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Endoplasmic reticulum-Golgi intermediate compartment protein 3

Possible role in transport between endoplasmic reticulum and Golgi. Positively regulates trafficking of the secretory proteins SERPINA1/alpha1-antitrypsin and HP/haptoglobin¹.

AlphaFold DB , UniProt , Accession Q9Y282, Species HUMAN (Homo sapiens, Human), Gene ERGIC3, Length 383 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.6	Low	72	Confident	221 Å²	221	134.6 Å²	134.6	100%	1.089	69%	0.686	S	S	*	*				0	-24.3	0	-76.6	-165	-84.3	0	0	113.5	A3 L4	M1-A3 PolarHBondContact O-N 3.02Å; M1-L4 PolarHBondContact O-N 2.02Å
2	E	69.6	Low	71.8	Confident	170 Å²	170	130.9 Å²	130.9	79%	0.794	69%	0.69	S	S	*	*	H	α-helix	trans	-64.6	-35.7	178.9	-65.7	-179.3	159.3	0	0	114.7	L4 G5 K6	E2-L4 VanDerWaalsContact C-N 3.33Å; E2-L4 PolarHBondContact O-N 2.93Å; E2-G5 PolarHBondContact O-N 3.44Å; E2-K6 PolarHBondContact O-N 3.25Å
3	A	71.7	Confident	71.6	Confident	77 Å²	77	135.8 Å²	135.8	64%	0.636	70%	0.696	S	S	*	*	H	α-helix	trans	-62.3	-38.2	178.7	0	0	0	0	0	112.9	M1 G5 K6 L7	M1-A3 PolarHBondContact O-N 3.02Å; A3-G5 VanDerWaalsContact C-N 3.33Å; A3-G5 PolarHBondContact O-N 3.47Å; A3-K6 PolarHBondContact O-N 3.33Å; A3-L7 PolarHBondContact O-N 3.33Å
4	L	73	Confident	71.4	Confident	137 Å²	137	134.3 Å²	134.3	72%	0.717	70%	0.7	S	S	*	*	H	α-helix	trans	-68.8	-34.1	178.4	-134.2	83.5	0	0	0	111.9	M1 E2 L7 K8	M1-L4 PolarHBondContact O-N 2.02Å; E2-L4 VanDerWaalsContact C-N 3.33Å; E2-L4 PolarHBondContact O-N 2.93Å; L4-L7 PolarHBondContact O-N 2.86Å; L4-K8 PolarHBondContact O-N 3.09Å
5	G	75.1	Confident	71.4	Confident	44 Å²	44	135.3 Å²	135.3	45%	0.454	70%	0.696	S	S	.	*	H	α-helix	trans	-66.5	-38.5	175.5	0	0	0	0	0	112.7	E2 A3 K8	E2-G5 PolarHBondContact O-N 3.44Å; A3-G5 VanDerWaalsContact C-N 3.33Å; A3-G5 PolarHBondContact O-N 3.47Å; G5-K8 VanDerWaalsContact O-CB 3.29Å; G5-K8 WeakPolarHBondContact O-CB 3.05Å; G5-K8 PolarHBondContact O-N 3.06Å
6	K	77	Confident	71.3	Confident	147 Å²	147	133.1 Å²	133.1	64%	0.639	69%	0.691	S	S	*	*	H	α-helix	trans	-68.5	-36.2	175.9	-69.9	-169.1	178.5	-178.1	0	112.7	E2 A3 K8 Q9	E2-K6 PolarHBondContact O-N 3.25Å; A3-K6 PolarHBondContact O-N 3.33Å; K6-K8 PolarHBondContact O-N 2.94Å; K6-Q9 WeakPolarHBondContact O-CB 3.45Å; K6-Q9 PolarHBondContact O-N 2.8Å; K6-Q9 VanDerWaalsContact O-N 3.11Å
7	L	73.8	Confident	71.6	Confident	114 Å²	114	132.3 Å²	132.3	60%	0.597	69%	0.687	S	S	*	*	H	α-helix	trans	-61.6	-30.1	174.3	-77.3	165	0	0	0	112.6	A3 L4 Q9 F10	A3-L7 PolarHBondContact O-N 3.33Å; L4-L7 PolarHBondContact O-N 2.86Å; L7-Q9 PolarHBondContact O-N 2.99Å; L7-F10 PolarHBondContact O-N 2.74Å
8	K	69.7	Low	71.6	Confident	154 Å²	154	133.9 Å²	133.9	67%	0.67	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-63.4	-19.9	176.8	-140.8	-179	-176.4	-177.4	0	113.3	L4 G5 K6 F10	L4-K8 PolarHBondContact O-N 3.09Å; G5-K8 VanDerWaalsContact O-CB 3.29Å; G5-K8 WeakPolarHBondContact O-CB 3.05Å; G5-K8 PolarHBondContact O-N 3.06Å; K6-K8 PolarHBondContact O-N 2.94Å; K8-F10 VanDerWaalsContact C-N 3.33Å
9	Q	75.5	Confident	71.7	Confident	167 Å²	167	134.9 Å²	134.9	78%	0.78	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-78.4	-15.7	175.1	-64.7	-179.3	-18.1	0	0	113.2	K6 L7	K6-Q9 WeakPolarHBondContact O-CB 3.45Å; K6-Q9 PolarHBondContact O-N 2.8Å; K6-Q9 VanDerWaalsContact O-N 3.11Å; L7-Q9 PolarHBondContact O-N 2.99Å
10	F	73.6	Confident	71.5	Confident	178 Å²	178	136.3 Å²	136.3	78%	0.781	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-89.6	0.9	175.4	-76.1	-87	0	0	0	113.4	L7 K8 A12	L7-F10 PolarHBondContact O-N 2.74Å; K8-F10 VanDerWaalsContact C-N 3.33Å; F10-A12 PolarHBondContact O-N 2.88Å
11	D	74.4	Confident	71.5	Confident	72 Å²	72	137.7 Å²	137.7	39%	0.385	70%	0.695	S	S	.	*			trans	-73.6	93.4	175.5	-166.4	-3.3	0	0	0	109.5	Y13 K15	D11-Y13 PolarHBondContact O-N 2.97Å; D11-Y13 PolarHBondContact OD1-N 3.04Å; D11-K15 WeakPolarHBondContact OD2-CE 3.44Å; D11-K15 IonicContact OD2-NZ 3.09Å; D11-K15 PolarHBondContact OD2-NZ 2.6Å
12	A	69.7	Low	72.3	Confident	90 Å²	90	132.1 Å²	132.1	74%	0.744	67%	0.673	S	S	*	*			trans	-76.1	-6.6	-178.4	0	0	0	0	0	113.6	F10	F10-A12 PolarHBondContact O-N 2.88Å
