O 3.26Å; T176-H229 WeakPolarHBondContact CB-O 3.4Å; T176-H229 WeakPolarHBondContact CG2-O 3.48Å; L201-H229 HydrophobicContact CD2-CB 3.87Å; D225-H229 WeakPolarHBondContact O-CB 3.26Å; D225-H229 PolarHBondContact O-N 3.12Å; D225-H229 PolarHBondContact O-ND1 2.76Å; L226-H229 PolarHBondContact O-N 3.48Å; H229-R256 VanDerWaalsContact C-CZ 3.49Å; H229-R256 PolarHBondContact O-NE 2.82Å; H229-R256 PolarHBondContact O-NH1 2.87Å; H229-R256 PolarHBondContact O-NH2 2.8Å; H229-R256 VanDerWaalsContact O-NH2 3.12Å
230	S	98.8	Very high	98.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.			trans	-99.3	133.2	-170.7	-56.1	0	0	0	0	113.9	G178 L226 R256	G178-S230 WeakPolarHBondContact CA-OG 3.27Å; G178-S230 PolarHBondContact N-OG 3.13Å; L226-S230 VanDerWaalsContact O-CB 3.26Å; L226-S230 WeakPolarHBondContact O-CB 3.28Å; L226-S230 PolarHBondContact O-N 3.29Å; L226-S230 PolarHBondContact O-OG 2.84Å; S230-R256 WeakPolarHBondContact O-CD 3.09Å; S230-R256 WeakPolarHBondContact O-CG 3.45Å
231	D	98.8	Very high	98.3	Very high	31 Å²	31	46.3 Å²	46.3	17%	0.166	25%	0.253	C	S	.	.	S	Bend	trans	-88	-26.1	172.5	-54	-60	0	0	0	111.1	E175 T176 R256 A259 F260	E175-D231 HydrophobicContact CB-CB 4.4Å; T176-D231 WeakPolarHBondContact CA-OD2 3.47Å; T176-D231 WeakPolarHBondContact CB-OD2 3.17Å; T176-D231 PolarHBondContact N-OD2 2.77Å; T176-D231 PolarHBondContact O-N 2.91Å; T176-D231 PolarHBondContact OG1-OD2 2.69Å; D231-R256 VanDerWaalsContact OD1-CD 3.22Å; D231-R256 WeakPolarHBondContact OD1-CD 3.32Å; D231-R256 IonicContact OD1-CZ 2.77Å; D231-R256 IonicContact OD1-NE 3.08Å; D231-R256 IonicContact OD1-NH1 2.7Å; D231-R256 PolarHBondContact OD1-NH1 2.9Å; D231-R256 IonicContact OD2-NH1 3.19Å; D231-R256 PolarHBondContact OD2-NH1 3.34Å; D231-R256 VanDerWaalsContact OD2-NH1 3.08Å; D231-A259 CarbonylContact O-C 3.49Å; D231-A259 VanDerWaalsContact O-CA 3.25Å; D231-A259 WeakPolarHBondContact O-CA 3.35Å; D231-A259 WeakPolarHBondContact O-CB 3.4Å; D231-F260 PolarHBondContact O-N 2.85Å
232	C	98.9	Very high	98.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	131.6	166	-176	0	0	0	0	109.8	Y140 T176 L177 G178 F260	Y140-C232 HydrophobicContact CE2-CB 3.84Å; T176-C232 PolarHBondContact O-N 2.92Å; L177-C232 CarbonylContact C-O 3.59Å; L177-C232 WeakPolarHBondContact CA-O 3.33Å; L177-C232 HydrophobicContact CD1-CB 3.95Å; G178-C232 PolarHBondContact N-O 2.76Å; C232-F260 WeakPolarHBondContact CA-O 3.23Å; C232-F260 HydrophobicContact CB-CB 4.06Å
233	V	99	Very high	98.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.3	174.6	177.3	0	0	0	0	109	G178 I180 L226 L227 L235 M255 F260 L261 V262	G178-V233 CarbonylContact O-C 3.58Å; G178-V233 WeakPolarHBondContact O-CA 3.3Å; I180-V233 HydrophobicContact CD1-CG1 3.67Å; I180-V233 HydrophobicContact CG1-CG1 4.34Å; L226-V233 HydrophobicContact CD2-CG1 4.1Å; L226-V233 HydrophobicContact CD2-CG2 4.1Å; L227-V233 HydrophobicContact CD2-CG1 4.04Å; L227-V233 HydrophobicContact CD2-CG2 3.89Å; V233-L235 HydrophobicContact CG1-CD2 4.33Å; V233-M255 HydrophobicContact CB-CE 4.21Å; V233-M255 HydrophobicContact CG2-CE 3.98Å; V233-F260 PolarHBondContact N-O 3.06Å; V233-L261 HydrophobicContact CB-CD1 4.08Å; V233-L261 HydrophobicContact CG1-CD1 4.05Å; V233-L261 CarbonylContact O-C 3.56Å; V233-L261 WeakPolarHBondContact O-CA 3.33Å; V233-V262 PolarHBondContact O-N 3.1Å
234	T	99	Very high	98.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.5	176.9	-172	0	0	0	0	112	T132 L177 G178 I179 I180 V189 H236 V262	T132-T234 WeakPolarHBondContact CG2-OG1 3.32Å; L177-T234 HydrophobicContact CD1-CG2 3.92Å; L177-T234 HydrophobicContact CG-CG2 4.37Å; G178-T234 PolarHBondContact O-N 3.47Å; I179-T234 HydrophobicContact CB-CG2 4.42Å; I179-T234 HydrophobicContact CG1-CG2 3.69Å; I180-T234 PolarHBondContact N-O 3.34Å; V189-T234 HydrophobicContact CG1-CG2 4.43Å; T234-H236 WeakPolarHBondContact CG2-NE2 3.42Å; T234-H236 PolarHBondContact OG1-CE1 3.45Å; T234-H236 VanDerWaalsContact OG1-CE1 3.24Å; T234-H236 PolarHBondContact OG1-NE2 3.01Å; T234-V262 WeakPolarHBondContact CA-O 3.44Å
235	L	98.9	Very high	98.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.6	-173.8	-53.9	-173.9	0	0	0	111.7	I180 V233 I247 V262 N263 A265 L269 V270	I180-L235 HydrophobicContact CB-CD2 3.9Å; I180-L235 HydrophobicContact CD1-CD2 3.62Å; I180-L235 HydrophobicContact CG1-CD2 4.25Å; I180-L235 HydrophobicContact CG2-CD2 4.29Å; V233-L235 HydrophobicContact CG1-CD2 4.33Å; L235-I247 HydrophobicContact CD1-CG1 4.04Å; L235-I247 HydrophobicContact CD2-CD1 4.37Å; L235-I247 HydrophobicContact CD2-CG1 4.12Å; L235-V262 PolarHBondContact N-O 3Å; L235-N263 HydrophobicContact CD1-CB 4.2Å; L235-A265 HydrophobicContact CB-CB 4.43Å; L235-A265 VanDerWaalsContact O-CB 3.3Å; L235-A265 WeakPolarHBondContact O-CB 3.49Å; L235-L269 HydrophobicContact CB-CD1 4.4Å; L235-L269 HydrophobicContact CD1-CB 3.98Å; L235-L269 HydrophobicContact CD1-CD1 4.44Å; L235-V270 HydrophobicContact CD1-CG2 3.47Å; L235-V270 VanDerWaalsContact CD1-CG2 3.47Å
236	H	98.9	Very high	98.3	Very high	20 Å²	20	45.1 Å²	45.1	9%	0.093	23%	0.229	C	C	.	.			trans	-136.4	14.5	179.2	-58	-47.2	0	0	0	113.6	T132 I180 T234 T264	T132-H236 VanDerWaalsContact CG2-CE1 3.46Å; T132-H236 WeakPolarHBondContact CG2-CE1 3.37Å; T132-H236 PolarHBondContact OG1-CE1 2.75Å; I180-H236 CarbonylContact O-C 3.27Å; I180-H236 PolarHBondContact O-N 3.13Å; T234-H236 WeakPolarHBondContact CG2-NE2 3.42Å; T234-H236 PolarHBondContact OG1-CE1 3.45Å; T234-H236 VanDerWaalsContact OG1-CE1 3.24Å; T234-H236 PolarHBondContact OG1-NE2 3.01Å; H236-T264 PolarHBondContact CE1-OG1 2.9Å
237	C	98.5	Very high	98.3	Very high	24 Å²	24	45.1 Å²	45.1	16%	0.162	23%	0.229	C	C	.	.	S	Bend	trans	-82.7	153.7	169.3	59.4	0	0	0	0	111.5	I180 A265	I180-C237 PolarHBondContact O-N 2.91Å; I180-C237 VanDerWaalsContact O-N 3.1Å; C237-A265 WeakPolarHBondContact O-CB 3.49Å
238	G	97.7	Very high	98.3	Very high	50 Å²	50	47.3 Å²	47.3	52%	0.515	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-78.7	143.9	171	0	0	0	0	0	111.6	N240 N243	G238-N240 PolarHBondContact O-ND2 3.35Å; G238-N243 PolarHBondContact O-ND2 2.84Å
239	L	98.3	Very high	98.3	Very high	42 Å²	42	45.3 Å²	45.3	22%	0.22	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.4	136.2	172	-177.5	62.2	0	0	0	110.3	D103 N243 H244 R266 L269	D103-L239 HydrophobicContact CB-CB 4.05Å; L239-N243 WeakPolarHBondContact CA-OD1 3.15Å; L239-H244 HydrophobicContact CD1-CB 4.41Å; L239-R266 HydrophobicContact CB-CB 3.86Å; L239-R266 HydrophobicContact CB-CG 3.81Å; L239-R266 HydrophobicContact CD2-CB 4.29Å; L239-L269 HydrophobicContact CB-CD2 4.37Å; L239-L269 HydrophobicContact CD1-CD2 3.92Å; L239-L269 HydrophobicContact CD1-CG 4.37Å
240	N	96.2	Very high	98.3	Very high	57 Å²	57	48.5 Å²	48.5	31%	0.305	25%	0.249	S	C	.	.			trans	-156.7	176.3	-179.3	63	73.3	0	0	0	111	G238 H242 N243	G238-N240 PolarHBondContact O-ND2 3.35Å; N240-H242 PolarHBondContact O-N 3.49Å; N240-H242 WeakPolarHBondContact OD1-CB 3.15Å; N240-H242 PolarHBondContact OD1-N 2.8Å; N240-N243 PolarHBondContact N-OD1 2.9Å; N240-N243 VanDerWaalsContact ND2-CG 3.33Å; N240-N243 PolarHBondContact ND2-ND2 3.03Å; N240-N243 VanDerWaalsContact ND2-ND2 3.11Å; N240-N243 PolarHBondContact ND2-OD1 3.23Å; N240-N243 PolarHBondContact O-N 3Å; N240-N243 PolarHBondContact O-OD1 3.22Å
241	E	95	Very high	98.3	Very high	172 Å²	172	49 Å²	49	80%	0.804	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-6.1	-177.1	57	172.9	-178.3	0	0	115.8
242	H	97.4	Very high	98.3	Very high	137 Å²	137	47.7 Å²	47.7	63%	0.634	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-4.9	-179.6	-57	-23.5	0	0	0	114.5	N240	N240-H242 PolarHBondContact O-N 3.49Å; N240-H242 WeakPolarHBondContact OD1-CB 3.15Å; N240-H242 PolarHBondContact OD1-N 2.8Å
243	N	98.5	Very high	98.2	Very high	12 Å²	12	53.1 Å²	53.1	6%	0.064	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	16.4	-176.1	72.9	-3.4	0	0	0	115.3	G238 L239 N240 H245 L246 L269	G238-N243 PolarHBondContact O-ND2 2.84Å; L239-N243 WeakPolarHBondContact CA-OD1 3.15Å; N240-N243 PolarHBondContact N-OD1 2.9Å; N240-N243 VanDerWaalsContact ND2-CG 3.33Å; N240-N243 PolarHBondContact ND2-ND2 3.03Å; N240-N243 VanDerWaalsContact ND2-ND2 3.11Å; N240-N243 PolarHBondContact ND2-OD1 3.23Å; N240-N243 PolarHBondContact O-N 3Å; N240-N243 PolarHBondContact O-OD1 3.22Å; N243-H245 PolarHBondContact O-N 3.33Å; N243-L246 HydrophobicContact CB-CB 4.27Å; N243-L246 HydrophobicContact CB-CD1 4.18Å; N243-L246 HydrophobicContact CB-CD2 4.38Å; N243-L246 WeakPolarHBondContact O-CB 3.26Å; N243-L246 PolarHBondContact O-N 3.33Å; N243-L246 VanDerWaalsContact O-N 3.12Å; N243-L269 HydrophobicContact CB-CD2 4.3Å; N243-L269 WeakPolarHBondContact ND2-CD2 3.42Å
244	H	98.5	Very high	98.2	Very high	127 Å²	127	55 Å²	55	59%	0.588	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	126.9	165.8	-172	-82.3	0	0	0	110.4	L239 L246 G268	L239-H244 HydrophobicContact CD1-CB 4.41Å; H244-L246 VanDerWaalsContact C-N 3.31Å; H244-L246 PolarHBondContact O-N 2.86Å; H244-G268 CarbonylContact C-O 3.54Å; H244-G268 WeakPolarHBondContact CA-O 3.41Å
245	H	98.7	Very high	98.2	Very high	37 Å²	37	55.5 Å²	55.5	17%	0.171	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	45.2	-170.8	-67.3	-149.5	0	0	0	112.6	N243 I247 N248 G268 L269 D271 E293	N243-H245 PolarHBondContact O-N 3.33Å; H245-I247 PolarHBondContact O-N 2.81Å; H245-N248 HydrophobicContact CB-CB 4.41Å; H245-N248 WeakPolarHBondContact O-CB 3.29Å; H245-N248 PolarHBondContact O-ND2 3.48Å; H245-G268 PolarHBondContact N-O 3.09Å; H245-L269 CarbonylContact C-O 3.49Å; H245-D271 HydrophobicContact CB-CB 4.31Å; H245-D271 IonicContact CE1-OD2 3.96Å; H245-D271 PolarHBondContact CE1-OD2 2.83Å; H245-D271 VanDerWaalsContact ND1-CB 3.3Å; H245-D271 WeakPolarHBondContact ND1-CB 3.41Å; H245-D271 IonicContact ND1-OD2 3.77Å; H245-D271 PolarHBondContact ND1-OD2 2.78Å; H245-E293 IonicContact CE1-OE1 3.46Å; H245-E293 IonicContact NE2-OE1 2.69Å
246	L	98.8	Very high	98.1	Very high	32 Å²	32	59.6 Å²	59.6	17%	0.168	30%	0.296	C	S	.	.	S	Bend	trans	-53.5	-39.5	172.7	-171.3	66.4	0	0	0	112.5	I180 L223 N243 H244 T251 L269	I180-L246 HydrophobicContact CG2-CD2 3.69Å; L223-L246 HydrophobicContact CD2-CD1 3.75Å; L223-L246 HydrophobicContact CD2-CG 4.07Å; N243-L246 HydrophobicContact CB-CB 4.27Å; N243-L246 HydrophobicContact CB-CD1 4.18Å; N243-L246 HydrophobicContact CB-CD2 4.38Å; N243-L246 WeakPolarHBondContact O-CB 3.26Å; N243-L246 PolarHBondContact O-N 3.33Å; N243-L246 VanDerWaalsContact O-N 3.12Å; H244-L246 VanDerWaalsContact C-N 3.31Å; H244-L246 PolarHBondContact O-N 2.86Å; L246-T251 PolarHBondContact O-OG1 3.11Å; L246-L269 PolarHBondContact N-O 3.15Å
247	I	98.8	Very high	98.1	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.005	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-96.6	107.1	169.1	-54.8	-56.1	0	0	0	107.8	I180 L227 L235 H245 T251 V252 L261 L269 V270 D271	I180-I247 HydrophobicContact CD1-CD1 4.21Å; L227-I247 HydrophobicContact CD2-CD1 4.2Å; L235-I247 HydrophobicContact CD1-CG1 4.04Å; L235-I247 HydrophobicContact CD2-CD1 4.37Å; L235-I247 HydrophobicContact CD2-CG1 4.12Å; H245-I247 PolarHBondContact O-N 2.81Å; I247-T251 WeakPolarHBondContact CA-OG1 3.47Å; I247-V252 HydrophobicContact CG2-CG2 3.49Å; I247-V252 VanDerWaalsContact CG2-CG2 3.49Å; I247-L261 HydrophobicContact CG2-CD2 4.08Å; I247-L269 PolarHBondContact N-O 3.03Å; I247-V270 HydrophobicContact CB-CB 4.42Å; I247-V270 HydrophobicContact CB-CG1 4.25Å; I247-V270 HydrophobicContact CB-CG2 4.12Å; I247-V270 HydrophobicContact CG1-CG2 4.34Å; I247-V270 HydrophobicContact CG2-CG1 4.19Å; I247-V270 WeakPolarHBondContact O-CA 3.36Å; I247-D271 PolarHBondContact O-N 2.71Å
248	N	98.7	Very high	98.1	Very high	46 Å²	46	64.8 Å²	64.8	25%	0.246	32%	0.322	C	S	.	.	S	Bend	trans	-141.4	178.3	-174.4	60.1	59.3	0	0	0	110.9	H245 F250 T251 V252 D271	H245-N248 HydrophobicContact CB-CB 4.41Å; H245-N248 WeakPolarHBondContact O-CB 3.29Å; H245-N248 PolarHBondContact O-ND2 3.48Å; N248-F250 PolarHBondContact O-N 2.6Å; N248-F250 WeakPolarHBondContact OD1-CA 3.26Å; N248-F250 WeakPolarHBondContact OD1-CB 3.21Å; N248-F250 PolarHBondContact OD1-N 3.46Å; N248-T251 PolarHBondContact N-OG1 3.06Å; N248-T251 PolarHBondContact O-N 2.91Å; N248-T251 VanDerWaalsContact O-N 3.13Å; N248-T251 PolarHBondContact O-OG1 3.03Å; N248-T251 PolarHBondContact OD1-N 2.88Å; N248-T251 VanDerWaalsContact OD1-N 3.1Å; N248-T251 PolarHBondContact OD1-OG1 3.42Å; N248-V252 WeakPolarHBondContact O-CB 3.45Å; N248-V252 WeakPolarHBondContact O-CG2 3.19Å; N248-V252 PolarHBondContact O-N 2.83Å; N248-D271 HydrophobicContact CB-CB 4.29Å
249	D	98.1	Very high	98.1	Very high	91 Å²	91	62.5 Å²	62.5	49%	0.487	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-30.1	-178.5	173.1	75.7	0	0	0	114.5	K253 A274	D249-K253 WeakPolarHBondContact O-CD 3.37Å; D249-K253 WeakPolarHBondContact O-CE 3.29Å; D249-K253 VanDerWaalsContact O-CG 3.28Å; D249-K253 WeakPolarHBondContact O-CG 3.47Å; D249-K253 WeakPolarHBondContact OD1-CE 2.99Å; D249-K253 IonicContact OD1-NZ 3.15Å; D249-K253 PolarHBondContact OD1-NZ 2.85Å; D249-K253 IonicContact OD2-NZ 2.7Å; D249-K253 PolarHBondContact OD2-NZ 3.06Å; D249-A274 HydrophobicContact CB-CB 4.15Å
250	F	98.6	Very high	98.2	Very high	139 Å²	139	60.6 Å²	60.6	61%	0.61	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-49.8	175.4	178.7	-102.9	0	0	0	112.4	N248 K253	N248-F250 PolarHBondContact O-N 2.6Å; N248-F250 WeakPolarHBondContact OD1-CA 3.26Å; N248-F250 WeakPolarHBondContact OD1-CB 3.21Å; N248-F250 PolarHBondContact OD1-N 3.46Å; F250-K253 WeakPolarHBondContact O-CB 3.33Å; F250-K253 PolarHBondContact O-N 3.05Å
251	T	98.5	Very high	98.3	Very high	12 Å²	12	57.9 Å²	57.9	7%	0.074	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-72.1	-31	-178	50.1	0	0	0	0	112.6	L223 L227 L246 I247 N248 K253 Q254 M255	L223-T251 HydrophobicContact CD2-CG2 3.88Å; L227-T251 HydrophobicContact CD1-CG2 4.41Å; L227-T251 WeakPolarHBondContact CD1-O 3.32Å; L246-T251 PolarHBondContact O-OG1 3.11Å; I247-T251 WeakPolarHBondContact CA-OG1 3.47Å; N248-T251 PolarHBondContact N-OG1 3.06Å; N248-T251 PolarHBondContact O-N 2.91Å; N248-T251 VanDerWaalsContact O-N 3.13Å; N248-T251 PolarHBondContact O-OG1 3.03Å; N248-T251 PolarHBondContact OD1-N 2.88Å; N248-T251 VanDerWaalsContact OD1-N 3.1Å; N248-T251 PolarHBondContact OD1-OG1 3.42Å; T251-K253 PolarHBondContact O-N 3.14Å; T251-Q254 WeakPolarHBondContact O-CA 3.31Å; T251-Q254 WeakPolarHBondContact O-CB 3.32Å; T251-Q254 PolarHBondContact O-N 2.85Å; T251-M255 PolarHBondContact O-N 2.95Å
252	V	98.5	Very high	98.5	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.018	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-61.5	-26	171.3	170.2	0	0	0	0	112.3	I247 N248 Q254 A278 R283 I284	I247-V252 HydrophobicContact CG2-CG2 3.49Å; I247-V252 VanDerWaalsContact CG2-CG2 3.49Å; N248-V252 WeakPolarHBondContact O-CB 3.45Å; N248-V252 WeakPolarHBondContact O-CG2 3.19Å; N248-V252 PolarHBondContact O-N 2.83Å; V252-Q254 VanDerWaalsContact C-N 3.3Å; V252-A278 HydrophobicContact CG1-CB 3.44Å; V252-A278 VanDerWaalsContact CG1-CB 3.44Å; V252-R283 WeakPolarHBondContact O-CD 3.48Å; V252-I284 HydrophobicContact CG1-CD1 4.06Å
253	K	97.9	Very high	98.6	Very high	114 Å²	114	43.2 Å²	43.2	50%	0.496	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-79.9	-8.7	172.9	-68.1	165.2	-167.7	163.4	0	113.6	D249 F250 T251	D249-K253 WeakPolarHBondContact O-CD 3.37Å; D249-K253 WeakPolarHBondContact O-CE 3.29Å; D249-K253 VanDerWaalsContact O-CG 3.28Å; D249-K253 WeakPolarHBondContact O-CG 3.47Å; D249-K253 WeakPolarHBondContact OD1-CE 2.99Å; D249-K253 IonicContact OD1-NZ 3.15Å; D249-K253 PolarHBondContact OD1-NZ 2.85Å; D249-K253 IonicContact OD2-NZ 2.7Å; D249-K253 PolarHBondContact OD2-NZ 3.06Å; F250-K253 WeakPolarHBondContact O-CB 3.33Å; F250-K253 PolarHBondContact O-N 3.05Å; T251-K253 PolarHBondContact O-N 3.14Å
254	Q	98.3	Very high	98.6	Very high	38 Å²	38	43.3 Å²	43.3	18%	0.178	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-13.1	173.1	-55.3	-177.9	-14.3	0	0	112.7	L227 F228 T251 V252	L227-Q254 CarbonylContact C-O 3.51Å; L227-Q254 VanDerWaalsContact C-O 3.31Å; L227-Q254 HydrophobicContact CB-CB 4.14Å; L227-Q254 HydrophobicContact CD1-CB 4.21Å; F228-Q254 WeakPolarHBondContact CA-O 3.34Å; F228-Q254 PolarHBondContact N-O 2.88Å; T251-Q254 WeakPolarHBondContact O-CA 3.31Å; T251-Q254 WeakPolarHBondContact O-CB 3.32Å; T251-Q254 PolarHBondContact O-N 2.85Å; V252-Q254 VanDerWaalsContact C-N 3.3Å
255	M	98.7	Very high	98.6	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.059	18%	0.183	C	C	.	.	S	Bend	trans	-69.4	151.1	175	-66.1	179.3	68.8	0	0	111.6	L227 V233 T251 A259 L261 I284	L227-M255 HydrophobicContact CB-CG 4.16Å; L227-M255 HydrophobicContact CD2-CG 3.95Å; L227-M255 HydrophobicContact CG-CG 4.43Å; L227-M255 WeakPolarHBondContact O-CA 3.48Å; V233-M255 HydrophobicContact CB-CE 4.21Å; V233-M255 HydrophobicContact CG2-CE 3.98Å; T251-M255 PolarHBondContact O-N 2.95Å; M255-A259 HydrophobicContact CE-CB 4.19Å; M255-L261 HydrophobicContact CE-CB 4.36Å; M255-L261 HydrophobicContact CE-CD1 4.47Å; M255-I284 HydrophobicContact CE-CD1 4.19Å; M255-I284 HydrophobicContact CE-CG1 4.26Å; M255-I284 HydrophobicContact SD-CD1 3.98Å; M255-I284 HydrophobicContact SD-CG1 4.37Å
256	R	98.3	Very high	98.6	Very high	86 Å²	86	37.6 Å²	37.6	33%	0.325	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-58.6	140.9	171.1	-68.5	-172.6	170.5	177.2	0.4	111.6	L227 F228 H229 S230 D231 G258 A259	L227-R256 PolarHBondContact O-N 2.86Å; F228-R256 VanDerWaalsContact O-CG 3.24Å; F228-R256 WeakPolarHBondContact O-CG 3.39Å; F228-R256 PolarHBondContact O-NE 3.32Å; H229-R256 VanDerWaalsContact C-CZ 3.49Å; H229-R256 PolarHBondContact O-NE 2.82Å; H229-R256 PolarHBondContact O-NH1 2.87Å; H229-R256 PolarHBondContact O-NH2 2.8Å; H229-R256 VanDerWaalsContact O-NH2 3.12Å; S230-R256 WeakPolarHBondContact O-CD 3.09Å; S230-R256 WeakPolarHBondContact O-CG 3.45Å; D231-R256 VanDerWaalsContact OD1-CD 3.22Å; D231-R256 WeakPolarHBondContact OD1-CD 3.32Å; D231-R256 IonicContact OD1-CZ 2.77Å; D231-R256 IonicContact OD1-NE 3.08Å; D231-R256 IonicContact OD1-NH1 2.7Å; D231-R256 PolarHBondContact OD1-NH1 2.9Å; D231-R256 IonicContact OD2-NH1 3.19Å; D231-R256 PolarHBondContact OD2-NH1 3.34Å; D231-R256 VanDerWaalsContact OD2-NH1 3.08Å; R256-G258 PolarHBondContact O-N 2.85Å; R256-A259 HydrophobicContact CB-CB 4.2Å; R256-A259 WeakPolarHBondContact O-CB 3.42Å; R256-A259 PolarHBondContact O-N 3.39Å
257	Q	98.3	Very high	98.6	Very high	139 Å²	139	36.4 Å²	36.4	65%	0.65	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	119.7	175.2	-179	65.2	27.4	0	0	110.4	G282	Q257-G282 PolarHBondContact NE2-O 3.45Å; Q257-G282 VanDerWaalsContact NE2-O 3.16Å
258	G	98	Very high	98.5	Very high	14 Å²	14	37 Å²	37	14%	0.144	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	24.2	-176.5	0	0	0	0	0	114.1	R256 R283 R285	R256-G258 PolarHBondContact O-N 2.85Å; G258-R283 WeakPolarHBondContact CA-O 3.38Å; G258-R283 PolarHBondContact N-O 2.84Å; G258-R285 WeakPolarHBondContact O-CB 3.34Å; G258-R285 PolarHBondContact O-NE 2.89Å
259	A	98.7	Very high	98.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	164.6	169.7	0	0	0	0	0	112.7	D231 M255 R256 I284 R285	D231-A259 CarbonylContact O-C 3.49Å; D231-A259 VanDerWaalsContact O-CA 3.25Å; D231-A259 WeakPolarHBondContact O-CA 3.35Å; D231-A259 WeakPolarHBondContact O-CB 3.4Å; M255-A259 HydrophobicContact CE-CB 4.19Å; R256-A259 HydrophobicContact CB-CB 4.2Å; R256-A259 WeakPolarHBondContact O-CB 3.42Å; R256-A259 PolarHBondContact O-N 3.39Å; A259-I284 CarbonylContact O-C 3.55Å; A259-I284 WeakPolarHBondContact O-CA 3.19Å; A259-R285 PolarHBondContact O-N 3.49Å
260	F	98.9	Very high	98.6	Very high	3 Å²	3	30.6 Å²	30.6	1%	0.013	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	152.6	170	-70.9	-59.1	0	0	0	112.1	L139 Y140 D231 C232 V233 R285 G286	L139-F260 HydrophobicContact CB-CD1 3.73Å; L139-F260 HydrophobicContact CB-CD2 4.34Å; L139-F260 HydrophobicContact CB-CE1 3.72Å; L139-F260 HydrophobicContact CB-CE2 4.32Å; L139-F260 HydrophobicContact CB-CG 4.04Å; L139-F260 HydrophobicContact CB-CZ 4Å; L139-F260 HydrophobicContact CD1-CB 3.93Å; L139-F260 HydrophobicContact CD1-CD1 3.91Å; L139-F260 HydrophobicContact CD1-CG 4.1Å; L139-F260 HydrophobicContact CD2-CD1 4.29Å; L139-F260 HydrophobicContact CD2-CE1 4.41Å; L139-F260 HydrophobicContact CG-CD1 4.19Å; L139-F260 HydrophobicContact CG-CE1 4.48Å; L139-F260 VanDerWaalsContact O-CZ 3.27Å; L139-F260 WeakPolarHBondContact O-CZ 3.37Å; Y140-F260 HydrophobicContact CD1-CE2 4.05Å; Y140-F260 AromaticContact CD2-CD2 3.98Å; Y140-F260 HydrophobicContact CD2-CD2 3.98Å; Y140-F260 AromaticContact CD2-CE2 3.99Å; Y140-F260 HydrophobicContact CD2-CE2 3.99Å; Y140-F260 HydrophobicContact CE1-CD2 4.26Å; Y140-F260 HydrophobicContact CE1-CE2 4.03Å; Y140-F260 AromaticContact CE2-CD2 3.63Å; Y140-F260 HydrophobicContact CE2-CD2 3.63Å; Y140-F260 HydrophobicContact CE2-CE2 4.02Å; Y140-F260 HydrophobicContact CG-CD2 4.44Å; Y140-F260 HydrophobicContact CG-CE2 4.01Å; Y140-F260 AromaticContact CZ-CD2 3.78Å; D231-F260 PolarHBondContact O-N 2.85Å; C232-F260 WeakPolarHBondContact CA-O 3.23Å; C232-F260 HydrophobicContact CB-CB 4.06Å; V233-F260 PolarHBondContact N-O 3.06Å; F260-R285 HydrophobicContact CD1-CB 4.2Å; F260-R285 HydrophobicContact CD1-CG 4.38Å; F260-R285 HydrophobicContact CE1-CB 4.06Å; F260-R285 HydrophobicContact CE1-CG 3.74Å; F260-R285 HydrophobicContact CZ-CG 4.07Å; F260-G286 WeakPolarHBondContact CA-O 3.3Å
261	L	98.9	Very high	98.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.3	172.4	-177.6	64.8	0	0	0	111.1	V233 I247 M255 V270 L275 I284 G286 A287 A288	V233-L261 HydrophobicContact CB-CD1 4.08Å; V233-L261 HydrophobicContact CG1-CD1 4.05Å; V233-L261 CarbonylContact O-C 3.56Å; V233-L261 WeakPolarHBondContact O-CA 3.33Å; I247-L261 HydrophobicContact CG2-CD2 4.08Å; M255-L261 HydrophobicContact CE-CB 4.36Å; M255-L261 HydrophobicContact CE-CD1 4.47Å; L261-V270 HydrophobicContact CD2-CG1 4.34Å; L261-L275 HydrophobicContact CD2-CD1 3.91Å; L261-L275 HydrophobicContact CD2-CD2 4.26Å; L261-I284 HydrophobicContact CB-CG2 4.49Å; L261-G286 PolarHBondContact N-O 2.86Å; L261-A287 HydrophobicContact CB-CB 4.33Å; L261-A287 CarbonylContact O-C 3.46Å; L261-A287 WeakPolarHBondContact O-CA 3.39Å; L261-A288 PolarHBondContact O-N 3.13Å
262	V	99	Very high	98.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.9	174.3	-177.8	0	0	0	0	110.3	T132 H135 I136 L139 V233 T234 L235 T264 A288	T132-V262 HydrophobicContact CG2-CG1 4.15Å; H135-V262 HydrophobicContact CB-CG1 3.97Å; I136-V262 HydrophobicContact CG1-CG2 3.85Å; L139-V262 HydrophobicContact CD1-CG2 3.75Å; V233-V262 PolarHBondContact O-N 3.1Å; T234-V262 WeakPolarHBondContact CA-O 3.44Å; L235-V262 PolarHBondContact N-O 3Å; V262-T264 HydrophobicContact CG1-CG2 4.23Å; V262-A288 VanDerWaalsContact CA-O 3.31Å; V262-A288 WeakPolarHBondContact CA-O 3.32Å; V262-A288 HydrophobicContact CG2-CB 4.34Å
263	N	98.9	Very high	98.6	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	114.1	174.2	-170.9	5.5	0	0	0	110.9	L235 A265 R266 A288 L289 D290 V291	L235-N263 HydrophobicContact CD1-CB 4.2Å; N263-A265 PolarHBondContact OD1-N 2.97Å; N263-R266 PolarHBondContact ND2-O 3.32Å; N263-R266 PolarHBondContact OD1-N 3.17Å; N263-A288 PolarHBondContact N-O 2.82Å; N263-L289 HydrophobicContact CB-CD2 3.72Å; N263-D290 PolarHBondContact O-N 2.89Å; N263-V291 HydrophobicContact CB-CG2 4.37Å; N263-V291 WeakPolarHBondContact OD1-CG2 3.31Å
264	T	98.9	Very high	98.6	Very high	13 Å²	13	27.1 Å²	27.1	8%	0.08	14%	0.135	C	C	.	.			trans	-127.2	25.9	171	69.1	0	0	0	0	110.8	T132 H236 V262 D290 A317	T132-T264 PolarHBondContact OG1-OG1 3.47Å; T132-T264 VanDerWaalsContact OG1-OG1 3.07Å; H236-T264 PolarHBondContact CE1-OG1 2.9Å; V262-T264 HydrophobicContact CG1-CG2 4.23Å; T264-D290 HydrophobicContact CG2-CB 4.14Å; T264-A317 HydrophobicContact CG2-CB 4.45Å
265	A	98.8	Very high	98.7	Very high	14 Å²	14	25.3 Å²	25.3	12%	0.116	13%	0.127	C	C	.	.	S	Bend	trans	-107.9	-79.7	-177.9	0	0	0	0	0	111.1	L235 C237 N263 L269	L235-A265 HydrophobicContact CB-CB 4.43Å; L235-A265 VanDerWaalsContact O-CB 3.3Å; L235-A265 WeakPolarHBondContact O-CB 3.49Å; C237-A265 WeakPolarHBondContact O-CB 3.49Å; N263-A265 PolarHBondContact OD1-N 2.97Å; A265-L269 HydrophobicContact CB-CD1 3.69Å