13	Y	69.3	Low	72.8	Confident	194 Å²	194	131.7 Å²	131.7	76%	0.761	67%	0.669	S	S	*	*	S	Bend	trans	-95.3	123.1	-177	-70.6	-81.6	0	0	0	110.8	D11 K15	D11-Y13 PolarHBondContact O-N 2.97Å; D11-Y13 PolarHBondContact OD1-N 3.04Å; Y13-K15 PolarHBondContact O-N 3.23Å; Y13-K15 VanDerWaalsContact O-N 3.16Å
14	P	69.2	Low	73.3	Confident	115 Å²	115	130.3 Å²	130.3	75%	0.747	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-63.3	121.3	177.8	25.4	-32.1	0	0	0	109.4	T16	P14-T16 PolarHBondContact O-N 2.69Å
15	K	70.6	Confident	73.8	Confident	149 Å²	149	129 Å²	129	65%	0.648	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-68.9	118.7	173.8	-57.6	-158.6	-177.3	-156.1	0	108.2	D11 Y13	D11-K15 WeakPolarHBondContact OD2-CE 3.44Å; D11-K15 IonicContact OD2-NZ 3.09Å; D11-K15 PolarHBondContact OD2-NZ 2.6Å; Y13-K15 PolarHBondContact O-N 3.23Å; Y13-K15 VanDerWaalsContact O-N 3.16Å
16	T	70.5	Confident	74.3	Confident	100 Å²	100	128 Å²	128	61%	0.613	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-64.6	136.7	172.8	49.8	0	0	0	0	109.1	P14	P14-T16 PolarHBondContact O-N 2.69Å
17	L	75.5	Confident	74.8	Confident	120 Å²	120	121.6 Å²	121.6	63%	0.628	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-57.1	142.7	171.5	-64.1	163.6	0	0	0	108.4	D19 F20	L17-D19 PolarHBondContact O-N 2.74Å; L17-F20 HydrophobicContact CB-CD2 3.95Å; L17-F20 HydrophobicContact CB-CE2 4.29Å; L17-F20 HydrophobicContact CD1-CD2 4.48Å; L17-F20 HydrophobicContact CD1-CE2 4.06Å; L17-F20 PolarHBondContact O-N 3.44Å
18	E	72.5	Confident	75.5	Confident	162 Å²	162	118.5 Å²	118.5	76%	0.757	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-56.5	-30.3	-172.7	-61.7	-166.2	163.8	0	0	112.5	F20 R21	E18-F20 PolarHBondContact O-N 3.28Å; E18-R21 WeakPolarHBondContact O-CB 3.39Å; E18-R21 PolarHBondContact O-N 3.39Å; E18-R21 VanDerWaalsContact O-N 3.09Å
19	D	72.3	Confident	76.5	Confident	153 Å²	153	114.9 Å²	114.9	82%	0.818	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-63.1	-25	178.6	-60.6	-27.6	0	0	0	113.9	L17	L17-D19 PolarHBondContact O-N 2.74Å
20	F	69	Low	77.3	Confident	162 Å²	162	107.9 Å²	107.9	71%	0.711	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-96	2.2	178	-59.6	-71.7	0	0	0	113.1	L17 E18	L17-F20 HydrophobicContact CB-CD2 3.95Å; L17-F20 HydrophobicContact CB-CE2 4.29Å; L17-F20 HydrophobicContact CD1-CD2 4.48Å; L17-F20 HydrophobicContact CD1-CE2 4.06Å; L17-F20 PolarHBondContact O-N 3.44Å; E18-F20 PolarHBondContact O-N 3.28Å
21	R	71.6	Confident	78.1	Confident	165 Å²	165	103.8 Å²	103.8	62%	0.623	56%	0.559	S	S	*	*			trans	-97	101.1	-176.6	-170.7	176.4	176.9	177.8	0.9	111.2	E18 K23	E18-R21 WeakPolarHBondContact O-CB 3.39Å; E18-R21 PolarHBondContact O-N 3.39Å; E18-R21 VanDerWaalsContact O-N 3.09Å; R21-K23 HydrophobicContact CG-CG 4.38Å; R21-K23 PolarHBondContact O-N 2.85Å
22	V	74.5	Confident	79.1	Confident	105 Å²	105	105.8 Å²	105.8	64%	0.636	57%	0.568	S	S	*	*			trans	-75.2	107	170.3	-175.6	0	0	0	0	109.2	T24 Y367	V22-T24 HydrophobicContact CG1-CG2 4.11Å; V22-Y367 HydrophobicContact CG1-CE2 4.36Å
23	K	79.2	Confident	80.2	Confident	160 Å²	160	105 Å²	105	70%	0.696	55%	0.554	S	S	*	*			trans	-84.7	120	175.3	-62.9	177.1	-174.3	171.4	0	109.2	R21	R21-K23 HydrophobicContact CG-CG 4.38Å; R21-K23 PolarHBondContact O-N 2.85Å
24	T	83.2	Confident	81.4	Confident	48 Å²	48	96.7 Å²	96.7	29%	0.294	53%	0.525	S	S	.	.			trans	-115.3	144.4	174.9	64.4	0	0	0	0	110.3	V22 G26 G27 A28 Y367	V22-T24 HydrophobicContact CG1-CG2 4.11Å; T24-G26 VanDerWaalsContact C-N 3.29Å; T24-G26 PolarHBondContact O-N 3.19Å; T24-G27 PolarHBondContact O-N 2.84Å; T24-G27 PolarHBondContact OG1-N 3.34Å; T24-A28 PolarHBondContact O-N 2.03Å; T24-A28 VanDerWaalsContact O-N 3.16Å; T24-Y367 HydrophobicContact CG2-CD2 4.02Å; T24-Y367 HydrophobicContact CG2-CE2 4.13Å
25	C	84.2	Confident	82.6	Confident	110 Å²	110	93 Å²	93	74%	0.743	51%	0.507	S	S	*	.	H	α-helix	trans	-62.8	-39.3	174.4	-170.7	0	0	0	0	110.9	G27 A28 T29	C25-G27 PolarHBondContact O-N 2.96Å; C25-A28 WeakPolarHBondContact O-CB 3.46Å; C25-A28 PolarHBondContact O-N 2.8Å; C25-T29 PolarHBondContact O-N 3.49Å; C25-T29 PolarHBondContact O-OG1 2.89Å
26	G	85.3	Confident	83.8	Confident	24 Å²	24	90.7 Å²	90.7	25%	0.247	50%	0.502	C	S	.	.	H	α-helix	trans	-57.4	-46.9	174.4	0	0	0	0	0	113	T24 A28 T29 V30	T24-G26 VanDerWaalsContact C-N 3.29Å; T24-G26 PolarHBondContact O-N 3.19Å; G26-A28 VanDerWaalsContact C-N 3.33Å; G26-A28 PolarHBondContact O-N 3.43Å; G26-T29 PolarHBondContact O-N 2.92Å; G26-V30 WeakPolarHBondContact O-CG2 3.23Å; G26-V30 PolarHBondContact O-N 2.89Å