266	R	98.6	Very high	98.7	Very high	30 Å²	30	25 Å²	25	11%	0.113	13%	0.126	C	C	.	.			trans	-148	143.1	176	-69.1	-60.5	177.5	-125.2	24.6	111.6	G101 D103 L239 N263 L269 H315	G101-R266 PolarHBondContact O-NH2 3.36Å; D103-R266 VanDerWaalsContact CG-NE 3.27Å; D103-R266 IonicContact OD1-CZ 3.78Å; D103-R266 IonicContact OD1-NE 3.73Å; D103-R266 PolarHBondContact OD1-NE 3.34Å; D103-R266 IonicContact OD1-NH2 2.86Å; D103-R266 WeakPolarHBondContact OD2-CD 3.47Å; D103-R266 WeakPolarHBondContact OD2-CG 3.41Å; D103-R266 IonicContact OD2-NE 2.63Å; D103-R266 PolarHBondContact OD2-NE 3.42Å; L239-R266 HydrophobicContact CB-CB 3.86Å; L239-R266 HydrophobicContact CB-CG 3.81Å; L239-R266 HydrophobicContact CD2-CB 4.29Å; N263-R266 PolarHBondContact ND2-O 3.32Å; N263-R266 PolarHBondContact OD1-N 3.17Å; R266-L269 HydrophobicContact CB-CD1 4.18Å; R266-L269 HydrophobicContact CB-CG 4.17Å; R266-L269 WeakPolarHBondContact O-CB 3.33Å; R266-L269 PolarHBondContact O-N 3.37Å; R266-H315 PolarHBondContact NH1-NE2 2.86Å
267	G	98.5	Very high	98.7	Very high	7 Å²	7	25.5 Å²	25.5	7%	0.072	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-56.7	-56.4	-179.4	0	0	0	0	0	113.2	L269 V270 H292	G267-L269 PolarHBondContact O-N 3.47Å; G267-V270 PolarHBondContact O-N 3.42Å; G267-H292 VanDerWaalsContact CA-C 3.44Å; G267-H292 WeakPolarHBondContact CA-O 3.05Å
268	G	98.4	Very high	98.7	Very high	13 Å²	13	18.9 Å²	18.9	13%	0.134	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-61.8	7.6	-180	0	0	0	0	0	117	H244 H245 V270	H244-G268 CarbonylContact C-O 3.54Å; H244-G268 WeakPolarHBondContact CA-O 3.41Å; H245-G268 PolarHBondContact N-O 3.09Å; G268-V270 VanDerWaalsContact C-N 3.3Å
269	L	98.9	Very high	98.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-78.3	-15.5	162.3	-64.2	171.2	0	0	0	112.5	L235 L239 N243 H245 L246 I247 A265 R266 G267	L235-L269 HydrophobicContact CB-CD1 4.4Å; L235-L269 HydrophobicContact CD1-CB 3.98Å; L235-L269 HydrophobicContact CD1-CD1 4.44Å; L239-L269 HydrophobicContact CB-CD2 4.37Å; L239-L269 HydrophobicContact CD1-CD2 3.92Å; L239-L269 HydrophobicContact CD1-CG 4.37Å; N243-L269 HydrophobicContact CB-CD2 4.3Å; N243-L269 WeakPolarHBondContact ND2-CD2 3.42Å; H245-L269 CarbonylContact C-O 3.49Å; L246-L269 PolarHBondContact N-O 3.15Å; I247-L269 PolarHBondContact N-O 3.03Å; A265-L269 HydrophobicContact CB-CD1 3.69Å; R266-L269 HydrophobicContact CB-CD1 4.18Å; R266-L269 HydrophobicContact CB-CG 4.17Å; R266-L269 WeakPolarHBondContact O-CB 3.33Å; R266-L269 PolarHBondContact O-N 3.37Å; G267-L269 PolarHBondContact O-N 3.47Å
270	V	98.9	Very high	98.7	Very high	4 Å²	4	23 Å²	23	2%	0.024	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-127.5	128.2	-174.6	-175.1	0	0	0	0	110	L235 I247 L261 G267 G268 E272 L275	L235-V270 HydrophobicContact CD1-CG2 3.47Å; L235-V270 VanDerWaalsContact CD1-CG2 3.47Å; I247-V270 HydrophobicContact CB-CB 4.42Å; I247-V270 HydrophobicContact CB-CG1 4.25Å; I247-V270 HydrophobicContact CB-CG2 4.12Å; I247-V270 HydrophobicContact CG1-CG2 4.34Å; I247-V270 HydrophobicContact CG2-CG1 4.19Å; I247-V270 WeakPolarHBondContact O-CA 3.36Å; L261-V270 HydrophobicContact CD2-CG1 4.34Å; G267-V270 PolarHBondContact O-N 3.42Å; G268-V270 VanDerWaalsContact C-N 3.3Å; V270-E272 PolarHBondContact O-N 3.38Å; V270-L275 HydrophobicContact CG1-CB 4.11Å; V270-L275 HydrophobicContact CG1-CD2 4.01Å
271	D	98.8	Very high	98.7	Very high	35 Å²	35	27.4 Å²	27.4	19%	0.187	14%	0.136	C	C	.	.			trans	-73.6	106.7	166.9	-170	-62.2	0	0	0	109.5	H245 I247 N248 K273 A274 L275	H245-D271 HydrophobicContact CB-CB 4.31Å; H245-D271 IonicContact CE1-OD2 3.96Å; H245-D271 PolarHBondContact CE1-OD2 2.83Å; H245-D271 VanDerWaalsContact ND1-CB 3.3Å; H245-D271 WeakPolarHBondContact ND1-CB 3.41Å; H245-D271 IonicContact ND1-OD2 3.77Å; H245-D271 PolarHBondContact ND1-OD2 2.78Å; I247-D271 PolarHBondContact O-N 2.71Å; N248-D271 HydrophobicContact CB-CB 4.29Å; D271-K273 PolarHBondContact O-N 2.98Å; D271-K273 WeakPolarHBondContact OD1-CB 3.43Å; D271-K273 PolarHBondContact OD1-N 2.67Å; D271-K273 VanDerWaalsContact OD1-N 3.09Å; D271-A274 HydrophobicContact CB-CB 3.9Å; D271-A274 PolarHBondContact O-N 2.89Å; D271-A274 PolarHBondContact OD1-N 3.15Å; D271-L275 PolarHBondContact O-N 3.22Å
272	E	98.7	Very high	98.6	Very high	11 Å²	11	29 Å²	29	5%	0.051	15%	0.153	C	C	.	.	H	α-helix	trans	-65.1	-25.3	-176.4	-78.2	-168.3	-165.2	0	0	112.6	V270 A276 H292 E293 P303 L304	V270-E272 PolarHBondContact O-N 3.38Å; E272-A276 WeakPolarHBondContact O-CB 3.49Å; E272-A276 PolarHBondContact O-N 2.77Å; E272-H292 WeakPolarHBondContact OE1-CA 3.48Å; E272-H292 WeakPolarHBondContact OE1-CB 3.39Å; E272-H292 IonicContact OE1-CD2 3.4Å; E272-E293 HydrophobicContact CG-CB 4.26Å; E272-E293 HydrophobicContact CG-CG 4.03Å; E272-E293 PolarHBondContact N-OE1 3.41Å; E272-E293 PolarHBondContact OE1-N 3.21Å; E272-P303 HydrophobicContact CB-CB 4.01Å; E272-P303 HydrophobicContact CB-CG 3.88Å; E272-P303 WeakPolarHBondContact OE2-CD 3.3Å; E272-L304 HydrophobicContact CB-CD1 4.42Å; E272-L304 HydrophobicContact CB-CG 4.17Å; E272-L304 HydrophobicContact CG-CD1 3.85Å; E272-L304 HydrophobicContact CG-CG 4.16Å; E272-L304 WeakPolarHBondContact OE2-CD1 3.36Å
273	K	98.5	Very high	98.5	Very high	138 Å²	138	31.6 Å²	31.6	60%	0.6	16%	0.163	S	C	*	.	H	α-helix	trans	-75.1	-44	177.6	-61.6	159.6	-171	148.3	0	110.3	D271 L275 A276 Q277 P303	D271-K273 PolarHBondContact O-N 2.98Å; D271-K273 WeakPolarHBondContact OD1-CB 3.43Å; D271-K273 PolarHBondContact OD1-N 2.67Å; D271-K273 VanDerWaalsContact OD1-N 3.09Å; K273-L275 VanDerWaalsContact C-N 3.35Å; K273-A276 PolarHBondContact O-N 3.33Å; K273-Q277 WeakPolarHBondContact O-CB 3.14Å; K273-Q277 PolarHBondContact O-N 2.59Å; K273-P303 HydrophobicContact CG-CB 3.79Å; K273-P303 HydrophobicContact CG-CG 3.78Å
274	A	98.6	Very high	98.5	Very high	10 Å²	10	31.6 Å²	31.6	8%	0.083	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-41.9	173.4	0	0	0	0	0	111.6	D249 D271 Q277 A278	D249-A274 HydrophobicContact CB-CB 4.15Å; D271-A274 HydrophobicContact CB-CB 3.9Å; D271-A274 PolarHBondContact O-N 2.89Å; D271-A274 PolarHBondContact OD1-N 3.15Å; A274-Q277 PolarHBondContact O-N 3.36Å; A274-A278 WeakPolarHBondContact O-CB 3.4Å; A274-A278 PolarHBondContact O-N 3.23Å
275	L	98.8	Very high	98.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-48.6	175.1	178.5	57.6	0	0	0	111.8	L261 V270 D271 K273 Q277 A278 L279 I284 A287 L289 L304	L261-L275 HydrophobicContact CD2-CD1 3.91Å; L261-L275 HydrophobicContact CD2-CD2 4.26Å; V270-L275 HydrophobicContact CG1-CB 4.11Å; V270-L275 HydrophobicContact CG1-CD2 4.01Å; D271-L275 PolarHBondContact O-N 3.22Å; K273-L275 VanDerWaalsContact C-N 3.35Å; L275-Q277 VanDerWaalsContact C-N 3.29Å; L275-Q277 PolarHBondContact O-N 3.22Å; L275-A278 PolarHBondContact O-N 2.95Å; L275-L279 HydrophobicContact CD1-CD1 3.96Å; L275-L279 HydrophobicContact CD1-CG 4.01Å; L275-L279 HydrophobicContact CG-CD1 3.93Å; L275-L279 HydrophobicContact CG-CG 4.43Å; L275-L279 WeakPolarHBondContact O-CG 3.47Å; L275-L279 PolarHBondContact O-N 3.41Å; L275-I284 HydrophobicContact CD1-CD1 3.64Å; L275-I284 HydrophobicContact CD1-CG2 4.49Å; L275-A287 HydrophobicContact CD1-CB 4.07Å; L275-A287 HydrophobicContact CD2-CB 4.21Å; L275-L289 HydrophobicContact CD2-CD1 3.94Å; L275-L289 HydrophobicContact CD2-CD2 4.17Å; L275-L304 HydrophobicContact CD2-CD2 4.19Å; L275-L304 HydrophobicContact CG-CD2 4.22Å
276	A	98.7	Very high	98.5	Very high	5 Å²	5	35.3 Å²	35.3	4%	0.041	17%	0.172	C	C	.	.	H	α-helix	trans	-57.2	-42	178.1	0	0	0	0	0	111.9	E272 K273 K280 P303 L304 A307	E272-A276 WeakPolarHBondContact O-CB 3.49Å; E272-A276 PolarHBondContact O-N 2.77Å; K273-A276 PolarHBondContact O-N 3.33Å; A276-K280 WeakPolarHBondContact O-CB 3.44Å; A276-K280 WeakPolarHBondContact O-CD 3.4Å; A276-K280 VanDerWaalsContact O-CG 3.25Å; A276-K280 WeakPolarHBondContact O-CG 3.4Å; A276-K280 PolarHBondContact O-N 3.28Å; A276-K280 VanDerWaalsContact O-N 3.1Å; A276-P303 WeakPolarHBondContact CB-O 3.29Å; A276-L304 HydrophobicContact CB-CD2 4.18Å; A276-A307 HydrophobicContact CB-CB 4.37Å
277	Q	98.5	Very high	98.5	Very high	97 Å²	97	33.9 Å²	33.9	45%	0.453	17%	0.167	S	C	.	.	H	α-helix	trans	-67.8	-43.6	176.4	-171.9	63.1	14.7	0	0	111.8	K273 A274 L275 L279 K280 E281	K273-Q277 WeakPolarHBondContact O-CB 3.14Å; K273-Q277 PolarHBondContact O-N 2.59Å; A274-Q277 PolarHBondContact O-N 3.36Å; L275-Q277 VanDerWaalsContact C-N 3.29Å; L275-Q277 PolarHBondContact O-N 3.22Å; Q277-L279 VanDerWaalsContact C-N 3.32Å; Q277-L279 PolarHBondContact O-N 3.09Å; Q277-K280 PolarHBondContact O-N 3.09Å; Q277-E281 HydrophobicContact CG-CG 4.38Å; Q277-E281 PolarHBondContact NE2-OE1 2.98Å; Q277-E281 WeakPolarHBondContact O-CB 3.35Å; Q277-E281 WeakPolarHBondContact O-CG 3.33Å; Q277-E281 PolarHBondContact O-N 3.01Å
278	A	98.7	Very high	98.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68	-28.4	180	0	0	0	0	0	114.1	V252 A274 L275 G282 R283 I284	V252-A278 HydrophobicContact CG1-CB 3.44Å; V252-A278 VanDerWaalsContact CG1-CB 3.44Å; A274-A278 WeakPolarHBondContact O-CB 3.4Å; A274-A278 PolarHBondContact O-N 3.23Å; L275-A278 PolarHBondContact O-N 2.95Å; A278-G282 PolarHBondContact O-N 3.11Å; A278-R283 HydrophobicContact CB-CB 4.3Å; A278-R283 PolarHBondContact O-N 2.99Å; A278-I284 HydrophobicContact CB-CB 4.48Å; A278-I284 HydrophobicContact CB-CD1 4.01Å; A278-I284 HydrophobicContact CB-CG1 4.13Å; A278-I284 PolarHBondContact O-N 2.96Å
279	L	98.7	Very high	98.6	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-70.6	-45.5	169.2	-71.3	167.8	0	0	0	111.2	L275 Q277 E281 G282 I284 A287 A307 P308 L310	L275-L279 HydrophobicContact CD1-CD1 3.96Å; L275-L279 HydrophobicContact CD1-CG 4.01Å; L275-L279 HydrophobicContact CG-CD1 3.93Å; L275-L279 HydrophobicContact CG-CG 4.43Å; L275-L279 WeakPolarHBondContact O-CG 3.47Å; L275-L279 PolarHBondContact O-N 3.41Å; Q277-L279 VanDerWaalsContact C-N 3.32Å; Q277-L279 PolarHBondContact O-N 3.09Å; L279-E281 VanDerWaalsContact C-N 3.31Å; L279-E281 PolarHBondContact O-N 3.26Å; L279-G282 PolarHBondContact O-N 3.37Å; L279-G282 VanDerWaalsContact O-N 3.12Å; L279-I284 HydrophobicContact CD2-CB 4.11Å; L279-I284 HydrophobicContact CD2-CG2 3.68Å; L279-I284 HydrophobicContact CG-CG2 4.47Å; L279-A287 HydrophobicContact CD1-CB 4.28Å; L279-A287 HydrophobicContact CD2-CB 4.23Å; L279-A307 HydrophobicContact CD1-CB 3.97Å; L279-P308 HydrophobicContact CB-CG 4.38Å; L279-P308 WeakPolarHBondContact O-CG 3.44Å; L279-L310 HydrophobicContact CD1-CD1 4.43Å
280	K	98.5	Very high	98.6	Very high	99 Å²	99	33.2 Å²	33.2	43%	0.43	16%	0.159	S	C	.	.	H	α-helix	trans	-63.3	-34.6	177	-73.6	168.9	179.6	175.7	0	112.8	A276 Q277 G282 D306	A276-K280 WeakPolarHBondContact O-CB 3.44Å; A276-K280 WeakPolarHBondContact O-CD 3.4Å; A276-K280 VanDerWaalsContact O-CG 3.25Å; A276-K280 WeakPolarHBondContact O-CG 3.4Å; A276-K280 PolarHBondContact O-N 3.28Å; A276-K280 VanDerWaalsContact O-N 3.1Å; Q277-K280 PolarHBondContact O-N 3.09Å; K280-G282 VanDerWaalsContact C-N 3.34Å; K280-D306 WeakPolarHBondContact CE-O 3.16Å
281	E	98.1	Very high	98.6	Very high	94 Å²	94	33.2 Å²	33.2	44%	0.439	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.2	175.3	-68.8	175.7	171	0	0	113.8	Q277 L279 R283	Q277-E281 HydrophobicContact CG-CG 4.38Å; Q277-E281 PolarHBondContact NE2-OE1 2.98Å; Q277-E281 WeakPolarHBondContact O-CB 3.35Å; Q277-E281 WeakPolarHBondContact O-CG 3.33Å; Q277-E281 PolarHBondContact O-N 3.01Å; L279-E281 VanDerWaalsContact C-N 3.31Å; L279-E281 PolarHBondContact O-N 3.26Å; E281-R283 PolarHBondContact O-N 3.22Å; E281-R283 IonicContact OE2-CZ 3.59Å; E281-R283 IonicContact OE2-NH1 2.7Å; E281-R283 PolarHBondContact OE2-NH1 2.94Å; E281-R283 IonicContact OE2-NH2 3.54Å; E281-R283 PolarHBondContact OE2-NH2 3.18Å
282	G	97.4	Very high	98.6	Very high	35 Å²	35	31.9 Å²	31.9	36%	0.361	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	14.7	-177.6	0	0	0	0	0	115.1	Q257 A278 L279 K280	Q257-G282 PolarHBondContact NE2-O 3.45Å; Q257-G282 VanDerWaalsContact NE2-O 3.16Å; A278-G282 PolarHBondContact O-N 3.11Å; L279-G282 PolarHBondContact O-N 3.37Å; L279-G282 VanDerWaalsContact O-N 3.12Å; K280-G282 VanDerWaalsContact C-N 3.34Å
283	R	98.1	Very high	98.5	Very high	54 Å²	54	34.8 Å²	34.8	20%	0.204	17%	0.165	C	C	.	.	S	Bend	trans	-67.6	-40.4	172	-174.8	-176.7	-59.4	93.8	11	110.8	V252 G258 A278 E281	V252-R283 WeakPolarHBondContact O-CD 3.48Å; G258-R283 WeakPolarHBondContact CA-O 3.38Å; G258-R283 PolarHBondContact N-O 2.84Å; A278-R283 HydrophobicContact CB-CB 4.3Å; A278-R283 PolarHBondContact O-N 2.99Å; E281-R283 PolarHBondContact O-N 3.22Å; E281-R283 IonicContact OE2-CZ 3.59Å; E281-R283 IonicContact OE2-NH1 2.7Å; E281-R283 PolarHBondContact OE2-NH1 2.94Å; E281-R283 IonicContact OE2-NH2 3.54Å; E281-R283 PolarHBondContact OE2-NH2 3.18Å