27	G	87.1	Confident	85	Confident	11 Å²	11	89.8 Å²	89.8	11%	0.113	49%	0.493	C	S	.	.	H	α-helix	trans	-65.6	-33.9	178	0	0	0	0	0	113.2	T24 C25 V30 T31 D363	T24-G27 PolarHBondContact O-N 2.84Å; T24-G27 PolarHBondContact OG1-N 3.34Å; C25-G27 PolarHBondContact O-N 2.96Å; G27-V30 PolarHBondContact O-N 3.39Å; G27-T31 WeakPolarHBondContact O-CB 3.02Å; G27-T31 PolarHBondContact O-N 3.4Å; G27-T31 PolarHBondContact O-OG1 2.78Å; G27-D363 WeakPolarHBondContact CA-OD1 3.48Å
28	A	88.4	Confident	85.9	Confident	49 Å²	49	86.6 Å²	86.6	41%	0.405	48%	0.475	S	S	.	.	H	α-helix	trans	-63.7	-44.9	172.9	0	0	0	0	0	111.6	T24 C25 G26 T31 I32	T24-A28 PolarHBondContact O-N 2.03Å; T24-A28 VanDerWaalsContact O-N 3.16Å; C25-A28 WeakPolarHBondContact O-CB 3.46Å; C25-A28 PolarHBondContact O-N 2.8Å; G26-A28 VanDerWaalsContact C-N 3.33Å; G26-A28 PolarHBondContact O-N 3.43Å; A28-T31 PolarHBondContact O-N 2.97Å; A28-I32 WeakPolarHBondContact O-CG1 3.01Å; A28-I32 PolarHBondContact O-N 3.14Å
29	T	91.2	Very high	87	Confident	79 Å²	79	83.6 Å²	83.6	49%	0.485	46%	0.464	S	S	.	.	H	α-helix	trans	-62.1	-46.5	175.8	-55.6	0	0	0	0	111.6	C25 G26 T31 I32 V33	C25-T29 PolarHBondContact O-N 3.49Å; C25-T29 PolarHBondContact O-OG1 2.89Å; G26-T29 PolarHBondContact O-N 2.92Å; T29-T31 VanDerWaalsContact C-N 3.27Å; T29-T31 PolarHBondContact O-N 3.3Å; T29-I32 PolarHBondContact O-N 3.17Å; T29-V33 HydrophobicContact CG2-CG2 4.35Å; T29-V33 WeakPolarHBondContact O-CB 3.02Å; T29-V33 VanDerWaalsContact O-CG2 3.31Å; T29-V33 WeakPolarHBondContact O-CG2 3.27Å; T29-V33 PolarHBondContact O-N 3.32Å
30	V	92.1	Very high	88.2	Confident	19 Å²	19	81.6 Å²	81.6	12%	0.115	45%	0.452	C	S	.	.	H	α-helix	trans	-59.4	-40	176.5	174.6	0	0	0	0	111.1	G26 G27 S34 A359 I362 D363 I366	G26-V30 WeakPolarHBondContact O-CG2 3.23Å; G26-V30 PolarHBondContact O-N 2.89Å; G27-V30 PolarHBondContact O-N 3.39Å; V30-S34 WeakPolarHBondContact O-CB 3.37Å; V30-S34 PolarHBondContact O-N 3.45Å; V30-S34 PolarHBondContact O-OG 3.37Å; V30-A359 HydrophobicContact CG1-CB 3.97Å; V30-I362 HydrophobicContact CG1-CG2 4.42Å; V30-I362 HydrophobicContact CG2-CG2 3.88Å; V30-D363 HydrophobicContact CG1-CB 4.49Å; V30-I366 HydrophobicContact CG2-CD1 3.58Å
31	T	91.4	Very high	89.5	Confident	93 Å²	93	77.6 Å²	77.6	57%	0.571	44%	0.438	S	S	*	.	H	α-helix	trans	-66.7	-42.2	178.5	-56.6	0	0	0	0	112.4	G27 A28 T29 S34 G35	G27-T31 WeakPolarHBondContact O-CB 3.02Å; G27-T31 PolarHBondContact O-N 3.4Å; G27-T31 PolarHBondContact O-OG1 2.78Å; A28-T31 PolarHBondContact O-N 2.97Å; T29-T31 VanDerWaalsContact C-N 3.27Å; T29-T31 PolarHBondContact O-N 3.3Å; T31-S34 WeakPolarHBondContact CA-OG 3.39Å; T31-S34 PolarHBondContact O-OG 2.81Å; T31-S34 VanDerWaalsContact O-OG 3.06Å; T31-G35 PolarHBondContact O-N 3.45Å
32	I	93.4	Very high	90.7	Very high	113 Å²	113	73.4 Å²	73.4	58%	0.579	42%	0.424	S	S	*	.	H	α-helix	trans	-66.5	-47	178.1	-68.1	168.2	0	0	0	110.2	A28 T29 G35 L36	A28-I32 WeakPolarHBondContact O-CG1 3.01Å; A28-I32 PolarHBondContact O-N 3.14Å; T29-I32 PolarHBondContact O-N 3.17Å; I32-G35 PolarHBondContact O-N 2.95Å; I32-L36 HydrophobicContact CG2-CD1 4.21Å; I32-L36 WeakPolarHBondContact O-CG 3.01Å; I32-L36 PolarHBondContact O-N 3.11Å
33	V	94.1	Very high	91.8	Very high	74 Å²	74	72.6 Å²	72.6	45%	0.448	42%	0.416	S	S	.	.	H	α-helix	trans	-64.2	-43.4	179.5	174	0	0	0	0	110.9	T29 L36 L37	T29-V33 HydrophobicContact CG2-CG2 4.35Å; T29-V33 WeakPolarHBondContact O-CB 3.02Å; T29-V33 VanDerWaalsContact O-CG2 3.31Å; T29-V33 WeakPolarHBondContact O-CG2 3.27Å; T29-V33 PolarHBondContact O-N 3.32Å; V33-L36 PolarHBondContact O-N 3.09Å; V33-L37 HydrophobicContact CG1-CD1 4.1Å; V33-L37 HydrophobicContact CG1-CG 4.45Å; V33-L37 WeakPolarHBondContact O-CB 3.3Å; V33-L37 WeakPolarHBondContact O-CG 3.27Å; V33-L37 PolarHBondContact O-N 2.67Å
34	S	93.9	Very high	92.5	Very high	20 Å²	20	68.4 Å²	68.4	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-65.9	-38.3	177.8	67.9	0	0	0	0	112.1	V30 T31 L37 M38	V30-S34 WeakPolarHBondContact O-CB 3.37Å; V30-S34 PolarHBondContact O-N 3.45Å; V30-S34 PolarHBondContact O-OG 3.37Å; T31-S34 WeakPolarHBondContact CA-OG 3.39Å; T31-S34 PolarHBondContact O-OG 2.81Å; T31-S34 VanDerWaalsContact O-OG 3.06Å; S34-L37 PolarHBondContact O-N 3.13Å; S34-M38 WeakPolarHBondContact O-CB 3.42Å; S34-M38 PolarHBondContact O-N 3.27Å