284	I	98.7	Very high	98.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.2	165.2	-66.6	175.2	0	0	0	106.9	V252 M255 A259 L261 L275 A278 L279 G286	V252-I284 HydrophobicContact CG1-CD1 4.06Å; M255-I284 HydrophobicContact CE-CD1 4.19Å; M255-I284 HydrophobicContact CE-CG1 4.26Å; M255-I284 HydrophobicContact SD-CD1 3.98Å; M255-I284 HydrophobicContact SD-CG1 4.37Å; A259-I284 CarbonylContact O-C 3.55Å; A259-I284 WeakPolarHBondContact O-CA 3.19Å; L261-I284 HydrophobicContact CB-CG2 4.49Å; L275-I284 HydrophobicContact CD1-CD1 3.64Å; L275-I284 HydrophobicContact CD1-CG2 4.49Å; A278-I284 HydrophobicContact CB-CB 4.48Å; A278-I284 HydrophobicContact CB-CD1 4.01Å; A278-I284 HydrophobicContact CB-CG1 4.13Å; A278-I284 PolarHBondContact O-N 2.96Å; L279-I284 HydrophobicContact CD2-CB 4.11Å; L279-I284 HydrophobicContact CD2-CG2 3.68Å; L279-I284 HydrophobicContact CG-CG2 4.47Å; I284-G286 VanDerWaalsContact C-N 3.32Å; I284-G286 VanDerWaalsContact CG2-O 3.26Å; I284-G286 WeakPolarHBondContact CG2-O 3.45Å
285	R	98.6	Very high	98.4	Very high	104 Å²	104	35.4 Å²	35.4	39%	0.392	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-27.7	-177.8	178.1	-171.1	-59.6	-109.1	0.3	112.5	G258 A259 F260 N309	G258-R285 WeakPolarHBondContact O-CB 3.34Å; G258-R285 PolarHBondContact O-NE 2.89Å; A259-R285 PolarHBondContact O-N 3.49Å; F260-R285 HydrophobicContact CD1-CB 4.2Å; F260-R285 HydrophobicContact CD1-CG 4.38Å; F260-R285 HydrophobicContact CE1-CB 4.06Å; F260-R285 HydrophobicContact CE1-CG 3.74Å; F260-R285 HydrophobicContact CZ-CG 4.07Å; R285-N309 WeakPolarHBondContact O-CB 3.46Å
286	G	98.8	Very high	98.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.5	161.6	174.5	0	0	0	0	0	111.3	F260 L261 I284 N309	F260-G286 WeakPolarHBondContact CA-O 3.3Å; L261-G286 PolarHBondContact N-O 2.86Å; I284-G286 VanDerWaalsContact C-N 3.32Å; I284-G286 VanDerWaalsContact CG2-O 3.26Å; I284-G286 WeakPolarHBondContact CG2-O 3.45Å; G286-N309 CarbonylContact C-O 3.55Å; G286-N309 WeakPolarHBondContact CA-O 3.46Å
287	A	98.9	Very high	98.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.3	178.7	0	0	0	0	0	111.7	L261 L275 L279 N309 L310 I311	L261-A287 HydrophobicContact CB-CB 4.33Å; L261-A287 CarbonylContact O-C 3.46Å; L261-A287 WeakPolarHBondContact O-CA 3.39Å; L275-A287 HydrophobicContact CD1-CB 4.07Å; L275-A287 HydrophobicContact CD2-CB 4.21Å; L279-A287 HydrophobicContact CD1-CB 4.28Å; L279-A287 HydrophobicContact CD2-CB 4.23Å; A287-N309 PolarHBondContact N-O 2.89Å; A287-L310 HydrophobicContact CB-CD1 4.05Å; A287-L310 CarbonylContact O-C 3.45Å; A287-L310 WeakPolarHBondContact O-CA 3.48Å; A287-I311 PolarHBondContact O-N 2.93Å
288	A	98.9	Very high	98.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	116.2	174.5	0	0	0	0	0	110.3	H135 L139 L261 V262 N263 I311	H135-A288 HydrophobicContact CB-CB 3.72Å; L139-A288 HydrophobicContact CD1-CB 3.89Å; L139-A288 HydrophobicContact CD2-CB 4.2Å; L139-A288 HydrophobicContact CG-CB 4.03Å; L261-A288 PolarHBondContact O-N 3.13Å; V262-A288 VanDerWaalsContact CA-O 3.31Å; V262-A288 WeakPolarHBondContact CA-O 3.32Å; V262-A288 HydrophobicContact CG2-CB 4.34Å; N263-A288 PolarHBondContact N-O 2.82Å; A288-I311 CarbonylContact C-O 3.57Å; A288-I311 WeakPolarHBondContact CA-O 3.43Å; A288-I311 HydrophobicContact CB-CB 4.13Å
289	L	98.9	Very high	98.1	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.5	-172.9	-52.8	178.9	0	0	0	109.7	N263 L275 L304 L310 I311 C312 T313	N263-L289 HydrophobicContact CB-CD2 3.72Å; L275-L289 HydrophobicContact CD2-CD1 3.94Å; L275-L289 HydrophobicContact CD2-CD2 4.17Å; L289-L304 HydrophobicContact CD1-CD1 3.56Å; L289-L310 HydrophobicContact CD1-CD1 4.01Å; L289-L310 HydrophobicContact CG-CD1 4.15Å; L289-I311 PolarHBondContact N-O 3.4Å; L289-C312 CarbonylContact O-C 3.57Å; L289-C312 VanDerWaalsContact O-CA 3.22Å; L289-C312 WeakPolarHBondContact O-CA 3.49Å; L289-T313 PolarHBondContact O-N 3.49Å
290	D	98.9	Very high	98	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.016	27%	0.266	C	S	.	.	S	Bend	trans	-89	-15.6	163.8	-168.5	58.4	0	0	0	111.7	N263 T264 T313 H315 A316 A317	N263-D290 PolarHBondContact O-N 2.89Å; T264-D290 HydrophobicContact CG2-CB 4.14Å; D290-T313 CarbonylContact C-O 3.58Å; D290-T313 WeakPolarHBondContact CA-O 3.5Å; D290-T313 WeakPolarHBondContact CA-OG1 3.41Å; D290-T313 WeakPolarHBondContact CB-OG1 3.4Å; D290-T313 WeakPolarHBondContact OD1-CB 3.41Å; D290-T313 PolarHBondContact OD1-OG1 2.95Å; D290-H315 WeakPolarHBondContact O-CA 3.36Å; D290-H315 PolarHBondContact O-N 2.97Å; D290-H315 VanDerWaalsContact OD2-C 3.31Å; D290-H315 WeakPolarHBondContact OD2-CA 3.48Å; D290-A316 VanDerWaalsContact CG-N 3.31Å; D290-A316 PolarHBondContact OD1-N 2.94Å; D290-A316 PolarHBondContact OD2-N 3.38Å; D290-A317 HydrophobicContact CB-CB 4.2Å; D290-A317 PolarHBondContact OD1-N 3.31Å; D290-A317 WeakPolarHBondContact OD2-CB 3.44Å; D290-A317 PolarHBondContact OD2-N 2.73Å
291	V	98.8	Very high	97.9	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	28%	0.275	C	S	.	.			trans	-140.4	144.7	-169	-68.3	0	0	0	0	111.5	N263 E295 H315	N263-V291 HydrophobicContact CB-CG2 4.37Å; N263-V291 WeakPolarHBondContact OD1-CG2 3.31Å; V291-E295 WeakPolarHBondContact CA-OE1 3.29Å; V291-E295 WeakPolarHBondContact CB-OE1 3.46Å; V291-H315 HydrophobicContact CG1-CB 4.46Å
292	H	98.8	Very high	97.7	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.037	28%	0.282	C	S	.	.			trans	-139.6	155.7	-160.7	-57.8	84.9	0	0	0	111.9	G267 E272 S294 E295 F297 C312	G267-H292 VanDerWaalsContact CA-C 3.44Å; G267-H292 WeakPolarHBondContact CA-O 3.05Å; E272-H292 WeakPolarHBondContact OE1-CA 3.48Å; E272-H292 WeakPolarHBondContact OE1-CB 3.39Å; E272-H292 IonicContact OE1-CD2 3.4Å; H292-S294 PolarHBondContact O-N 2.84Å; H292-E295 HydrophobicContact CB-CG 4.08Å; H292-E295 PolarHBondContact N-OE1 3.34Å; H292-F297 HydrophobicContact CB-CB 4.23Å; H292-F297 HydrophobicContact CB-CD2 4.09Å; H292-F297 HydrophobicContact CB-CG 4.5Å; H292-F297 AromaticContact CD2-CD2 3.24Å; H292-F297 WeakPolarHBondContact CD2-CD2 2.84Å; H292-F297 AromaticContact CD2-CE2 3.66Å; H292-F297 AromaticContact CD2-CG 3.6Å; H292-F297 AromaticContact CE1-CG 3.85Å; H292-F297 AromaticContact CG-CD2 3.58Å; H292-F297 AromaticContact CG-CG 3.74Å; H292-F297 AromaticContact ND1-CG 3.88Å; H292-F297 AromaticContact NE2-CD1 3.93Å; H292-F297 AromaticContact NE2-CD2 3.74Å; H292-F297 AromaticContact NE2-CG 3.67Å; H292-C312 PolarHBondContact NE2-SG 3.2Å
293	E	97.8	Very high	97.7	Very high	72 Å²	72	49.9 Å²	49.9	34%	0.336	28%	0.277	S	S	.	.	S	Bend	trans	-56.1	-32.5	178.5	-89.7	-176.8	-141.6	0	0	111.8	H245 E272	H245-E293 IonicContact CE1-OE1 3.46Å; H245-E293 IonicContact NE2-OE1 2.69Å; E272-E293 HydrophobicContact CG-CB 4.26Å; E272-E293 HydrophobicContact CG-CG 4.03Å; E272-E293 PolarHBondContact N-OE1 3.41Å; E272-E293 PolarHBondContact OE1-N 3.21Å
294	S	96.9	Very high	97.7	Very high	92 Å²	92	47.3 Å²	47.3	64%	0.643	27%	0.268	S	S	*	.	S	Bend	trans	-135.6	125	176.5	-173	0	0	0	0	109.9	H292	H292-S294 PolarHBondContact O-N 2.84Å
295	E	97.2	Very high	97.6	Very high	68 Å²	68	52.5 Å²	52.5	32%	0.318	29%	0.29	S	S	.	.	S	Bend	trans	-120.9	144.2	-179.9	-69.2	173.9	-171.3	0	0	109.6	V291 H292 H315	V291-E295 WeakPolarHBondContact CA-OE1 3.29Å; V291-E295 WeakPolarHBondContact CB-OE1 3.46Å; H292-E295 HydrophobicContact CB-CG 4.08Å; H292-E295 PolarHBondContact N-OE1 3.34Å; E295-H315 IonicContact OE1-ND1 2.61Å; E295-H315 IonicContact OE2-CE1 3.5Å; E295-H315 IonicContact OE2-CG 3.49Å; E295-H315 IonicContact OE2-ND1 3.98Å; E295-H315 PolarHBondContact OE2-ND1 3.35Å
296	P	97	Very high	97.5	Very high	130 Å²	130	52.8 Å²	52.8	84%	0.844	30%	0.3	S	S	*	.	S	Bend	cis	-72.4	134.6	3.2	30.3	-35.8	0	0	0	113.6
297	F	97.6	Very high	97.5	Very high	44 Å²	44	53.6 Å²	53.6	19%	0.193	31%	0.306	C	S	.	.			trans	-67.9	147	-178.4	176	-100.6	0	0	0	113	H292 F299 L304 C312	H292-F297 HydrophobicContact CB-CB 4.23Å; H292-F297 HydrophobicContact CB-CD2 4.09Å; H292-F297 HydrophobicContact CB-CG 4.5Å; H292-F297 AromaticContact CD2-CD2 3.24Å; H292-F297 WeakPolarHBondContact CD2-CD2 2.84Å; H292-F297 AromaticContact CD2-CE2 3.66Å; H292-F297 AromaticContact CD2-CG 3.6Å; H292-F297 AromaticContact CE1-CG 3.85Å; H292-F297 AromaticContact CG-CD2 3.58Å; H292-F297 AromaticContact CG-CG 3.74Å; H292-F297 AromaticContact ND1-CG 3.88Å; H292-F297 AromaticContact NE2-CD1 3.93Å; H292-F297 AromaticContact NE2-CD2 3.74Å; H292-F297 AromaticContact NE2-CG 3.67Å; F297-F299 AromaticContact CE1-CD1 3.83Å; F297-F299 HydrophobicContact CE1-CD1 3.83Å; F297-F299 AromaticContact CE1-CD2 3.9Å; F297-F299 HydrophobicContact CE1-CD2 3.9Å; F297-F299 AromaticContact CE1-CE1 3.94Å; F297-F299 HydrophobicContact CE1-CE1 3.94Å; F297-F299 HydrophobicContact CE1-CE2 4.01Å; F297-F299 AromaticContact CE1-CG 3.81Å; F297-F299 HydrophobicContact CE1-CG 3.81Å; F297-F299 HydrophobicContact CE1-CZ 4.04Å; F297-F299 AromaticContact CZ-CD1 3.99Å; F297-F299 HydrophobicContact CZ-CD1 3.99Å; F297-F299 HydrophobicContact CZ-CE1 4.24Å; F297-F299 HydrophobicContact CZ-CG 4.28Å; F297-L304 HydrophobicContact CE2-CB 4.33Å; F297-L304 HydrophobicContact CE2-CD1 4.16Å; F297-C312 HydrophobicContact CD1-CB 3.84Å; F297-C312 HydrophobicContact CE1-CB 3.58Å; F297-C312 WeakPolarHBondContact CE1-SG 3.22Å; F297-C312 HydrophobicContact CZ-CB 4.36Å
298	S	97.5	Very high	97.4	Very high	43 Å²	43	56 Å²	56	30%	0.301	32%	0.322	S	S	.	.			trans	-145	118.1	177.7	175	0	0	0	0	111.5	S300 Q301	S298-S300 PolarHBondContact O-N 2.9Å; S298-S300 PolarHBondContact OG-N 2.86Å; S298-S300 PolarHBondContact OG-OG 2.85Å; S298-Q301 PolarHBondContact O-N 3.23Å
299	F	96.8	Very high	97.4	Very high	116 Å²	116	58.8 Å²	58.8	51%	0.509	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-13.5	175.2	-76.8	-73.1	0	0	0	115	F297 K305 L310 C312	F297-F299 AromaticContact CE1-CD1 3.83Å; F297-F299 HydrophobicContact CE1-CD1 3.83Å; F297-F299 AromaticContact CE1-CD2 3.9Å; F297-F299 HydrophobicContact CE1-CD2 3.9Å; F297-F299 AromaticContact CE1-CE1 3.94Å; F297-F299 HydrophobicContact CE1-CE1 3.94Å; F297-F299 HydrophobicContact CE1-CE2 4.01Å; F297-F299 AromaticContact CE1-CG 3.81Å; F297-F299 HydrophobicContact CE1-CG 3.81Å; F297-F299 HydrophobicContact CE1-CZ 4.04Å; F297-F299 AromaticContact CZ-CD1 3.99Å; F297-F299 HydrophobicContact CZ-CD1 3.99Å; F297-F299 HydrophobicContact CZ-CE1 4.24Å; F297-F299 HydrophobicContact CZ-CG 4.28Å; F299-K305 WeakPolarHBondContact O-CG 3.43Å; F299-L310 HydrophobicContact CE1-CD2 4.22Å; F299-C312 HydrophobicContact CE1-CB 4.21Å; F299-C312 HydrophobicContact CE2-CB 4.08Å; F299-C312 HydrophobicContact CZ-CB 3.57Å
300	S	96.7	Very high	97.4	Very high	73 Å²	73	59.3 Å²	59.3	51%	0.51	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.5	177.6	62.5	0	0	0	0	114.2	S298 K305	S298-S300 PolarHBondContact O-N 2.9Å; S298-S300 PolarHBondContact OG-N 2.86Å; S298-S300 PolarHBondContact OG-OG 2.85Å; S300-K305 WeakPolarHBondContact O-CD 3.07Å
301	Q	94.5	Very high	97.4	Very high	136 Å²	136	59.8 Å²	59.8	64%	0.636	34%	0.342	S	S	*	.	S	Bend	trans	-137	175.9	-169.7	-65.3	179.1	-8.7	0	0	111	S298	S298-Q301 PolarHBondContact O-N 3.23Å
302	G	95.4	Very high	97.4	Very high	56 Å²	56	60.7 Å²	60.7	58%	0.577	35%	0.348	S	S	*	.	S	Bend	trans	71.9	178.9	177.6	0	0	0	0	0	115.5	L304	G302-L304 VanDerWaalsContact C-N 3.31Å; G302-L304 PolarHBondContact O-N 3.41Å
303	P	97.4	Very high	97.4	Very high	40 Å²	40	62.4 Å²	62.4	26%	0.26	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-31.9	-179.6	-21.4	34	0	0	0	113.9	E272 K273 A276 K305	E272-P303 HydrophobicContact CB-CB 4.01Å; E272-P303 HydrophobicContact CB-CG 3.88Å; E272-P303 WeakPolarHBondContact OE2-CD 3.3Å; K273-P303 HydrophobicContact CG-CB 3.79Å; K273-P303 HydrophobicContact CG-CG 3.78Å; A276-P303 WeakPolarHBondContact CB-O 3.29Å; P303-K305 VanDerWaalsContact C-N 3.32Å; P303-K305 PolarHBondContact O-N 2.74Å
304	L	98.1	Very high	97.4	Very high	1 Å²	1	64 Å²	64	1%	0.005	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.2	-174.4	-67.1	172.4	0	0	0	114.6	E272 L275 A276 L289 F297 G302 D306 A307 L310	E272-L304 HydrophobicContact CB-CD1 4.42Å; E272-L304 HydrophobicContact CB-CG 4.17Å; E272-L304 HydrophobicContact CG-CD1 3.85Å; E272-L304 HydrophobicContact CG-CG 4.16Å; E272-L304 WeakPolarHBondContact OE2-CD1 3.36Å; L275-L304 HydrophobicContact CD2-CD2 4.19Å; L275-L304 HydrophobicContact CG-CD2 4.22Å; A276-L304 HydrophobicContact CB-CD2 4.18Å; L289-L304 HydrophobicContact CD1-CD1 3.56Å; F297-L304 HydrophobicContact CE2-CB 4.33Å; F297-L304 HydrophobicContact CE2-CD1 4.16Å; G302-L304 VanDerWaalsContact C-N 3.31Å; G302-L304 PolarHBondContact O-N 3.41Å; L304-D306 VanDerWaalsContact C-N 3.29Å; L304-D306 PolarHBondContact O-N 3.28Å; L304-D306 VanDerWaalsContact O-N 3.1Å; L304-A307 HydrophobicContact CD2-CB 4.23Å; L304-A307 WeakPolarHBondContact O-CB 3.34Å; L304-A307 PolarHBondContact O-N 2.71Å; L304-L310 HydrophobicContact CB-CD2 3.86Å; L304-L310 HydrophobicContact CD1-CD2 4.22Å; L304-L310 HydrophobicContact CD2-CD2 4.24Å; L304-L310 HydrophobicContact CG-CD2 4.34Å
305	K	96.6	Very high	97.5	Very high	109 Å²	109	60.7 Å²	60.7	47%	0.474	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.4	-50.1	-176.3	179.9	-174	175.4	170.2	0	114.8	F299 S300 P303	F299-K305 WeakPolarHBondContact O-CG 3.43Å; S300-K305 WeakPolarHBondContact O-CD 3.07Å; P303-K305 VanDerWaalsContact C-N 3.32Å; P303-K305 PolarHBondContact O-N 2.74Å
306	D	95.6	Very high	97.6	Very high	111 Å²	111	59.5 Å²	59.5	59%	0.594	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	25.2	-176.9	-42.1	-67.1	0	0	0	112	K280 L304	K280-D306 WeakPolarHBondContact CE-O 3.16Å; L304-D306 VanDerWaalsContact C-N 3.29Å; L304-D306 PolarHBondContact O-N 3.28Å; L304-D306 VanDerWaalsContact O-N 3.1Å
307	A	98.2	Very high	97.7	Very high	16 Å²	16	53.5 Å²	53.5	13%	0.132	31%	0.313	C	S	.	.			trans	-85.9	124	-178.1	0	0	0	0	0	111.8	A276 L279 L304 L310	A276-A307 HydrophobicContact CB-CB 4.37Å; L279-A307 HydrophobicContact CD1-CB 3.97Å; L304-A307 HydrophobicContact CD2-CB 4.23Å; L304-A307 WeakPolarHBondContact O-CB 3.34Å; L304-A307 PolarHBondContact O-N 2.71Å; A307-L310 HydrophobicContact CB-CD2 4.47Å
308	P	98.3	Very high	97.7	Very high	51 Å²	51	54.2 Å²	54.2	33%	0.331	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	160.9	179.9	33.7	-36.7	0	0	0	112.2	L279 L310	L279-P308 HydrophobicContact CB-CG 4.38Å; L279-P308 WeakPolarHBondContact O-CG 3.44Å; P308-L310 PolarHBondContact O-N 3.39Å
309	N	98.4	Very high	97.8	Very high	58 Å²	58	59 Å²	59	31%	0.31	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	36.7	177.5	-58.2	-75	0	0	0	114.2	R142 W145 R285 G286 A287	R142-N309 PolarHBondContact NH1-OD1 2.99Å; R142-N309 PolarHBondContact NH2-OD1 2.96Å; W145-N309 HydrophobicContact CH2-CB 4.21Å; W145-N309 VanDerWaalsContact CZ2-C 3.4Å; W145-N309 HydrophobicContact CZ2-CB 4.22Å; W145-N309 VanDerWaalsContact CZ2-O 3.3Å; W145-N309 WeakPolarHBondContact CZ2-O 3.36Å; R285-N309 WeakPolarHBondContact O-CB 3.46Å; G286-N309 CarbonylContact C-O 3.55Å; G286-N309 WeakPolarHBondContact CA-O 3.46Å; A287-N309 PolarHBondContact N-O 2.89Å
310	L	98.8	Very high	97.9	Very high	16 Å²	16	54.5 Å²	54.5	8%	0.084	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	148.2	175.4	-172.8	61.8	0	0	0	111.1	W145 L279 A287 L289 F299 L304 A307 P308	W145-L310 PolarHBondContact NE1-O 3.12Å; W145-L310 VanDerWaalsContact NE1-O 3.08Å; L279-L310 HydrophobicContact CD1-CD1 4.43Å; A287-L310 HydrophobicContact CB-CD1 4.05Å; A287-L310 CarbonylContact O-C 3.45Å; A287-L310 WeakPolarHBondContact O-CA 3.48Å; L289-L310 HydrophobicContact CD1-CD1 4.01Å; L289-L310 HydrophobicContact CG-CD1 4.15Å; F299-L310 HydrophobicContact CE1-CD2 4.22Å; L304-L310 HydrophobicContact CB-CD2 3.86Å; L304-L310 HydrophobicContact CD1-CD2 4.22Å; L304-L310 HydrophobicContact CD2-CD2 4.24Å; L304-L310 HydrophobicContact CG-CD2 4.34Å; A307-L310 HydrophobicContact CB-CD2 4.47Å; P308-L310 PolarHBondContact O-N 3.39Å
311	I	98.8	Very high	97.9	Very high	12 Å²	12	57.1 Å²	57.1	6%	0.062	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132	164.5	-61.8	178.3	0	0	0	106.4	N138 L139 W145 A287 A288 L289	N138-I311 HydrophobicContact CB-CD1 3.77Å; L139-I311 HydrophobicContact CD2-CD1 4.11Å; W145-I311 HydrophobicContact CH2-CD1 4.4Å; W145-I311 HydrophobicContact CZ2-CD1 3.93Å; W145-I311 HydrophobicContact CZ2-CG1 3.62Å; A287-I311 PolarHBondContact O-N 2.93Å; A288-I311 CarbonylContact C-O 3.57Å; A288-I311 WeakPolarHBondContact CA-O 3.43Å; A288-I311 HydrophobicContact CB-CB 4.13Å; L289-I311 PolarHBondContact N-O 3.4Å
312	C	98.8	Very high	98.1	Very high	22 Å²	22	56.8 Å²	56.8	15%	0.149	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.9	174.5	-62.5	0	0	0	0	110.8	L289 H292 F297 F299	L289-C312 CarbonylContact O-C 3.57Å; L289-C312 VanDerWaalsContact O-CA 3.22Å; L289-C312 WeakPolarHBondContact O-CA 3.49Å; H292-C312 PolarHBondContact NE2-SG 3.2Å; F297-C312 HydrophobicContact CD1-CB 3.84Å; F297-C312 HydrophobicContact CE1-CB 3.58Å; F297-C312 WeakPolarHBondContact CE1-SG 3.22Å; F297-C312 HydrophobicContact CZ-CB 4.36Å; F299-C312 HydrophobicContact CE1-CB 4.21Å; F299-C312 HydrophobicContact CE2-CB 4.08Å; F299-C312 HydrophobicContact CZ-CB 3.57Å
313	T	98.8	Very high	98.2	Very high	44 Å²	44	54.2 Å²	54.2	27%	0.27	29%	0.286	S	S	.	.			trans	-123	154.7	164.9	45.1	0	0	0	0	110.2	H135 L289 D290 H315	H135-T313 PolarHBondContact CE1-OG1 2.92Å; H135-T313 PolarHBondContact NE2-OG1 3.46Å; L289-T313 PolarHBondContact O-N 3.49Å; D290-T313 CarbonylContact C-O 3.58Å; D290-T313 WeakPolarHBondContact CA-O 3.5Å; D290-T313 WeakPolarHBondContact CA-OG1 3.41Å; D290-T313 WeakPolarHBondContact CB-OG1 3.4Å; D290-T313 WeakPolarHBondContact OD1-CB 3.41Å; D290-T313 PolarHBondContact OD1-OG1 2.95Å; T313-H315 PolarHBondContact O-N 3.01Å
314	P	98.5	Very high	98.3	Very high	107 Å²	107	53.3 Å²	53.3	70%	0.695	28%	0.28	S	S	*	.			trans	-93.7	70.4	-168.2	36.7	-35.3	0	0	0	112.3	A316	P314-A316 HydrophobicContact CG-CB 4.39Å; P314-A316 PolarHBondContact O-N 2.83Å
315	H	98.6	Very high	98.3	Very high	22 Å²	22	56.7 Å²	56.7	10%	0.102	30%	0.298	C	S	.	.	S	Bend	trans	48.6	45.7	-178.7	-153.6	147.8	0	0	0	112.3	H77 R266 D290 V291 E295 T313 W318	H77-H315 AromaticContact CD2-CE1 3.68Å; H77-H315 AromaticContact CD2-ND1 3.51Å; H77-H315 AromaticContact CE1-CG 3.8Å; H77-H315 AromaticContact CE1-ND1 3.79Å; H77-H315 AromaticContact CG-CE1 3.66Å; H77-H315 AromaticContact CG-ND1 3.92Å; H77-H315 AromaticContact ND1-CE1 3.89Å; H77-H315 AromaticContact NE2-CE1 3.97Å; H77-H315 AromaticContact NE2-CG 3.78Å; H77-H315 AromaticContact NE2-ND1 3.45Å; H77-H315 PolarHBondContact NE2-ND1 3.02Å; R266-H315 PolarHBondContact NH1-NE2 2.86Å; D290-H315 WeakPolarHBondContact O-CA 3.36Å; D290-H315 PolarHBondContact O-N 2.97Å; D290-H315 VanDerWaalsContact OD2-C 3.31Å; D290-H315 WeakPolarHBondContact OD2-CA 3.48Å; V291-H315 HydrophobicContact CG1-CB 4.46Å; E295-H315 IonicContact OE1-ND1 2.61Å; E295-H315 IonicContact OE2-CE1 3.5Å; E295-H315 IonicContact OE2-CG 3.49Å; E295-H315 IonicContact OE2-ND1 3.98Å; E295-H315 PolarHBondContact OE2-ND1 3.35Å; T313-H315 PolarHBondContact O-N 3.01Å; H315-W318 PolarHBondContact O-NE1 3.21Å
316	A	98.7	Very high	98.4	Very high	42 Å²	42	55.9 Å²	55.9	35%	0.347	30%	0.296	S	S	.	.			trans	-110.4	-5.5	-168	0	0	0	0	0	113.8	D290 P314 W318 Y319	D290-A316 VanDerWaalsContact CG-N 3.31Å; D290-A316 PolarHBondContact OD1-N 2.94Å; D290-A316 PolarHBondContact OD2-N 3.38Å; P314-A316 HydrophobicContact CG-CB 4.39Å; P314-A316 PolarHBondContact O-N 2.83Å; A316-W318 PolarHBondContact O-N 3.1Å; A316-Y319 WeakPolarHBondContact O-CB 3.17Å; A316-Y319 PolarHBondContact O-N 2.95Å
317	A	98.7	Very high	98.5	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.033	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.5	-175.7	0	0	0	0	0	114.2	E127 T128 S131 T264 D290	E127-A317 CarbonylContact C-O 3.53Å; E127-A317 VanDerWaalsContact O-O 3.08Å; T128-A317 WeakPolarHBondContact CA-O 3.45Å; T128-A317 HydrophobicContact CG2-CB 4.27Å; T128-A317 PolarHBondContact N-O 2.7Å; T128-A317 VanDerWaalsContact N-O 3.13Å; S131-A317 PolarHBondContact OG-O 2.77Å; T264-A317 HydrophobicContact CG2-CB 4.45Å; D290-A317 HydrophobicContact CB-CB 4.2Å; D290-A317 PolarHBondContact OD1-N 3.31Å; D290-A317 WeakPolarHBondContact OD2-CB 3.44Å; D290-A317 PolarHBondContact OD2-N 2.73Å
318	W	98.7	Very high	98.5	Very high	59 Å²	59	50.9 Å²	50.9	22%	0.223	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-14.8	176.8	66.1	-88.7	0	0	0	114	S124 H315 A316 S320 M327	S124-W318 WeakPolarHBondContact CB-O 3.46Å; S124-W318 PolarHBondContact OG-O 3.24Å; H315-W318 PolarHBondContact O-NE1 3.21Å; A316-W318 PolarHBondContact O-N 3.1Å; W318-S320 PolarHBondContact O-N 2.77Å; W318-M327 HydrophobicContact CD2-CE 4.23Å; W318-M327 HydrophobicContact CE3-CE 3.3Å; W318-M327 HydrophobicContact CE3-SD 3.97Å; W318-M327 HydrophobicContact CZ3-CE 3.66Å; W318-M327 HydrophobicContact CZ3-SD 3.79Å
319	Y	98.7	Very high	98.5	Very high	144 Å²	144	51.7 Å²	51.7	57%	0.565	27%	0.265	S	S	*	.			trans	-87.6	111	-161.8	-177.9	-95.9	0	0	0	113.4	A316	A316-Y319 WeakPolarHBondContact O-CB 3.17Å; A316-Y319 PolarHBondContact O-N 2.95Å
320	S	98.6	Very high	98.6	Very high	21 Å²	21	49.8 Å²	49.8	15%	0.147	25%	0.254	C	S	.	.			trans	-124.6	162.2	149.8	74.4	0	0	0	0	109	E127 W318 Q322 A323 S324	E127-S320 WeakPolarHBondContact OE1-CB 3.45Å; E127-S320 PolarHBondContact OE1-OG 3.36Å; W318-S320 PolarHBondContact O-N 2.77Å; S320-Q322 PolarHBondContact O-N 3.08Å; S320-A323 PolarHBondContact O-N 2.74Å; S320-A323 WeakPolarHBondContact OG-CB 3.5Å; S320-A323 PolarHBondContact OG-N 2.75Å; S320-S324 VanDerWaalsContact O-CB 3.31Å; S320-S324 WeakPolarHBondContact O-CB 3.13Å; S320-S324 PolarHBondContact O-N 2.72Å
321	E	97.9	Very high	98.6	Very high	129 Å²	129	49 Å²	49	60%	0.603	25%	0.25	S	C	*	.	H	α-helix	trans	-58.2	-41.2	174.2	-178.4	178.6	-162.7	0	0	110.5	I325	E321-I325 HydrophobicContact CG-CD1 4.28Å; E321-I325 WeakPolarHBondContact O-CD1 3.38Å; E321-I325 VanDerWaalsContact O-CG1 3.32Å; E321-I325 WeakPolarHBondContact O-CG1 3.4Å; E321-I325 PolarHBondContact O-N 2.56Å; E321-I325 VanDerWaalsContact O-N 3.16Å
322	Q	98.4	Very high	98.6	Very high	128 Å²	128	48.5 Å²	48.5	60%	0.598	25%	0.247	S	C	*	.	H	α-helix	trans	-67.4	-49.1	179.4	-63.8	74.9	15.6	0	0	111.7	S320 S324 I325 E326	S320-Q322 PolarHBondContact O-N 3.08Å; Q322-S324 PolarHBondContact O-N 2.97Å; Q322-I325 PolarHBondContact O-N 3.46Å; Q322-E326 PolarHBondContact O-N 3.09Å
323	A	98.4	Very high	98.5	Very high	2 Å²	2	51.3 Å²	51.3	2%	0.017	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-43.2	177.3	0	0	0	0	0	112.4	A123 E127 S320 I325 E326 M327	A123-A323 VanDerWaalsContact O-CA 3.32Å; A123-A323 WeakPolarHBondContact O-CA 3.32Å; A123-A323 WeakPolarHBondContact O-CB 3.3Å; E127-A323 HydrophobicContact CG-CB 4.28Å; S320-A323 PolarHBondContact O-N 2.74Å; S320-A323 WeakPolarHBondContact OG-CB 3.5Å; S320-A323 PolarHBondContact OG-N 2.75Å; A323-I325 PolarHBondContact O-N 2.87Å; A323-E326 PolarHBondContact O-N 3.42Å; A323-M327 VanDerWaalsContact O-CG 3.32Å; A323-M327 WeakPolarHBondContact O-CG 3.41Å; A323-M327 PolarHBondContact O-N 3.25Å
324	S	98.4	Very high	98.5	Very high	21 Å²	21	49.2 Å²	49.2	15%	0.147	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-43.4	177.2	-172.6	0	0	0	0	111.7	S320 Q322 M327 R328	S320-S324 VanDerWaalsContact O-CB 3.31Å; S320-S324 WeakPolarHBondContact O-CB 3.13Å; S320-S324 PolarHBondContact O-N 2.72Å; Q322-S324 PolarHBondContact O-N 2.97Å; S324-M327 WeakPolarHBondContact O-CG 3.38Å; S324-R328 WeakPolarHBondContact O-CB 3.08Å; S324-R328 WeakPolarHBondContact O-CD 3.41Å; S324-R328 WeakPolarHBondContact O-CG 3.38Å; S324-R328 PolarHBondContact O-N 2.85Å
325	I	98.3	Very high	98.5	Very high	72 Å²	72	44.1 Å²	44.1	37%	0.369	21%	0.209	S	C	.	.	H	α-helix	trans	-66.3	-51.3	174.8	-66.8	165.8	0	0	0	110.7	E321 Q322 A323 M327 R328 E329	E321-I325 HydrophobicContact CG-CD1 4.28Å; E321-I325 WeakPolarHBondContact O-CD1 3.38Å; E321-I325 VanDerWaalsContact O-CG1 3.32Å; E321-I325 WeakPolarHBondContact O-CG1 3.4Å; E321-I325 PolarHBondContact O-N 2.56Å; E321-I325 VanDerWaalsContact O-N 3.16Å; Q322-I325 PolarHBondContact O-N 3.46Å; A323-I325 PolarHBondContact O-N 2.87Å; I325-M327 VanDerWaalsContact C-N 3.32Å; I325-M327 PolarHBondContact O-N 2.81Å; I325-R328 PolarHBondContact O-N 2.88Å; I325-E329 HydrophobicContact CG2-CG 4.15Å; I325-E329 WeakPolarHBondContact O-CG 3.1Å; I325-E329 PolarHBondContact O-N 2.97Å