35	G	94.3	Very high	93.1	Very high	37 Å²	37	67.8 Å²	67.8	38%	0.381	40%	0.401	S	S	.	.	H	α-helix	trans	-62.4	-43.4	173.4	0	0	0	0	0	112.9	T31 I32 M38 L39	T31-G35 PolarHBondContact O-N 3.45Å; I32-G35 PolarHBondContact O-N 2.95Å; G35-M38 PolarHBondContact O-N 3.29Å; G35-L39 WeakPolarHBondContact O-CB 3.45Å; G35-L39 PolarHBondContact O-N 2.92Å
36	L	95.8	Very high	93.6	Very high	101 Å²	101	65 Å²	65	53%	0.529	38%	0.378	S	S	.	.	H	α-helix	trans	-63.9	-46.4	175.5	-73.3	173	0	0	0	111.9	I32 V33 M38 L39 L40	I32-L36 HydrophobicContact CG2-CD1 4.21Å; I32-L36 WeakPolarHBondContact O-CG 3.01Å; I32-L36 PolarHBondContact O-N 3.11Å; V33-L36 PolarHBondContact O-N 3.09Å; L36-M38 VanDerWaalsContact C-N 3.35Å; L36-M38 PolarHBondContact O-N 3.18Å; L36-L39 PolarHBondContact O-N 3.48Å; L36-L40 WeakPolarHBondContact O-CG 3.41Å; L36-L40 PolarHBondContact O-N 3.36Å
37	L	95.7	Very high	94	Very high	81 Å²	81	70.5 Å²	70.5	42%	0.424	40%	0.397	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176.7	-74.5	177.8	0	0	0	112	V33 S34 L39 L40 L41 M355	V33-L37 HydrophobicContact CG1-CD1 4.1Å; V33-L37 HydrophobicContact CG1-CG 4.45Å; V33-L37 WeakPolarHBondContact O-CB 3.3Å; V33-L37 WeakPolarHBondContact O-CG 3.27Å; V33-L37 PolarHBondContact O-N 2.67Å; S34-L37 PolarHBondContact O-N 3.13Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L39 PolarHBondContact O-N 3.31Å; L37-L40 PolarHBondContact O-N 2.99Å; L37-L41 WeakPolarHBondContact O-CB 3.28Å; L37-L41 VanDerWaalsContact O-CG 3.32Å; L37-L41 WeakPolarHBondContact O-CG 3.05Å; L37-L41 PolarHBondContact O-N 2.76Å; L37-M355 HydrophobicContact CB-CE 3.74Å; L37-M355 HydrophobicContact CD1-CE 3.92Å
38	M	95.3	Very high	94.2	Very high	53 Å²	53	75.2 Å²	75.2	26%	0.261	41%	0.412	S	S	.	.	H	α-helix	trans	-62.8	-41	177.4	-168.8	-175	-64.6	0	0	111.4	S34 G35 L36 F42 I351 I352 M355	S34-M38 WeakPolarHBondContact O-CB 3.42Å; S34-M38 PolarHBondContact O-N 3.27Å; G35-M38 PolarHBondContact O-N 3.29Å; L36-M38 VanDerWaalsContact C-N 3.35Å; L36-M38 PolarHBondContact O-N 3.18Å; M38-F42 VanDerWaalsContact O-CB 3.24Å; M38-F42 WeakPolarHBondContact O-CB 3.49Å; M38-F42 PolarHBondContact O-N 2.82Å; M38-I351 HydrophobicContact CG-CG2 4.03Å; M38-I352 HydrophobicContact CG-CG1 4.48Å; M38-I352 HydrophobicContact SD-CG1 3.95Å; M38-M355 HydrophobicContact CE-CB 3.82Å
39	L	95.6	Very high	94.4	Very high	98 Å²	98	75.8 Å²	75.8	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-45.2	174.5	-180	63.9	0	0	0	111.7	G35 L36 L37 F42 L43	G35-L39 WeakPolarHBondContact O-CB 3.45Å; G35-L39 PolarHBondContact O-N 2.92Å; L36-L39 PolarHBondContact O-N 3.48Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L39 PolarHBondContact O-N 3.31Å; L39-F42 PolarHBondContact O-N 3.44Å; L39-L43 HydrophobicContact CD1-CD1 4.38Å; L39-L43 HydrophobicContact CD1-CG 4.33Å; L39-L43 HydrophobicContact CG-CD1 4.21Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.41Å; L39-L43 PolarHBondContact O-N 3.26Å
40	L	97	Very high	94.4	Very high	112 Å²	112	77.6 Å²	77.6	59%	0.586	41%	0.411	S	S	*	.	H	α-helix	trans	-62.5	-45.6	178.2	-71.6	173.2	0	0	0	112	L36 L37 F42 L43 S44	L36-L40 WeakPolarHBondContact O-CG 3.41Å; L36-L40 PolarHBondContact O-N 3.36Å; L37-L40 PolarHBondContact O-N 2.99Å; L40-F42 VanDerWaalsContact C-N 3.34Å; L40-L43 PolarHBondContact O-N 3.41Å; L40-S44 WeakPolarHBondContact O-CB 3.36Å; L40-S44 PolarHBondContact O-N 3.31Å
41	L	96.7	Very high	94.3	Very high	77 Å²	77	79.7 Å²	79.7	40%	0.403	42%	0.424	S	S	.	.	H	α-helix	trans	-64.5	-39.7	176.6	-69.4	175.4	0	0	0	111.6	L37 S44 E45 I351 M355	L37-L41 WeakPolarHBondContact O-CB 3.28Å; L37-L41 VanDerWaalsContact O-CG 3.32Å; L37-L41 WeakPolarHBondContact O-CG 3.05Å; L37-L41 PolarHBondContact O-N 2.76Å; L41-S44 WeakPolarHBondContact O-CB 3.32Å; L41-S44 PolarHBondContact O-N 3.01Å; L41-E45 WeakPolarHBondContact O-CB 3.36Å; L41-E45 PolarHBondContact O-N 3.09Å; L41-I351 HydrophobicContact CB-CD1 4.03Å; L41-I351 HydrophobicContact CB-CG1 4.2Å; L41-I351 HydrophobicContact CB-CG2 3.76Å; L41-I351 HydrophobicContact CD1-CG2 4.11Å; L41-M355 HydrophobicContact CD1-CG 4.32Å; L41-M355 HydrophobicContact CD1-SD 4.12Å