326	E	98.4	Very high	98.5	Very high	92 Å²	92	46.9 Å²	46.9	43%	0.43	22%	0.218	S	C	.	.	H	α-helix	trans	-57.2	-44.1	-177	-171	-167.2	135.4	0	0	111.7	A123 Q322 A323 E330	A123-E326 HydrophobicContact CB-CB 4.04Å; A123-E326 HydrophobicContact CB-CG 3.95Å; A123-E326 WeakPolarHBondContact CB-OE1 3.38Å; Q322-E326 PolarHBondContact O-N 3.09Å; A323-E326 PolarHBondContact O-N 3.42Å; E326-E330 WeakPolarHBondContact O-CB 3.13Å; E326-E330 PolarHBondContact O-N 3.22Å
327	M	98.3	Very high	98.5	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.02	21%	0.212	C	C	.	.	H	α-helix	trans	-68.6	-37.8	-178.5	71.7	174.1	66.5	0	0	113.2	I98 V120 A123 S124 W318 A323 S324 I325 E330 A331	I98-M327 HydrophobicContact CG2-CB 4.17Å; I98-M327 HydrophobicContact CG2-CG 3.54Å; I98-M327 HydrophobicContact CG2-SD 3.62Å; V120-M327 HydrophobicContact CB-CB 4.46Å; V120-M327 HydrophobicContact CG1-CB 4.18Å; A123-M327 HydrophobicContact CB-CB 3.76Å; S124-M327 WeakPolarHBondContact OG-CE 3.17Å; W318-M327 HydrophobicContact CD2-CE 4.23Å; W318-M327 HydrophobicContact CE3-CE 3.3Å; W318-M327 HydrophobicContact CE3-SD 3.97Å; W318-M327 HydrophobicContact CZ3-CE 3.66Å; W318-M327 HydrophobicContact CZ3-SD 3.79Å; A323-M327 VanDerWaalsContact O-CG 3.32Å; A323-M327 WeakPolarHBondContact O-CG 3.41Å; A323-M327 PolarHBondContact O-N 3.25Å; S324-M327 WeakPolarHBondContact O-CG 3.38Å; I325-M327 VanDerWaalsContact C-N 3.32Å; I325-M327 PolarHBondContact O-N 2.81Å; M327-E330 PolarHBondContact O-N 2.84Å; M327-A331 VanDerWaalsContact O-CB 3.32Å; M327-A331 WeakPolarHBondContact O-CB 3.33Å; M327-A331 PolarHBondContact O-N 3.23Å
328	R	98.7	Very high	98.5	Very high	18 Å²	18	47.7 Å²	47.7	7%	0.068	21%	0.212	C	C	.	.	H	α-helix	trans	-68.7	-43.5	177.4	-74	175.3	65.6	-174.5	-0.9	111.2	D37 V40 E41 Y76 I98 S324 I325 A332	D37-R328 PolarHBondContact O-NH2 2.96Å; D37-R328 VanDerWaalsContact O-NH2 3.08Å; D37-R328 IonicContact OD1-NH2 2.7Å; D37-R328 PolarHBondContact OD1-NH2 3.39Å; D37-R328 VanDerWaalsContact OD1-NH2 3.14Å; D37-R328 IonicContact OD2-CZ 3.38Å; D37-R328 VanDerWaalsContact OD2-CZ 3.31Å; D37-R328 IonicContact OD2-NH1 2.77Å; D37-R328 PolarHBondContact OD2-NH1 3.12Å; D37-R328 IonicContact OD2-NH2 3.65Å; D37-R328 PolarHBondContact OD2-NH2 3.18Å; D37-R328 VanDerWaalsContact OD2-NH2 3.08Å; V40-R328 HydrophobicContact CB-CB 4.03Å; V40-R328 HydrophobicContact CG1-CB 3.79Å; E41-R328 VanDerWaalsContact OE1-CB 3.31Å; E41-R328 WeakPolarHBondContact OE1-CB 3.33Å; E41-R328 WeakPolarHBondContact OE1-CG 3.35Å; E41-R328 IonicContact OE1-CZ 2.72Å; E41-R328 IonicContact OE1-NE 3.52Å; E41-R328 PolarHBondContact OE1-NE 3.37Å; E41-R328 IonicContact OE1-NH2 3.43Å; E41-R328 IonicContact OE2-CZ 3.56Å; E41-R328 IonicContact OE2-NE 2.67Å; E41-R328 PolarHBondContact OE2-NE 3.22Å; E41-R328 IonicContact OE2-NH2 3.5Å; E41-R328 PolarHBondContact OE2-NH2 3.15Å; Y76-R328 WeakPolarHBondContact OH-CD 3.3Å; I98-R328 HydrophobicContact CG2-CG 4.05Å; S324-R328 WeakPolarHBondContact O-CB 3.08Å; S324-R328 WeakPolarHBondContact O-CD 3.41Å; S324-R328 WeakPolarHBondContact O-CG 3.38Å; S324-R328 PolarHBondContact O-N 2.85Å; I325-R328 PolarHBondContact O-N 2.88Å; R328-A332 WeakPolarHBondContact O-CB 3.39Å; R328-A332 PolarHBondContact O-N 2.98Å
329	E	98.6	Very high	98.4	Very high	69 Å²	69	46.2 Å²	46.2	32%	0.322	21%	0.208	S	C	.	.	H	α-helix	trans	-60.6	-45.9	172.7	-69.5	-161.7	154.5	0	0	112.3	V40 I44 I325 A332 R333	V40-E329 HydrophobicContact CG1-CB 4.38Å; V40-E329 HydrophobicContact CG1-CG 3.61Å; I44-E329 HydrophobicContact CD1-CB 3.88Å; I44-E329 HydrophobicContact CD1-CG 3.91Å; I325-E329 HydrophobicContact CG2-CG 4.15Å; I325-E329 WeakPolarHBondContact O-CG 3.1Å; I325-E329 PolarHBondContact O-N 2.97Å; E329-A332 PolarHBondContact O-N 2.8Å; E329-R333 WeakPolarHBondContact O-CB 3.39Å; E329-R333 WeakPolarHBondContact O-CG 3.31Å; E329-R333 PolarHBondContact O-N 3.2Å; E329-R333 IonicContact OE2-CZ 3.84Å; E329-R333 IonicContact OE2-NH1 3.6Å; E329-R333 PolarHBondContact OE2-NH1 3.29Å; E329-R333 IonicContact OE2-NH2 2.71Å; E329-R333 PolarHBondContact OE2-NH2 2.85Å
330	E	98.6	Very high	98.3	Very high	18 Å²	18	43.8 Å²	43.8	8%	0.084	21%	0.209	C	C	.	.	H	α-helix	trans	-70.5	-33.9	-176.8	-174.4	56.9	-163.9	0	0	112.5	V120 E326 M327 R333 E334 R337 K348	V120-E330 HydrophobicContact CG1-CB 4.02Å; V120-E330 HydrophobicContact CG1-CG 4.09Å; V120-E330 HydrophobicContact CG2-CB 4.29Å; V120-E330 HydrophobicContact CG2-CG 4.36Å; E326-E330 WeakPolarHBondContact O-CB 3.13Å; E326-E330 PolarHBondContact O-N 3.22Å; M327-E330 PolarHBondContact O-N 2.84Å; E330-R333 PolarHBondContact O-N 2.93Å; E330-R333 IonicContact OE2-CZ 3.6Å; E330-R333 IonicContact OE2-NE 2.75Å; E330-R333 PolarHBondContact OE2-NE 3.05Å; E330-R333 IonicContact OE2-NH2 3.27Å; E330-R333 PolarHBondContact OE2-NH2 2.96Å; E330-E334 PolarHBondContact O-N 2.86Å; E330-R337 IonicContact OE1-CZ 3.14Å; E330-R337 IonicContact OE1-NH1 3.55Å; E330-R337 PolarHBondContact OE1-NH1 3.25Å; E330-R337 VanDerWaalsContact OE1-NH1 3.08Å; E330-R337 IonicContact OE1-NH2 2.77Å; E330-R337 PolarHBondContact OE1-NH2 3.27Å; E330-R337 IonicContact OE2-NH1 3.89Å; E330-K348 VanDerWaalsContact OE1-CD 3.3Å; E330-K348 WeakPolarHBondContact OE1-CD 3.47Å; E330-K348 IonicContact OE1-NZ 2.74Å; E330-K348 PolarHBondContact OE1-NZ 3.42Å; E330-K348 IonicContact OE2-NZ 3.72Å
331	A	98.8	Very high	98.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-42.8	171.5	0	0	0	0	0	111.8	L74 V96 I98 V120 M327 R333 E334 I335	L74-A331 HydrophobicContact CD2-CB 3.95Å; V96-A331 HydrophobicContact CG1-CB 3.85Å; I98-A331 HydrophobicContact CG1-CB 3.74Å; V120-A331 HydrophobicContact CG2-CB 4.02Å; M327-A331 VanDerWaalsContact O-CB 3.32Å; M327-A331 WeakPolarHBondContact O-CB 3.33Å; M327-A331 PolarHBondContact O-N 3.23Å; A331-R333 VanDerWaalsContact C-N 3.33Å; A331-R333 PolarHBondContact O-N 2.95Å; A331-E334 PolarHBondContact O-N 2.87Å; A331-I335 PolarHBondContact O-N 3.37Å
332	A	98.8	Very high	98	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-38	172.6	0	0	0	0	0	112.2	E41 I44 L45 R328 E329 I335 R336	E41-A332 HydrophobicContact CB-CB 4.22Å; E41-A332 HydrophobicContact CG-CB 4.26Å; I44-A332 HydrophobicContact CB-CB 3.98Å; I44-A332 HydrophobicContact CD1-CB 4.02Å; I44-A332 HydrophobicContact CG2-CB 3.8Å; L45-A332 HydrophobicContact CD1-CB 4.28Å; L45-A332 WeakPolarHBondContact CD2-O 3.05Å; L45-A332 HydrophobicContact CG-CB 4.33Å; R328-A332 WeakPolarHBondContact O-CB 3.39Å; R328-A332 PolarHBondContact O-N 2.98Å; E329-A332 PolarHBondContact O-N 2.8Å; A332-I335 PolarHBondContact O-N 2.9Å; A332-R336 WeakPolarHBondContact O-CB 3.27Å; A332-R336 PolarHBondContact O-N 3.42Å
333	R	98.7	Very high	97.8	Very high	81 Å²	81	42.7 Å²	42.7	31%	0.306	20%	0.203	S	C	.	.	H	α-helix	trans	-64.6	-35.7	172.3	-73.8	-175.5	-72.3	-103.3	-2.2	112.3	I44 E329 E330 A331 R336 R337	I44-R333 HydrophobicContact CG2-CG 4.27Å; E329-R333 WeakPolarHBondContact O-CB 3.39Å; E329-R333 WeakPolarHBondContact O-CG 3.31Å; E329-R333 PolarHBondContact O-N 3.2Å; E329-R333 IonicContact OE2-CZ 3.84Å; E329-R333 IonicContact OE2-NH1 3.6Å; E329-R333 PolarHBondContact OE2-NH1 3.29Å; E329-R333 IonicContact OE2-NH2 2.71Å; E329-R333 PolarHBondContact OE2-NH2 2.85Å; E330-R333 PolarHBondContact O-N 2.93Å; E330-R333 IonicContact OE2-CZ 3.6Å; E330-R333 IonicContact OE2-NE 2.75Å; E330-R333 PolarHBondContact OE2-NE 3.05Å; E330-R333 IonicContact OE2-NH2 3.27Å; E330-R333 PolarHBondContact OE2-NH2 2.96Å; A331-R333 VanDerWaalsContact C-N 3.33Å; A331-R333 PolarHBondContact O-N 2.95Å; R333-R336 WeakPolarHBondContact O-CB 3.35Å; R333-R336 PolarHBondContact O-N 2.73Å; R333-R337 VanDerWaalsContact O-CG 3.32Å; R333-R337 WeakPolarHBondContact O-CG 3.44Å; R333-R337 PolarHBondContact O-N 3.34Å
334	E	98.7	Very high	97.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-69.3	-43.2	174.9	-164.1	73.8	83.4	0	0	112.2	I94 V96 C118 E330 A331 R336 R337 A338 L347 K348 N349	I94-E334 HydrophobicContact CD1-CG 4.31Å; V96-E334 HydrophobicContact CG1-CB 4.17Å; V96-E334 HydrophobicContact CG1-CG 4.37Å; V96-E334 HydrophobicContact CG2-CB 4.08Å; V96-E334 HydrophobicContact CG2-CG 4.05Å; C118-E334 HydrophobicContact CB-CG 3.73Å; E330-E334 PolarHBondContact O-N 2.86Å; A331-E334 PolarHBondContact O-N 2.87Å; E334-R336 VanDerWaalsContact C-N 3.29Å; E334-R336 PolarHBondContact O-N 3.47Å; E334-R337 WeakPolarHBondContact O-CB 3.36Å; E334-R337 PolarHBondContact O-N 2.99Å; E334-R337 IonicContact OE1-CZ 2.7Å; E334-R337 IonicContact OE1-NE 3.24Å; E334-R337 IonicContact OE1-NH2 3.44Å; E334-R337 PolarHBondContact OE1-NH2 3.17Å; E334-R337 IonicContact OE2-CZ 3.36Å; E334-R337 IonicContact OE2-NE 2.74Å; E334-R337 PolarHBondContact OE2-NE 3.06Å; E334-R337 IonicContact OE2-NH2 3.17Å; E334-R337 PolarHBondContact OE2-NH2 2.95Å; E334-R337 VanDerWaalsContact OE2-NH2 3.17Å; E334-A338 PolarHBondContact O-N 3.46Å; E334-L347 WeakPolarHBondContact OE2-CA 3.42Å; E334-K348 WeakPolarHBondContact OE1-CB 3.41Å; E334-K348 PolarHBondContact OE1-N 2.74Å; E334-K348 PolarHBondContact OE2-N 3.44Å; E334-N349 PolarHBondContact OE1-N 3.02Å
335	I	98.6	Very high	97.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-43.5	170.1	-68.6	-66.7	0	0	0	110.9	V30 L45 L74 I94 V96 A331 A332 R337 A338 I339	V30-I335 HydrophobicContact CB-CG2 4.5Å; V30-I335 HydrophobicContact CG1-CG1 4.45Å; V30-I335 HydrophobicContact CG1-CG2 4.01Å; V30-I335 HydrophobicContact CG2-CG2 3.64Å; L45-I335 HydrophobicContact CD1-CB 4.34Å; L45-I335 HydrophobicContact CD1-CG2 3.93Å; L45-I335 HydrophobicContact CD2-CB 4.24Å; L45-I335 HydrophobicContact CD2-CG2 3.8Å; L74-I335 HydrophobicContact CD2-CD1 4.04Å; L74-I335 HydrophobicContact CD2-CG1 3.46Å; L74-I335 VanDerWaalsContact CD2-CG1 3.46Å; L74-I335 HydrophobicContact CG-CG1 4.06Å; I94-I335 HydrophobicContact CG2-CD1 3.77Å; V96-I335 HydrophobicContact CG2-CD1 3.61Å; V96-I335 HydrophobicContact CG2-CG1 3.87Å; A331-I335 PolarHBondContact O-N 3.37Å; A332-I335 PolarHBondContact O-N 2.9Å; I335-R337 PolarHBondContact O-N 3.46Å; I335-A338 WeakPolarHBondContact O-CB 3.36Å; I335-A338 PolarHBondContact O-N 2.75Å; I335-I339 HydrophobicContact CG2-CD1 3.69Å; I335-I339 HydrophobicContact CG2-CG1 4.43Å; I335-I339 WeakPolarHBondContact O-CG1 3.32Å; I335-I339 PolarHBondContact O-N 3.28Å
336	R	98.4	Very high	97.4	Very high	80 Å²	80	47.7 Å²	47.7	30%	0.302	23%	0.234	S	C	.	.	H	α-helix	trans	-59.6	-47.7	176.3	-169.5	178.6	-176.5	93.6	9.8	111.2	I44 L45 D47 V48 A332 R333 E334 A338 I339 T340	I44-R336 PolarHBondContact O-NH1 3.32Å; L45-R336 HydrophobicContact CD2-CB 3.98Å; D47-R336 IonicContact OD1-CZ 2.77Å; D47-R336 IonicContact OD1-NH1 3.08Å; D47-R336 PolarHBondContact OD1-NH1 3.3Å; D47-R336 IonicContact OD1-NH2 3.41Å; D47-R336 IonicContact OD2-CZ 3.84Å; D47-R336 IonicContact OD2-NH1 3.08Å; D47-R336 PolarHBondContact OD2-NH1 2.98Å; D47-R336 IonicContact OD2-NH2 2.72Å; D47-R336 PolarHBondContact OD2-NH2 2.86Å; V48-R336 HydrophobicContact CG2-CG 4.33Å; A332-R336 WeakPolarHBondContact O-CB 3.27Å; A332-R336 PolarHBondContact O-N 3.42Å; R333-R336 WeakPolarHBondContact O-CB 3.35Å; R333-R336 PolarHBondContact O-N 2.73Å; E334-R336 VanDerWaalsContact C-N 3.29Å; E334-R336 PolarHBondContact O-N 3.47Å; R336-A338 VanDerWaalsContact C-N 3.26Å; R336-A338 PolarHBondContact O-N 3.06Å; R336-I339 PolarHBondContact O-N 3.4Å; R336-T340 HydrophobicContact CG-CG2 4.41Å; R336-T340 PolarHBondContact O-N 2.92Å; R336-T340 PolarHBondContact O-OG1 3.47Å; R336-T340 VanDerWaalsContact O-OG1 3.06Å
337	R	98.3	Very high	97.4	Very high	58 Å²	58	43.5 Å²	43.5	22%	0.219	21%	0.214	C	C	.	.	H	α-helix	trans	-57.3	-37.6	175.3	-73.5	-178	-63.9	-108.8	12.7	112.4	E330 R333 E334 I335 G341	E330-R337 IonicContact OE1-CZ 3.14Å; E330-R337 IonicContact OE1-NH1 3.55Å; E330-R337 PolarHBondContact OE1-NH1 3.25Å; E330-R337 VanDerWaalsContact OE1-NH1 3.08Å; E330-R337 IonicContact OE1-NH2 2.77Å; E330-R337 PolarHBondContact OE1-NH2 3.27Å; E330-R337 IonicContact OE2-NH1 3.89Å; R333-R337 VanDerWaalsContact O-CG 3.32Å; R333-R337 WeakPolarHBondContact O-CG 3.44Å; R333-R337 PolarHBondContact O-N 3.34Å; E334-R337 WeakPolarHBondContact O-CB 3.36Å; E334-R337 PolarHBondContact O-N 2.99Å; E334-R337 IonicContact OE1-CZ 2.7Å; E334-R337 IonicContact OE1-NE 3.24Å; E334-R337 IonicContact OE1-NH2 3.44Å; E334-R337 PolarHBondContact OE1-NH2 3.17Å; E334-R337 IonicContact OE2-CZ 3.36Å; E334-R337 IonicContact OE2-NE 2.74Å; E334-R337 PolarHBondContact OE2-NE 3.06Å; E334-R337 IonicContact OE2-NH2 3.17Å; E334-R337 PolarHBondContact OE2-NH2 2.95Å; E334-R337 VanDerWaalsContact OE2-NH2 3.17Å; I335-R337 PolarHBondContact O-N 3.46Å; R337-G341 WeakPolarHBondContact O-CA 3.4Å; R337-G341 PolarHBondContact O-N 3.26Å
338	A	97.9	Very high	97.4	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-69.9	-37.4	177.5	0	0	0	0	0	113.8	I94 E334 I335 R336 I343 L347	I94-A338 HydrophobicContact CB-CB 4.19Å; I94-A338 HydrophobicContact CD1-CB 3.5Å; I94-A338 HydrophobicContact CG1-CB 4.43Å; I94-A338 HydrophobicContact CG2-CB 3.76Å; E334-A338 PolarHBondContact O-N 3.46Å; I335-A338 WeakPolarHBondContact O-CB 3.36Å; I335-A338 PolarHBondContact O-N 2.75Å; R336-A338 VanDerWaalsContact C-N 3.26Å; R336-A338 PolarHBondContact O-N 3.06Å; A338-I343 HydrophobicContact CB-CD1 4.06Å; A338-I343 HydrophobicContact CB-CG1 4.12Å; A338-L347 HydrophobicContact CB-CD2 3.66Å
339	I	97.1	Very high	97.3	Very high	28 Å²	28	50 Å²	50	14%	0.144	24%	0.244	C	C	.	.	H	α-helix	trans	-78.4	-41.2	-179.3	-68.2	170.6	0	0	0	111.6	P28 V30 V48 A49 I335 R336	P28-I339 HydrophobicContact CG-CD1 4.17Å; P28-I339 HydrophobicContact CG-CG1 4.48Å; P28-I339 HydrophobicContact CG-CG2 3.98Å; V30-I339 HydrophobicContact CG2-CD1 3.83Å; V48-I339 HydrophobicContact CB-CG2 4.26Å; A49-I339 HydrophobicContact CB-CD1 3.96Å; I335-I339 HydrophobicContact CG2-CD1 3.69Å; I335-I339 HydrophobicContact CG2-CG1 4.43Å; I335-I339 WeakPolarHBondContact O-CG1 3.32Å; I335-I339 PolarHBondContact O-N 3.28Å; R336-I339 PolarHBondContact O-N 3.4Å
340	T	96.6	Very high	97.3	Very high	94 Å²	94	47.4 Å²	47.4	58%	0.577	23%	0.234	S	C	*	.	H	α-helix	trans	-90	-10.3	-177.3	65.3	0	0	0	0	114.1	V48 R336	V48-T340 HydrophobicContact CG1-CG2 3.94Å; R336-T340 HydrophobicContact CG-CG2 4.41Å; R336-T340 PolarHBondContact O-N 2.92Å; R336-T340 PolarHBondContact O-OG1 3.47Å; R336-T340 VanDerWaalsContact O-OG1 3.06Å
341	G	95.2	Very high	97.2	Very high	35 Å²	35	48.7 Å²	48.7	36%	0.361	24%	0.243	S	C	.	.	S	Bend	trans	-117.7	-157.8	-173.9	0	0	0	0	0	114	R337	R337-G341 WeakPolarHBondContact O-CA 3.4Å; R337-G341 PolarHBondContact O-N 3.26Å
342	R	94.2	Very high	97.2	Very high	191 Å²	191	48.8 Å²	48.8	72%	0.721	24%	0.244	S	C	*	.			trans	-109.7	128.9	171.9	-66.4	-175.9	-179.8	-175.5	0.1	109.8	P344 D345 S346	R342-P344 CarbonylContact O-C 3.58Å; R342-D345 PolarHBondContact O-N 2.99Å; R342-D345 VanDerWaalsContact O-N 3.14Å; R342-S346 PolarHBondContact N-OG 3.4Å; R342-S346 VanDerWaalsContact O-CB 3.3Å; R342-S346 WeakPolarHBondContact O-CB 3.2Å; R342-S346 PolarHBondContact O-N 2.8Å; R342-S346 PolarHBondContact O-OG 3.48Å
343	I	95.3	Very high	97	Very high	29 Å²	29	52.3 Å²	52.3	15%	0.149	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	131.6	171.8	-64.1	171.3	0	0	0	108.1	R93 I94 A116 A338 L347	R93-I343 HydrophobicContact CB-CD1 3.82Å; I94-I343 HydrophobicContact CB-CD1 4.4Å; A116-I343 HydrophobicContact CB-CG2 3.59Å; A338-I343 HydrophobicContact CB-CD1 4.06Å; A338-I343 HydrophobicContact CB-CG1 4.12Å; I343-L347 HydrophobicContact CG1-CD1 4.34Å; I343-L347 HydrophobicContact CG2-CD1 4.03Å
344	P	95	Very high	96.5	Very high	24 Å²	24	54.9 Å²	54.9	16%	0.156	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	cis	-93.4	-4.3	-0.9	36.3	-33.9	0	0	0	115.1	R342 S346 L347 K353 L356	R342-P344 CarbonylContact O-C 3.58Å; P344-S346 VanDerWaalsContact C-N 3.31Å; P344-S346 PolarHBondContact O-N 3.29Å; P344-L347 HydrophobicContact CB-CD1 4.42Å; P344-L347 VanDerWaalsContact O-CB 3.32Å; P344-L347 WeakPolarHBondContact O-CB 3.39Å; P344-L347 PolarHBondContact O-N 3.09Å; P344-K353 HydrophobicContact CB-CG 4.26Å; P344-L356 HydrophobicContact CB-CD1 3.75Å; P344-L356 HydrophobicContact CG-CD1 4.06Å
345	D	94.7	Very high	96.1	Very high	126 Å²	126	57.9 Å²	57.9	67%	0.674	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.6	-169.2	-53.5	-25.6	0	0	0	114.1	R342 L347	R342-D345 PolarHBondContact O-N 2.99Å; R342-D345 VanDerWaalsContact O-N 3.14Å; D345-L347 VanDerWaalsContact C-N 3.28Å; D345-L347 PolarHBondContact O-N 3.37Å
346	S	96.6	Very high	95.6	Very high	49 Å²	49	58.5 Å²	58.5	34%	0.343	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-3.5	-179.8	-55.1	0	0	0	0	113.7	R342 P344	R342-S346 PolarHBondContact N-OG 3.4Å; R342-S346 VanDerWaalsContact O-CB 3.3Å; R342-S346 WeakPolarHBondContact O-CB 3.2Å; R342-S346 PolarHBondContact O-N 2.8Å; R342-S346 PolarHBondContact O-OG 3.48Å; P344-S346 VanDerWaalsContact C-N 3.31Å; P344-S346 PolarHBondContact O-N 3.29Å
347	L	97.7	Very high	94.3	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	30%	0.303	C	S	.	.			trans	-90	125.9	-176	-53.3	-177.5	0	0	0	111.4	I94 A116 E334 A338 I343 P344 D345 C350 K353	I94-L347 HydrophobicContact CD1-CD1 3.98Å; I94-L347 HydrophobicContact CD1-CD2 3.83Å; A116-L347 HydrophobicContact CB-CD1 3.56Å; E334-L347 WeakPolarHBondContact OE2-CA 3.42Å; A338-L347 HydrophobicContact CB-CD2 3.66Å; I343-L347 HydrophobicContact CG1-CD1 4.34Å; I343-L347 HydrophobicContact CG2-CD1 4.03Å; P344-L347 HydrophobicContact CB-CD1 4.42Å; P344-L347 VanDerWaalsContact O-CB 3.32Å; P344-L347 WeakPolarHBondContact O-CB 3.39Å; P344-L347 PolarHBondContact O-N 3.09Å; D345-L347 VanDerWaalsContact C-N 3.28Å; D345-L347 PolarHBondContact O-N 3.37Å; L347-C350 HydrophobicContact CB-CB 3.72Å; L347-C350 HydrophobicContact CD1-CB 3.94Å; L347-C350 HydrophobicContact CG-CB 4.49Å; L347-K353 PolarHBondContact O-NZ 3.16Å
348	K	97.9	Very high	92.6	Very high	125 Å²	125	58.3 Å²	58.3	54%	0.543	32%	0.316	S	S	.	.	S	Bend	trans	-74.1	-48.8	-175	178	-174.1	166.4	-170.8	0	111.3	E330 E334	E330-K348 VanDerWaalsContact OE1-CD 3.3Å; E330-K348 WeakPolarHBondContact OE1-CD 3.47Å; E330-K348 IonicContact OE1-NZ 2.74Å; E330-K348 PolarHBondContact OE1-NZ 3.42Å; E330-K348 IonicContact OE2-NZ 3.72Å; E334-K348 WeakPolarHBondContact OE1-CB 3.41Å; E334-K348 PolarHBondContact OE1-N 2.74Å; E334-K348 PolarHBondContact OE2-N 3.44Å
349	N	97.6	Very high	90.6	Very high	33 Å²	33	59.7 Å²	59.7	18%	0.176	33%	0.328	C	S	.	.	S	Bend	trans	-118.7	36.6	-174.4	-57	-49.3	0	0	0	113.4	C118 N119 P121 E334 V351	C118-N349 VanDerWaalsContact CA-O 3.22Å; C118-N349 WeakPolarHBondContact CA-O 3.14Å; N119-N349 PolarHBondContact N-O 3.36Å; N119-N349 WeakPolarHBondContact O-CB 3.36Å; N119-N349 PolarHBondContact O-ND2 3.22Å; P121-N349 WeakPolarHBondContact CD-ND2 3.48Å; E334-N349 PolarHBondContact OE1-N 3.02Å; N349-V351 PolarHBondContact O-N 3.25Å
350	C	98.2	Very high	88.4	Confident	15 Å²	15	62 Å²	62	10%	0.101	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-71.7	121.3	174.9	179.3	0	0	0	0	111	V117 C118 L347 N352 K353	V117-C350 CarbonylContact O-C 3.56Å; V117-C350 VanDerWaalsContact O-CA 3.31Å; V117-C350 WeakPolarHBondContact O-CA 3.4Å; C118-C350 WeakPolarHBondContact SG-CA 3.39Å; C118-C350 VanDerWaalsContact SG-CB 3.59Å; L347-C350 HydrophobicContact CB-CB 3.72Å; L347-C350 HydrophobicContact CD1-CB 3.94Å; L347-C350 HydrophobicContact CG-CB 4.49Å; C350-N352 PolarHBondContact SG-OD1 3.24Å; C350-N352 VanDerWaalsContact SG-OD1 3.37Å; C350-K353 HydrophobicContact CB-CD 4.43Å; C350-K353 HydrophobicContact CB-CG 3.95Å
351	V	97.5	Very high	85.7	Confident	46 Å²	46	64.2 Å²	64.2	28%	0.279	35%	0.347	S	S	.	.	S	Bend	trans	-95.4	-12.3	-171.8	-58.6	0	0	0	0	114	F102 I107 V117 N119 N349	F102-V351 HydrophobicContact CD1-CB 4.41Å; F102-V351 HydrophobicContact CD1-CG1 4.03Å; F102-V351 HydrophobicContact CD1-CG2 4.09Å; F102-V351 HydrophobicContact CD2-CG2 4.12Å; F102-V351 HydrophobicContact CE1-CB 4.19Å; F102-V351 HydrophobicContact CE1-CG1 3.87Å; F102-V351 HydrophobicContact CE1-CG2 4.3Å; F102-V351 HydrophobicContact CE2-CG2 4.34Å; F102-V351 HydrophobicContact CG-CG2 3.99Å; F102-V351 HydrophobicContact CZ-CB 4.32Å; F102-V351 HydrophobicContact CZ-CG1 4.46Å; F102-V351 HydrophobicContact CZ-CG2 4.42Å; I107-V351 HydrophobicContact CD1-CG2 4.44Å; I107-V351 HydrophobicContact CG2-CG2 4.44Å; V117-V351 HydrophobicContact CB-CG2 4.21Å; V117-V351 HydrophobicContact CG1-CG2 4.07Å; V117-V351 WeakPolarHBondContact O-CG2 3.3Å; V117-V351 PolarHBondContact O-N 2.83Å; N119-V351 HydrophobicContact CB-CG1 4.47Å; N349-V351 PolarHBondContact O-N 3.25Å
352	N	97.6	Very high	82.8	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.011	37%	0.368	C	S	.	.			trans	-114.3	27.4	-178.7	75.7	-24.1	0	0	0	114.4	I107 G111 I115 V117 C350 D354 H355 L356	I107-N352 HydrophobicContact CB-CB 4.08Å; I107-N352 WeakPolarHBondContact O-CB 3.43Å; I107-N352 PolarHBondContact O-ND2 2.7Å; G111-N352 PolarHBondContact N-ND2 3.44Å; I115-N352 PolarHBondContact O-ND2 3.14Å; V117-N352 PolarHBondContact N-OD1 2.94Å; C350-N352 PolarHBondContact SG-OD1 3.24Å; C350-N352 VanDerWaalsContact SG-OD1 3.37Å; N352-D354 PolarHBondContact O-N 3.46Å; N352-D354 VanDerWaalsContact O-N 3.16Å; N352-H355 PolarHBondContact O-N 3.36Å; N352-H355 VanDerWaalsContact O-N 3.09Å; N352-L356 PolarHBondContact O-N 3.49Å
353	K	94.3	Very high	80.2	Confident	74 Å²	74	65.9 Å²	65.9	32%	0.322	35%	0.353	S	S	.	.	H	α-helix	trans	-53.3	-38.9	-175.1	-69.4	-167.2	179.1	-168.5	0	113.1	P344 L347 C350 H355 L356 T357	P344-K353 HydrophobicContact CB-CG 4.26Å; L347-K353 PolarHBondContact O-NZ 3.16Å; C350-K353 HydrophobicContact CB-CD 4.43Å; C350-K353 HydrophobicContact CB-CG 3.95Å; K353-H355 VanDerWaalsContact C-N 3.29Å; K353-H355 PolarHBondContact O-N 2.97Å; K353-L356 PolarHBondContact O-N 3.17Å; K353-T357 PolarHBondContact O-N 3.49Å
354	D	90	Very high	77.5	Confident	135 Å²	135	68.9 Å²	68.9	72%	0.722	38%	0.376	S	S	*	.	H	α-helix	trans	-71.2	-21.8	-175.8	-54.2	-31.2	0	0	0	113.5	N352 T357	N352-D354 PolarHBondContact O-N 3.46Å; N352-D354 VanDerWaalsContact O-N 3.16Å; D354-T357 PolarHBondContact O-OG1 3.21Å
355	H	89.1	Confident	74.6	Confident	63 Å²	63	74.7 Å²	74.7	29%	0.292	40%	0.403	S	S	.	.	H	α-helix	trans	-82.2	-33.3	174.8	-61.5	-60.6	0	0	0	112.1	N352 K353 A358 A359	N352-H355 PolarHBondContact O-N 3.36Å; N352-H355 VanDerWaalsContact O-N 3.09Å; K353-H355 VanDerWaalsContact C-N 3.29Å; K353-H355 PolarHBondContact O-N 2.97Å; H355-A358 PolarHBondContact O-N 3.43Å; H355-A359 PolarHBondContact O-N 3.33Å
356	L	87.4	Confident	71.6	Confident	14 Å²	14	74 Å²	74	7%	0.073	40%	0.4	C	S	.	.	H	α-helix	trans	-67.7	-36.9	179.5	-63.8	168.7	0	0	0	112.7	A116 P344 N352 K353 T360	A116-L356 HydrophobicContact CB-CD1 3.84Å; P344-L356 HydrophobicContact CB-CD1 3.75Å; P344-L356 HydrophobicContact CG-CD1 4.06Å; N352-L356 PolarHBondContact O-N 3.49Å; K353-L356 PolarHBondContact O-N 3.17Å; L356-T360 PolarHBondContact O-N 3.21Å; L356-T360 PolarHBondContact O-OG1 3.31Å
357	T	71.9	Confident	68.6	Low	74 Å²	74	77.8 Å²	77.8	45%	0.454	42%	0.423	S	S	.	.	H	α-helix	trans	-70.1	-40.4	178	51.4	0	0	0	0	111.6	K353 D354 A359 T360 H361	K353-T357 PolarHBondContact O-N 3.49Å; D354-T357 PolarHBondContact O-OG1 3.21Å; T357-A359 PolarHBondContact O-N 3.02Å; T357-T360 WeakPolarHBondContact O-CB 3.48Å; T357-T360 PolarHBondContact O-N 3.24Å; T357-T360 VanDerWaalsContact O-N 3.17Å; T357-H361 PolarHBondContact O-CD2 3.37Å; T357-H361 PolarHBondContact O-N 3.19Å
358	A	62.5	Low	65.6	Low	60 Å²	60	81.7 Å²	81.7	50%	0.496	46%	0.455	S	S	.	.	H	α-helix	trans	-58.1	-46.7	177.4	0	0	0	0	0	112.7	H355 T360 H361 W362	H355-A358 PolarHBondContact O-N 3.43Å; A358-T360 VanDerWaalsContact C-N 3.26Å; A358-T360 PolarHBondContact O-N 3.05Å; A358-H361 PolarHBondContact O-N 2.84Å; A358-W362 PolarHBondContact O-N 2.92Å
359	A	57	Low	62.6	Low	33 Å²	33	81.5 Å²	81.5	27%	0.273	47%	0.465	S	S	.	.	H	α-helix	trans	-58.9	-36.9	176.9	0	0	0	0	0	112.7	H355 T357 A363	H355-A359 PolarHBondContact O-N 3.33Å; T357-A359 PolarHBondContact O-N 3.02Å; A359-A363 PolarHBondContact O-N 3.21Å
360	T	50.7	Low	59.4	Low	75 Å²	75	86.3 Å²	86.3	46%	0.46	50%	0.495	S	S	.	.	H	α-helix	trans	-69.1	-35.7	180	-48.9	0	0	0	0	112.2	L356 T357 A358 S364	L356-T360 PolarHBondContact O-N 3.21Å; L356-T360 PolarHBondContact O-OG1 3.31Å; T357-T360 WeakPolarHBondContact O-CB 3.48Å; T357-T360 PolarHBondContact O-N 3.24Å; T357-T360 VanDerWaalsContact O-N 3.17Å; A358-T360 VanDerWaalsContact C-N 3.26Å; A358-T360 PolarHBondContact O-N 3.05Å; T360-S364 PolarHBondContact O-OG 3.22Å