42	F	96.6	Very high	94.2	Very high	78 Å²	78	78.3 Å²	78.3	34%	0.342	42%	0.415	S	S	.	.	H	α-helix	trans	-62.5	-45.8	174.7	174.6	-94	0	0	0	112	M38 L39 L40 S44 E45 L46 F344 V348	M38-F42 VanDerWaalsContact O-CB 3.24Å; M38-F42 WeakPolarHBondContact O-CB 3.49Å; M38-F42 PolarHBondContact O-N 2.82Å; L39-F42 PolarHBondContact O-N 3.44Å; L40-F42 VanDerWaalsContact C-N 3.34Å; F42-S44 VanDerWaalsContact C-N 3.3Å; F42-S44 PolarHBondContact O-N 3.2Å; F42-E45 PolarHBondContact O-N 3.34Å; F42-L46 HydrophobicContact CE1-CD2 4.23Å; F42-L46 VanDerWaalsContact O-CB 3.29Å; F42-L46 WeakPolarHBondContact O-CB 3.37Å; F42-L46 PolarHBondContact O-N 3.05Å; F42-F344 AromaticContact CE2-CZ 3.96Å; F42-F344 HydrophobicContact CE2-CZ 3.96Å; F42-F344 HydrophobicContact CZ-CZ 4.34Å; F42-V348 HydrophobicContact CD2-CG1 4.25Å; F42-V348 HydrophobicContact CD2-CG2 3.92Å; F42-V348 HydrophobicContact CE2-CG1 4.36Å; F42-V348 HydrophobicContact CE2-CG2 3.91Å
43	L	96.6	Very high	93.9	Very high	87 Å²	87	76.3 Å²	76.3	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-38.6	176.7	-70.6	174.5	0	0	0	111.5	L39 L40 L46 Q47	L39-L43 HydrophobicContact CD1-CD1 4.38Å; L39-L43 HydrophobicContact CD1-CG 4.33Å; L39-L43 HydrophobicContact CG-CD1 4.21Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.41Å; L39-L43 PolarHBondContact O-N 3.26Å; L40-L43 PolarHBondContact O-N 3.41Å; L43-L46 PolarHBondContact O-N 2.85Å; L43-Q47 WeakPolarHBondContact O-CB 2.94Å; L43-Q47 PolarHBondContact O-N 3.25Å
44	S	95.7	Very high	93.8	Very high	73 Å²	73	75.6 Å²	75.6	51%	0.51	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-47.2	173.5	-174.1	0	0	0	0	111.9	L40 L41 F42 L46 Q47 Y48	L40-S44 WeakPolarHBondContact O-CB 3.36Å; L40-S44 PolarHBondContact O-N 3.31Å; L41-S44 WeakPolarHBondContact O-CB 3.32Å; L41-S44 PolarHBondContact O-N 3.01Å; F42-S44 VanDerWaalsContact C-N 3.3Å; F42-S44 PolarHBondContact O-N 3.2Å; S44-L46 VanDerWaalsContact C-N 3.32Å; S44-L46 PolarHBondContact O-N 3.23Å; S44-Q47 PolarHBondContact O-N 3.47Å; S44-Y48 VanDerWaalsContact O-CB 3.28Å; S44-Y48 WeakPolarHBondContact O-CB 3.3Å; S44-Y48 PolarHBondContact O-N 2.95Å
45	E	95.3	Very high	93.8	Very high	34 Å²	34	77.8 Å²	77.8	16%	0.159	41%	0.407	C	S	.	.	H	α-helix	trans	-66.6	-36.2	179.1	-169.4	62.4	-156.6	0	0	111.3	L41 F42 Y48 Y49 F344 I351	L41-E45 WeakPolarHBondContact O-CB 3.36Å; L41-E45 PolarHBondContact O-N 3.09Å; F42-E45 PolarHBondContact O-N 3.34Å; E45-Y48 PolarHBondContact O-N 2.03Å; E45-Y49 WeakPolarHBondContact O-CB 3.2Å; E45-Y49 PolarHBondContact O-N 2.72Å; E45-F344 HydrophobicContact CG-CD2 3.9Å; E45-F344 HydrophobicContact CG-CE2 4.16Å; E45-I351 HydrophobicContact CB-CD1 3.91Å; E45-I351 HydrophobicContact CG-CD1 4.25Å
46	L	94.4	Very high	93.8	Very high	53 Å²	53	80.5 Å²	80.5	28%	0.277	42%	0.418	S	S	.	.	H	α-helix	trans	-65.5	-47.4	173.9	179.2	62.9	0	0	0	111.2	F42 L43 S44 Y48 Y49 L50 F344	F42-L46 HydrophobicContact CE1-CD2 4.23Å; F42-L46 VanDerWaalsContact O-CB 3.29Å; F42-L46 WeakPolarHBondContact O-CB 3.37Å; F42-L46 PolarHBondContact O-N 3.05Å; L43-L46 PolarHBondContact O-N 2.85Å; S44-L46 VanDerWaalsContact C-N 3.32Å; S44-L46 PolarHBondContact O-N 3.23Å; L46-Y48 VanDerWaalsContact C-N 3.28Å; L46-Y48 PolarHBondContact O-N 3.18Å; L46-Y49 PolarHBondContact O-N 2.83Å; L46-L50 HydrophobicContact CD1-CD1 4.19Å; L46-L50 HydrophobicContact CD1-CG 4.3Å; L46-L50 HydrophobicContact CG-CD1 4.06Å; L46-L50 WeakPolarHBondContact O-CB 3.13Å; L46-L50 VanDerWaalsContact O-CG 3.25Å; L46-L50 WeakPolarHBondContact O-CG 3.34Å; L46-L50 PolarHBondContact O-N 2.94Å; L46-F344 HydrophobicContact CB-CE2 4.23Å; L46-F344 HydrophobicContact CD1-CE2 4.27Å; L46-F344 HydrophobicContact CD1-CZ 4.16Å
47	Q	94.3	Very high	93.7	Very high	138 Å²	138	79.1 Å²	79.1	65%	0.645	41%	0.409	S	S	*	.	H	α-helix	trans	-60.1	-42.3	175.9	-177.1	176.6	-12.6	0	0	110.8	L43 S44 Y49 L50 T51	L43-Q47 WeakPolarHBondContact O-CB 2.94Å; L43-Q47 PolarHBondContact O-N 3.25Å; S44-Q47 PolarHBondContact O-N 3.47Å; Q47-Y49 PolarHBondContact O-N 2.9Å; Q47-L50 PolarHBondContact O-N 3.23Å; Q47-T51 WeakPolarHBondContact O-CG2 3.41Å; Q47-T51 PolarHBondContact O-N 3.01Å; Q47-T51 PolarHBondContact O-OG1 3.38Å