361	H	40	Very low	56	Low	141 Å²	141	93.7 Å²	93.7	65%	0.653	53%	0.527	S	S	*	.	H	α-helix	trans	-70	-41	176.7	-81.7	-73.4	0	0	0	112.5	T357 A358 S364	T357-H361 PolarHBondContact O-CD2 3.37Å; T357-H361 PolarHBondContact O-N 3.19Å; A358-H361 PolarHBondContact O-N 2.84Å; H361-S364 WeakPolarHBondContact O-CB 3.49Å; H361-S364 PolarHBondContact O-N 3.18Å; H361-S364 VanDerWaalsContact O-N 3.17Å
362	W	33	Very low	53.1	Low	212 Å²	212	96.6 Å²	96.6	80%	0.803	55%	0.547	S	S	*	.	H	α-helix	trans	-66.8	-40.4	179.3	-163	-100.1	0	0	0	112.4	A358 S364 M365	A358-W362 PolarHBondContact O-N 2.92Å; W362-S364 PolarHBondContact O-N 3.09Å; W362-S364 VanDerWaalsContact O-N 3.09Å; W362-M365 PolarHBondContact O-N 3.17Å
363	A	40.6	Very low	49.9	Very low	49 Å²	49	104.5 Å²	104.5	41%	0.405	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-11	174.7	0	0	0	0	0	114.2	V15 A359	V15-A363 HydrophobicContact CG2-CB 4.05Å; A359-A363 PolarHBondContact O-N 3.21Å
364	S	39.2	Very low	47.2	Very low	92 Å²	92	108.5 Å²	108.5	64%	0.643	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	4.3	178.2	-56.5	0	0	0	0	113.8	T360 H361 W362	T360-S364 PolarHBondContact O-OG 3.22Å; H361-S364 WeakPolarHBondContact O-CB 3.49Å; H361-S364 PolarHBondContact O-N 3.18Å; H361-S364 VanDerWaalsContact O-N 3.17Å; W362-S364 PolarHBondContact O-N 3.09Å; W362-S364 VanDerWaalsContact O-N 3.09Å
365	M	32.7	Very low	44.7	Very low	147 Å²	147	109.6 Å²	109.6	72%	0.724	61%	0.614	S	S	*	*			trans	-114.6	61.8	-175.4	-64.2	-164.9	75.3	0	0	113.7	W362	W362-M365 PolarHBondContact O-N 3.17Å
366	D	32.6	Very low	42	Very low	112 Å²	112	109.9 Å²	109.9	60%	0.599	64%	0.635	S	S	*	*			trans	-130.6	93.9	164.1	-167.9	-9.5	0	0	0	112.3	A368	D366-A368 VanDerWaalsContact C-N 3.29Å; D366-A368 WeakPolarHBondContact OD1-CA 3.32Å; D366-A368 WeakPolarHBondContact OD1-CB 3.5Å; D366-A368 PolarHBondContact OD1-N 2.87Å
367	P	32.1	Very low	39.4	Very low	127 Å²	127	114.4 Å²	114.4	83%	0.825	67%	0.674	S	S	*	*			trans	-81.7	3.4	172.9	-12.9	30.7	0	0	0	114.6
368	A	35.3	Very low	37.6	Very low	86 Å²	86	114.3 Å²	114.3	71%	0.711	68%	0.68	S	S	*	*			trans	-105.3	23.3	-156.3	0	0	0	0	0	115.8	D366	D366-A368 VanDerWaalsContact C-N 3.29Å; D366-A368 WeakPolarHBondContact OD1-CA 3.32Å; D366-A368 WeakPolarHBondContact OD1-CB 3.5Å; D366-A368 PolarHBondContact OD1-N 2.87Å
369	V	34.4	Very low	36.2	Very low	122 Å²	122	121.2 Å²	121.2	74%	0.739	70%	0.695	S	S	*	*			trans	-125.7	62.4	179.4	-164	0	0	0	0	112.6
370	V	30.3	Very low	35.2	Very low	134 Å²	134	130.2 Å²	130.2	81%	0.812	72%	0.722	S	S	*	*			trans	-137	96.3	169.8	-175.3	0	0	0	0	111.4
371	H	28.5	Very low	34.5	Very low	169 Å²	169	137.4 Å²	137.4	78%	0.782	74%	0.742	S	S	*	*			trans	-165.8	159	161.7	-118	-102.3	0	0	0	107.1
372	P	36.1	Very low	34.5	Very low	107 Å²	107	135.9 Å²	135.9	70%	0.695	75%	0.745	S	S	*	*			cis	-130.4	170.1	13.1	42.2	-26.6	0	0	0	116.9
373	E	30.2	Very low	35	Very low	169 Å²	169	131.5 Å²	131.5	79%	0.79	74%	0.744	S	S	*	*			trans	24.4	112.7	143.9	-59.5	-178.5	173.2	0	0	120.3
374	L	38.2	Very low	35	Very low	157 Å²	157	132.3 Å²	132.3	82%	0.822	76%	0.756	S	S	*	*			trans	-164.8	114.9	148.1	-111.3	166.5	0	0	0	110.3
375	N	37.4	Very low	35.1	Very low	158 Å²	158	134.6 Å²	134.6	85%	0.845	77%	0.767	S	S	*	*			trans	45.7	132.8	166.2	-55.8	-24	0	0	0	119.4
376	G	31.4	Very low	35.5	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	77%	0.769	S	S	*	*			cis	142.1	109.7	3.6	0	0	0	0	0	111.1
377	A	33.5	Very low	35.7	Very low	108 Å²	108	131.7 Å²	131.7	89%	0.893	78%	0.775	S	S	*	*			trans	65.7	152.3	178.3	0	0	0	0	0	117.3
378	A	33.2	Very low	36.1	Very low	72 Å²	72	131.9 Å²	131.9	60%	0.595	77%	0.773	S	S	*	*			cis	-166.8	158.5	-24.6	0	0	0	0	0	110.9
379	Y	34.1	Very low	36.2	Very low	206 Å²	206	132.4 Å²	132.4	81%	0.808	78%	0.777	S	S	*	*			trans	70.1	149.5	171.3	-52	-65.5	0	0	0	116.6
380	R	35.3	Very low	36.7	Very low	222 Å²	222	132.3 Å²	132.3	84%	0.838	78%	0.779	S	S	*	*			cis	-147.9	-173.3	-1	-127.3	165.1	-156.3	-153.2	3.9	112.1
381	Y	36	Very low	36.9	Very low	226 Å²	226	133.3 Å²	133.3	89%	0.886	79%	0.786	S	S	*	*			trans	-90.8	169.6	-155.8	-110.2	-118.7	0	0	0	118.1
382	P	39.6	Very low	37.4	Very low	108 Å²	108	129 Å²	129	70%	0.701	79%	0.788	S	S	*	*			trans	-110.6	-122.3	-169.7	26.2	-3.1	0	0	0	115.9
383	P	44.2	Very low	37.6	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	80%	0.795	S	S	*	*				-120.7	-177.8	-97.9	37.5	-22.9	0	0	0	117
384	G	41.6	Very low	38.2	Very low	65 Å²	65	129.2 Å²	129.2	67%	0.67	79%	0.793	S	S	*	*			trans	-132.4	142.3	158.6	0	0	0	0	0	110.7
385	V	41.2	Very low	38.3	Very low	141 Å²	141	126.4 Å²	126.4	86%	0.855	79%	0.792	S	S	*	*			cis	74.3	123.5	40.6	-176.8	0	0	0	0	110.2
386	V	41.1	Very low	38.3	Very low	128 Å²	128	123.1 Å²	123.1	78%	0.776	79%	0.787	S	S	*	*			cis	-131	167.4	30.9	-173.3	0	0	0	0	108.6	V388	V386-V388 HydrophobicContact CG1-CG2 3.98Å
387	G	36	Very low	38.8	Very low	70 Å²	70	125.1 Å²	125.1	72%	0.722	79%	0.785	S	S	*	*			cis	98.3	157.1	29.7	0	0	0	0	0	111.7
388	V	40.6	Very low	39.1	Very low	130 Å²	130	129.1 Å²	129.1	79%	0.788	79%	0.785	S	S	*	*			cis	-156.2	116.3	4.9	178.5	0	0	0	0	112.7	V386	V386-V388 HydrophobicContact CG1-CG2 3.98Å
389	A	37.5	Very low	39.4	Very low	97 Å²	97	129 Å²	129	80%	0.802	79%	0.791	S	S	*	*			trans	65.7	159	141	0	0	0	0	0	125.4
390	P	44	Very low	39.5	Very low	120 Å²	120	126.8 Å²	126.8	78%	0.779	79%	0.792	S	S	*	*			trans	-121.6	169.1	-179.6	43.5	-32.4	0	0	0	116.2
391	T	34.7	Very low	39.5	Very low	156 Å²	156	122.1 Å²	122.1	96%	0.957	79%	0.787	S	S	*	*			trans	-176.2	149.7	149	30.8	0	0	0	0	112.1
392	G	40	Very low	39.8	Very low	79 Å²	79	116.6 Å²	116.6	81%	0.814	78%	0.779	S	S	*	*			trans	158.2	95.9	163.5	0	0	0	0	0	118.2
393	I	39.5	Very low	39.7	Very low	166 Å²	166	117.6 Å²	117.6	85%	0.851	79%	0.788	S	S	*	*			trans	-145.3	134.2	172.3	-66.5	177.1	0	0	0	104.8
394	P	43.2	Very low	39.1	Very low	114 Å²	114	116.2 Å²	116.2	74%	0.74	79%	0.787	S	S	*	*				-163.6	173.2	82.1	44	-22.4	0	0	0	120.9
395	A	39.7	Very low	39	Very low	97 Å²	97	122.1 Å²	122.1	80%	0.802	80%	0.8	S	S	*	*			trans	64.9	152	147.4	0	0	0	0	0	119.7
396	A	38.6	Very low	38.6	Very low	90 Å²	90	120.8 Å²	120.8	74%	0.744	80%	0.797	S	S	*	*			cis	-158.1	-143.6	-14.7	0	0	0	0	0	107.4
397	V	42.3	Very low	38.6	Very low	111 Å²	111	123.1 Å²	123.1	67%	0.673	80%	0.804	S	S	*	*			cis	-158.4	131.5	11	-177.8	0	0	0	0	109.4
398	E	38.4	Very low	38.4	Very low	192 Å²	192	124.2 Å²	124.2	90%	0.897	80%	0.801	S	S	*	*			trans	53.8	162.9	157.2	-65.8	158.8	-165.1	0	0	120.8
399	G	39.2	Very low	38.4	Very low	70 Å²	70	127.1 Å²	127.1	72%	0.722	81%	0.805	S	S	*	*			cis	-159.8	-156.8	9.6	0	0	0	0	0	115.2
400	I	36.5	Very low	38.3	Very low	160 Å²	160	125.9 Å²	125.9	82%	0.821	80%	0.802	S	S	*	*			trans	-123.2	131.7	-152.5	-72	171.6	0	0	0	114.5
401	V	35	Very low	37.9	Very low	124 Å²	124	128.7 Å²	128.7	75%	0.752	81%	0.81	S	S	*	*				24.4	156.8	126.9	-160.9	0	0	0	0	119.8
402	P	43.4	Very low	38.9	Very low	110 Å²	110	126.5 Å²	126.5	71%	0.714	80%	0.798	S	S	*	*			cis	-125.1	-179.2	-33.6	36.6	-21.3	0	0	0	113.8
403	S	36.7	Very low	38.9	Very low	128 Å²	128	128.9 Å²	128.9	90%	0.895	80%	0.799	S	S	*	*			trans	-168.2	163	135.3	-90.8	0	0	0	0	113.8
404	A	32.5	Very low	38.7	Very low	92 Å²	92	126.8 Å²	126.8	76%	0.76	79%	0.794	S	S	*	*			trans	-98.7	162.1	-174.3	0	0	0	0	0	113.9
405	M	39.8	Very low	38.9	Very low	189 Å²	189	125.9 Å²	125.9	93%	0.931	80%	0.796	S	S	*	*			trans	-146.8	136.4	142.8	-93.7	-156.2	164.2	0	0	111.3
406	S	31.4	Very low	39.1	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	80%	0.795	S	S	*	*			trans	-91.7	140.3	170.7	-54.6	0	0	0	0	110.1
407	L	41	Very low	40.2	Very low	176 Å²	176	130.5 Å²	130.5	92%	0.921	80%	0.795	S	S	*	*			trans	-131.5	128.2	158.7	-77.1	177.4	0	0	0	110.1
408	S	32.2	Very low	40.6	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	80%	0.802	S	S	*	*			trans	-98.8	-168.3	173.5	55	0	0	0	0	110.3
409	H	40.3	Very low	40.9	Very low	191 Å²	191	131.3 Å²	131.3	88%	0.884	80%	0.802	S	S	*	*			trans	80	134.9	-170.2	-45.6	-71.9	0	0	0	114.3
410	G	36.6	Very low	41.3	Very low	71 Å²	71	132.4 Å²	132.4	73%	0.732	80%	0.804	S	S	*	*			cis	177.5	140	-8.1	0	0	0	0	0	111.4
411	L	35.9	Very low	42	Very low	179 Å²	179	130.7 Å²	130.7	94%	0.937	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-88.8	130.3	-177.5	-79.6	168	0	0	0	112.9
412	P	55.3	Low	42.8	Very low	110 Å²	110	130.6 Å²	130.6	71%	0.714	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-88.1	158.6	153.5	35.2	-31	0	0	0	111.4
413	P	40.2	Very low	42.8	Very low	129 Å²	129	131.7 Å²	131.7	84%	0.838	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85	167.6	-171.4	33.9	-36.9	0	0	0	115.4
414	V	35.4	Very low	43.2	Very low	121 Å²	121	129.2 Å²	129.2	73%	0.733	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68	144.5	179.5	177.1	0	0	0	0	112.7
415	A	46.3	Very low	43.4	Very low	96 Å²	96	134 Å²	134	79%	0.793	82%	0.817	S	S	*	*			trans	-125.7	125.1	162.5	0	0	0	0	0	110.6
416	H	44.6	Very low	43.7	Very low	169 Å²	169	132 Å²	132	78%	0.782	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-97.5	135.7	173.4	-76.6	-80.3	0	0	0	110.9
417	P	61.1	Low	44.1	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.1	161.4	32.4	-32.8	0	0	0	110.8
418	P	50.1	Low	44.5	Very low	127 Å²	127	134.3 Å²	134.3	83%	0.825	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.1	162	-175.4	32.5	-36.2	0	0	0	113.9
419	H	45.7	Very low	44.8	Very low	194 Å²	194	134.6 Å²	134.6	90%	0.898	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-63.4	140.5	172.8	-85.2	-94.2	0	0	0	112.8
420	A	47.3	Very low	44.7	Very low	92 Å²	92	134.6 Å²	134.6	76%	0.76	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-96.4	132.9	162.7	0	0	0	0	0	110.5
421	P	52.2	Low	45.2	Very low	124 Å²	124	136 Å²	136	81%	0.805	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-90.8	145.2	175.1	34.6	-32.9	0	0	0	112.5
422	S	49.8	Very low	45.5	Very low	122 Å²	122	134.9 Å²	134.9	85%	0.853	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.8	172.5	-56.4	0	0	0	0	111.5
423	P	45.2	Very low	45	Very low	133 Å²	133	141.2 Å²	141.2	86%	0.864	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-91.3	152.4	176.7	35.4	-34	0	0	0	112.6
424	G	44.5	Very low	45.2	Very low	76 Å²	76	141.9 Å²	141.9	78%	0.784	82%	0.821	S	S	*	*			trans	135.5	70.3	157.7	0	0	0	0	0	118
425	Q	36.1	Very low	45.8	Very low	192 Å²	192	145 Å²	145	90%	0.897	83%	0.827	S	S	*	*			trans	-137.6	125.3	149.3	-82	-167.1	-20.1	0	0	109.9
426	T	46.1	Very low	45.9	Very low	148 Å²	148	144.9 Å²	144.9	91%	0.908	83%	0.826	S	S	*	*			trans	-132	120.7	171.6	30.7	0	0	0	0	108.9
427	V	41.1	Very low	45.8	Very low	139 Å²	139	142 Å²	142	84%	0.842	83%	0.825	S	S	*	*			trans	-89	141.4	-179.3	177.5	0	0	0	0	110.2
428	K	47.9	Very low	45.3	Very low	199 Å²	199	142.8 Å²	142.8	87%	0.865	82%	0.823	S	S	*	*			trans	-146.2	137.3	156.5	-116	-174.9	176.5	-173.1	0	109.9
429	P	39.9	Very low	45.3	Very low	100 Å²	100	144 Å²	144	65%	0.649	82%	0.818	S	S	*	*			trans	-94.9	162.3	-172.1	37.3	-36.5	0	0	0	114.6
430	E	38.2	Very low	45.7	Very low	192 Å²	192	146.5 Å²	146.5	90%	0.897	84%	0.836	S	S	*	*			trans	52.9	119.3	143.7	-67.4	169.2	160	0	0	121.5
431	A	46.2	Very low	45.7	Very low	101 Å²	101	149.2 Å²	149.2	84%	0.835	84%	0.84	S	S	*	*			trans	-160.2	147.3	138.2	0	0	0	0	0	110.1
432	D	43	Very low	45.3	Very low	154 Å²	154	150.5 Å²	150.5	82%	0.824	84%	0.842	S	S	*	*			trans	-67.1	155.2	-168.3	-50.5	-71.3	0	0	0	116.5
433	R	44.2	Very low	45.1	Very low	243 Å²	243	152.1 Å²	152.1	92%	0.917	84%	0.841	S	S	*	*				-170.3	138.9	112.5	-103.8	166.6	-176.6	-178.7	0.9	114.4
434	D	44.4	Very low	45.1	Very low	143 Å²	143	153.2 Å²	153.2	77%	0.765	84%	0.84	S	S	*	*			trans	-65.6	155.3	172.3	-50.7	-91.5	0	0	0	113.3
435	H	48.4	Very low	45.1	Very low	187 Å²	187	158.1 Å²	158.1	87%	0.866	84%	0.843	S	S	*	*				-161.9	133	120.5	-102.7	13	0	0	0	114.3
436	A	48.8	Very low	45.7	Very low	93 Å²	93	155.8 Å²	155.8	77%	0.769	84%	0.84	S	S	*	*			trans	42.8	108.2	147.9	0	0	0	0	0	120.4
437	S	42.1	Very low	45.7	Very low	109 Å²	109	156.4 Å²	156.4	76%	0.762	84%	0.835	S	S	*	*			trans	-43.8	149.3	146.9	51.5	0	0	0	0	115.1
438	D	50	Low	46	Very low	130 Å²	130	157.7 Å²	157.7	70%	0.695	83%	0.834	S	S	*	*				-158.2	143.1	116.1	-128.5	-22.4	0	0	0	115.9
439	Q	51.3	Low	45.9	Very low	154 Å²	154	154.3 Å²	154.3	72%	0.72	83%	0.832	S	S	*	*			trans	43.9	135.7	153.9	-78.5	158.5	73.2	0	0	125.5
440	L	53.9	Low	46.4	Very low	245 Å²	245	159.2 Å²	159.2	100%	1.283	85%	0.848	S	S	*	*			trans	75	0	158.5	-68.3	167.3	0	0	0	118.9

Retrieved 440 of 440 residues in 914.5 ms (Link to these results)

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