48	Y	91.2	Very high	93.7	Very high	110 Å²	110	80.8 Å²	80.8	43%	0.431	42%	0.418	S	S	.	.	H	α-helix	trans	-65.8	-36.2	177.9	-170.4	-128.3	0	0	0	113.2	S44 E45 L46 T51 R339	S44-Y48 VanDerWaalsContact O-CB 3.28Å; S44-Y48 WeakPolarHBondContact O-CB 3.3Å; S44-Y48 PolarHBondContact O-N 2.95Å; E45-Y48 PolarHBondContact O-N 2.03Å; L46-Y48 VanDerWaalsContact C-N 3.28Å; L46-Y48 PolarHBondContact O-N 3.18Å; Y48-T51 WeakPolarHBondContact CA-OG1 3.41Å; Y48-T51 PolarHBondContact O-OG1 2.88Å; Y48-R339 VanDerWaalsContact CE2-CZ 3.41Å; Y48-R339 WeakPolarHBondContact O-CD 3.4Å; Y48-R339 PolarHBondContact O-NE 2.59Å; Y48-R339 PolarHBondContact OH-NH1 2.94Å; Y48-R339 PolarHBondContact OH-NH2 3.46Å
49	Y	92	Very high	93.5	Very high	62 Å²	62	83.3 Å²	83.3	24%	0.243	43%	0.425	C	S	.	.	H	α-helix	trans	-67.2	-38.9	171.8	171.3	-109.8	0	0	0	112.6	E45 L46 Q47 T51 R339 F341 F344	E45-Y49 WeakPolarHBondContact O-CB 3.2Å; E45-Y49 PolarHBondContact O-N 2.72Å; L46-Y49 PolarHBondContact O-N 2.83Å; Q47-Y49 PolarHBondContact O-N 2.9Å; Y49-T51 VanDerWaalsContact C-N 3.34Å; Y49-R339 HydrophobicContact CD2-CB 4.26Å; Y49-R339 WeakPolarHBondContact CE2-O 2.9Å; Y49-F341 HydrophobicContact CE2-CB 4.5Å; Y49-F344 HydrophobicContact CD1-CD2 4.38Å; Y49-F344 HydrophobicContact CD1-CG 4.25Å; Y49-F344 HydrophobicContact CD2-CB 3.61Å; Y49-F344 HydrophobicContact CD2-CG 4.17Å; Y49-F344 HydrophobicContact CE2-CB 4.19Å; Y49-F344 HydrophobicContact CG-CB 3.83Å; Y49-F344 AromaticContact CG-CD2 3.96Å; Y49-F344 HydrophobicContact CG-CD2 3.96Å; Y49-F344 AromaticContact CG-CG 3.88Å; Y49-F344 HydrophobicContact CG-CG 3.88Å
50	L	90.9	Very high	93.4	Very high	116 Å²	116	83.7 Å²	83.7	61%	0.607	43%	0.431	S	S	*	.	H	α-helix	trans	-74	-24.4	178.6	-68.3	173.3	0	0	0	112.8	L46 Q47	L46-L50 HydrophobicContact CD1-CD1 4.19Å; L46-L50 HydrophobicContact CD1-CG 4.3Å; L46-L50 HydrophobicContact CG-CD1 4.06Å; L46-L50 WeakPolarHBondContact O-CB 3.13Å; L46-L50 VanDerWaalsContact O-CG 3.25Å; L46-L50 WeakPolarHBondContact O-CG 3.34Å; L46-L50 PolarHBondContact O-N 2.94Å; Q47-L50 PolarHBondContact O-N 3.23Å
51	T	90.6	Very high	93	Very high	63 Å²	63	80 Å²	80	39%	0.387	41%	0.411	S	S	.	.	S	Bend	trans	-75.3	136.8	173.3	58.1	0	0	0	0	111.6	Q47 Y48 Y49	Q47-T51 WeakPolarHBondContact O-CG2 3.41Å; Q47-T51 PolarHBondContact O-N 3.01Å; Q47-T51 PolarHBondContact O-OG1 3.38Å; Y48-T51 WeakPolarHBondContact CA-OG1 3.41Å; Y48-T51 PolarHBondContact O-OG1 2.88Å; Y49-T51 VanDerWaalsContact C-N 3.34Å
52	T	88.4	Confident	92.6	Very high	64 Å²	64	85 Å²	85	39%	0.393	43%	0.43	S	S	.	.			trans	-78.9	149.1	173.4	46.9	0	0	0	0	110.9	V290 H338	T52-V290 HydrophobicContact CG2-CG2 3.84Å; T52-H338 VanDerWaalsContact CG2-CE1 3.46Å; T52-H338 WeakPolarHBondContact CG2-CE1 3.4Å
53	E	88.6	Confident	92	Very high	71 Å²	71	83.1 Å²	83.1	33%	0.332	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.1	174	-170.6	173.9	167.1	0	0	109.5	H55 K337 R339	E53-H55 VanDerWaalsContact CD-CE1 3.47Å; E53-H55 IonicContact OE1-CE1 3.72Å; E53-H55 PolarHBondContact OE1-CE1 3.4Å; E53-H55 VanDerWaalsContact OE1-CE1 3.24Å; E53-H55 IonicContact OE1-ND1 3.22Å; E53-K337 PolarHBondContact N-O 3.46Å; E53-K337 PolarHBondContact O-N 2.94Å; E53-R339 IonicContact OE2-CZ 3.32Å; E53-R339 IonicContact OE2-NH1 3.73Å; E53-R339 IonicContact OE2-NH2 3.36Å; E53-R339 PolarHBondContact OE2-NH2 3.49Å
54	V	91.8	Very high	91.3	Very high	59 Å²	59	90 Å²	90	36%	0.358	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.7	177.9	-177.1	0	0	0	0	108.9	P56 L334 T335 E336	V54-P56 WeakPolarHBondContact O-CD 3.29Å; V54-L334 HydrophobicContact CG1-CB 3.81Å; V54-L334 HydrophobicContact CG1-CD2 4.03Å; V54-L334 HydrophobicContact CG1-CG 4.39Å; V54-T335 WeakPolarHBondContact CA-O 3.37Å; V54-E336 HydrophobicContact CG2-CG 4.09Å
55	H	92.8	Very high	90.5	Very high	67 Å²	67	90.6 Å²	90.6	31%	0.31	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.8	176.6	-65.2	-69	0	0	0	111	E53 T335	E53-H55 VanDerWaalsContact CD-CE1 3.47Å; E53-H55 IonicContact OE1-CE1 3.72Å; E53-H55 PolarHBondContact OE1-CE1 3.4Å; E53-H55 VanDerWaalsContact OE1-CE1 3.24Å; E53-H55 IonicContact OE1-ND1 3.22Å; H55-T335 PolarHBondContact N-O 2.82Å; H55-T335 PolarHBondContact O-N 2.91Å
56	P	94	Very high	90.1	Very high	94 Å²	94	91.6 Å²	91.6	61%	0.61	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	133.9	174.9	32.2	-32.9	0	0	0	112	V54 K333 L334	V54-P56 WeakPolarHBondContact O-CD 3.29Å; P56-K333 CarbonylContact C-O 3.58Å; P56-K333 WeakPolarHBondContact CA-O 3.29Å; P56-L334 HydrophobicContact CB-CD2 3.78Å
57	E	95	Very high	89.9	Confident	72 Å²	72	93.8 Å²	93.8	34%	0.336	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.9	172.9	-68.3	177.4	173.8	0	0	110	Y59 V332 K333	E57-Y59 HydrophobicContact CB-CD2 4.24Å; E57-Y59 HydrophobicContact CB-CE2 3.5Å; E57-Y59 VanDerWaalsContact CB-CE2 3.5Å; E57-Y59 WeakPolarHBondContact OE2-CE2 3.05Å; E57-Y59 PolarHBondContact OE2-OH 3.29Å; E57-V332 CarbonylContact O-C 3.57Å; E57-V332 WeakPolarHBondContact O-CA 3.49Å; E57-K333 HydrophobicContact CB-CB 4.4Å; E57-K333 PolarHBondContact N-O 2.89Å; E57-K333 PolarHBondContact O-N 3.37Å
58	L	94.5	Very high	89.8	Confident	116 Å²	116	87.4 Å²	87.4	61%	0.607	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	133.4	179.1	-68.4	169.5	0	0	0	111.1	M330 V332	L58-M330 HydrophobicContact CB-CE 4.21Å; L58-M330 HydrophobicContact CD1-CE 3.87Å; L58-M330 HydrophobicContact CD2-CE 4.24Å; L58-M330 HydrophobicContact CG-CE 4.34Å; L58-V332 HydrophobicContact CD2-CG2 3.68Å
59	Y	91.2	Very high	89.9	Confident	106 Å²	106	85.9 Å²	85.9	42%	0.416	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	167.5	179	-69	-88.3	0	0	0	110.9	E57 M330 M331 K333	E57-Y59 HydrophobicContact CB-CD2 4.24Å; E57-Y59 HydrophobicContact CB-CE2 3.5Å; E57-Y59 VanDerWaalsContact CB-CE2 3.5Å; E57-Y59 WeakPolarHBondContact OE2-CE2 3.05Å; E57-Y59 PolarHBondContact OE2-OH 3.29Å; Y59-M330 CarbonylContact O-C 3.6Å; Y59-M330 WeakPolarHBondContact O-CA 3.47Å; Y59-M331 PolarHBondContact N-O 2.98Å; Y59-M331 PolarHBondContact O-N 3.31Å; Y59-K333 HydrophobicContact CD2-CB 3.73Å; Y59-K333 HydrophobicContact CD2-CD 4.2Å; Y59-K333 HydrophobicContact CE2-CB 3.72Å; Y59-K333 HydrophobicContact CE2-CD 3.58Å; Y59-K333 HydrophobicContact CE2-CG 4.32Å
60	V	93.1	Very high	90	Very high	105 Å²	105	82.9 Å²	82.9	64%	0.636	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	130.6	168.7	178.3	0	0	0	0	108.4	K62	V60-K62 PolarHBondContact O-N 2.93Å
61	D	90.3	Very high	90.2	Very high	34 Å²	34	78.8 Å²	78.8	18%	0.182	41%	0.411	C	S	.	.			trans	-68.4	120.3	174.2	-168.1	-2.1	0	0	0	109.9	S63 K209 P284 P329 M331	D61-S63 WeakPolarHBondContact OD1-CB 3.31Å; D61-S63 PolarHBondContact OD1-N 2.93Å; D61-S63 PolarHBondContact OD1-OG 3.18Å; D61-S63 PolarHBondContact OD2-OG 3.07Å; D61-S63 VanDerWaalsContact OD2-OG 3.12Å; D61-K209 IonicContact OD1-NZ 3.91Å; D61-K209 IonicContact OD2-NZ 3.19Å; D61-K209 PolarHBondContact OD2-NZ 3.4Å; D61-P284 WeakPolarHBondContact OD2-CG 3.37Å; D61-P329 PolarHBondContact N-O 3.29Å; D61-P329 VanDerWaalsContact N-O 3.12Å; D61-M331 HydrophobicContact CB-CB 4.18Å; D61-M331 HydrophobicContact CB-CE 4.19Å; D61-M331 WeakPolarHBondContact OD1-CE 3.28Å
62	K	88.4	Confident	90.4	Very high	183 Å²	183	76 Å²	76	80%	0.796	39%	0.394	S	S	*	.			trans	-107.4	-1.1	176.9	-61.1	-176.6	-176.8	176.8	0	112.7	V60	V60-K62 PolarHBondContact O-N 2.93Å
63	S	83.9	Confident	90.8	Very high	39 Å²	39	74.6 Å²	74.6	27%	0.273	38%	0.384	S	S	.	.			trans	-67	141.8	178.5	61.6	0	0	0	0	110.8	D61 D66 K209	D61-S63 WeakPolarHBondContact OD1-CB 3.31Å; D61-S63 PolarHBondContact OD1-N 2.93Å; D61-S63 PolarHBondContact OD1-OG 3.18Å; D61-S63 PolarHBondContact OD2-OG 3.07Å; D61-S63 VanDerWaalsContact OD2-OG 3.12Å; S63-D66 VanDerWaalsContact CB-OD2 3.27Å; S63-D66 WeakPolarHBondContact CB-OD2 3.44Å; S63-K209 PolarHBondContact OG-NZ 2.85Å
64	R	81.2	Confident	91.2	Very high	231 Å²	231	71.4 Å²	71.4	87%	0.872	37%	0.369	S	S	*	.			trans	-140.6	136.2	178.2	-69.1	-172.7	178.2	176.5	-0.8	108.8	D66	R64-D66 VanDerWaalsContact C-N 3.28Å; R64-D66 PolarHBondContact O-N 2.56Å
65	G	79.7	Confident	91.4	Very high	86 Å²	86	70.3 Å²	70.3	89%	0.887	36%	0.361	S	S	*	.	S	Bend	trans	76.1	11.2	175.8	0	0	0	0	0	115.1
66	D	86.8	Confident	91.5	Very high	54 Å²	54	67.1 Å²	67.1	29%	0.289	35%	0.346	S	S	.	.			trans	-70.8	151.6	172.9	-69.2	-10.8	0	0	0	110.3	S63 R64 K209 R296	S63-D66 VanDerWaalsContact CB-OD2 3.27Å; S63-D66 WeakPolarHBondContact CB-OD2 3.44Å; R64-D66 VanDerWaalsContact C-N 3.28Å; R64-D66 PolarHBondContact O-N 2.56Å; D66-K209 HydrophobicContact CB-CB 4.41Å; D66-K209 HydrophobicContact CB-CD 3.98Å; D66-K209 WeakPolarHBondContact O-CB 3.21Å; D66-K209 PolarHBondContact O-N 3.4Å; D66-R296 IonicContact OD2-NH1 3.23Å
67	K	89.7	Confident	91.4	Very high	100 Å²	100	64.9 Å²	64.9	44%	0.435	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	150.3	168.1	-66.2	-69.7	-170.6	172.4	0	109.8	E206 V207 N208	K67-E206 HydrophobicContact CB-CG 4.03Å; K67-E206 HydrophobicContact CG-CG 4.4Å; K67-V207 CarbonylContact C-O 3.56Å; K67-V207 WeakPolarHBondContact CA-O 3.45Å; K67-V207 WeakPolarHBondContact CD-O 3.07Å; K67-N208 WeakPolarHBondContact CE-OD1 3.44Å; K67-N208 PolarHBondContact NZ-OD1 2.66Å
68	L	91.2	Very high	91.2	Very high	4 Å²	4	66.4 Å²	66.4	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.3	176.4	-179.9	63.2	0	0	0	108.5	I70 V207 K209 F251 N298 Y325	L68-I70 HydrophobicContact CG-CG1 4.35Å; L68-V207 HydrophobicContact CB-CG2 4.03Å; L68-V207 HydrophobicContact CD2-CG2 4.48Å; L68-V207 HydrophobicContact CG-CG2 4.47Å; L68-V207 PolarHBondContact N-O 2.88Å; L68-V207 WeakPolarHBondContact O-CG2 3.21Å; L68-V207 PolarHBondContact O-N 2.95Å; L68-K209 HydrophobicContact CB-CB 4.28Å; L68-F251 HydrophobicContact CD1-CB 4.28Å; L68-F251 HydrophobicContact CD2-CD1 3.94Å; L68-F251 HydrophobicContact CG-CD1 4.39Å; L68-N298 VanDerWaalsContact CD1-ND2 3.27Å; L68-N298 WeakPolarHBondContact CD1-ND2 3.35Å; L68-Y325 HydrophobicContact CD2-CE2 4.41Å
69	K	93.2	Very high	90.9	Very high	77 Å²	77	61.4 Å²	61.4	34%	0.335	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.3	173.1	-170.1	179.8	-177.5	-174.5	0	108.9	N71 F204 L205 F251 G252	K69-N71 WeakPolarHBondContact CE-OD1 3.02Å; K69-F204 HydrophobicContact CD-CB 4.37Å; K69-F204 HydrophobicContact CD-CD2 4.07Å; K69-F204 HydrophobicContact CD-CG 4.21Å; K69-F204 HydrophobicContact CG-CB 3.89Å; K69-F204 HydrophobicContact CG-CD2 3.78Å; K69-F204 HydrophobicContact CG-CG 4.05Å; K69-L205 CarbonylContact C-O 3.5Å; K69-L205 WeakPolarHBondContact CA-O 3.05Å; K69-F251 CarbonylContact O-C 3.49Å; K69-G252 PolarHBondContact O-N 2.96Å
70	I	94.6	Very high	90.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	110.9	176.2	-52.2	177.4	0	0	0	106.8	L68 I72 F204 L205 V207 F214 L249 S250 F251 Y325	L68-I70 HydrophobicContact CG-CG1 4.35Å; I70-I72 HydrophobicContact CG2-CD1 4.26Å; I70-I72 HydrophobicContact CG2-CG1 3.98Å; I70-F204 CarbonylContact O-C 3.32Å; I70-F204 WeakPolarHBondContact O-CA 3.25Å; I70-L205 HydrophobicContact CB-CB 4.31Å; I70-L205 PolarHBondContact N-O 2.85Å; I70-L205 PolarHBondContact O-N 3.22Å; I70-V207 HydrophobicContact CD1-CG1 4.5Å; I70-V207 HydrophobicContact CD1-CG2 3.75Å; I70-V207 HydrophobicContact CG1-CG2 4.16Å; I70-F214 HydrophobicContact CD1-CD1 3.97Å; I70-F214 HydrophobicContact CD1-CE1 4.09Å; I70-F214 HydrophobicContact CG2-CE1 3.88Å; I70-F214 HydrophobicContact CG2-CZ 4.16Å; I70-L249 HydrophobicContact CG2-CD1 4Å; I70-S250 CarbonylContact C-O 3.54Å; I70-S250 WeakPolarHBondContact CA-O 3.45Å; I70-F251 HydrophobicContact CD1-CD1 4.31Å; I70-F251 HydrophobicContact CD1-CE1 3.91Å; I70-F251 HydrophobicContact CG1-CD1 3.85Å; I70-F251 HydrophobicContact CG1-CE1 3.92Å; I70-F251 HydrophobicContact CG2-CD1 4.32Å; I70-F251 HydrophobicContact CG2-CE1 4.08Å; I70-F251 HydrophobicContact CG2-CZ 4.45Å; I70-Y325 HydrophobicContact CD1-CD1 4.43Å; I70-Y325 HydrophobicContact CD1-CE1 4.04Å
71	N	95.6	Very high	90.4	Very high	30 Å²	30	51.9 Å²	51.9	16%	0.16	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.9	176.7	-44	-69.9	0	0	0	108.8	K69 G203 L249 S250 G252	K69-N71 WeakPolarHBondContact CE-OD1 3.02Å; N71-G203 WeakPolarHBondContact CA-O 3.09Å; N71-L249 WeakPolarHBondContact O-CA 3.24Å; N71-S250 WeakPolarHBondContact CB-OG 3.25Å; N71-S250 PolarHBondContact N-O 2.93Å; N71-S250 PolarHBondContact ND2-OG 3.48Å; N71-S250 PolarHBondContact O-N 3.39Å; N71-S250 VanDerWaalsContact O-N 3.11Å; N71-G252 PolarHBondContact ND2-O 3.24Å
72	I	95.4	Very high	89.8	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.5	-170.9	-63.6	177.9	0	0	0	107.3	I70 V74 I86 L103 Y202 G203 L205 F214 F216 L249	I70-I72 HydrophobicContact CG2-CD1 4.26Å; I70-I72 HydrophobicContact CG2-CG1 3.98Å; I72-V74 HydrophobicContact CG2-CG2 3.85Å; I72-I86 HydrophobicContact CD1-CD1 3.88Å; I72-L103 HydrophobicContact CB-CD2 4.47Å; I72-Y202 CarbonylContact O-C 3.49Å; I72-Y202 WeakPolarHBondContact O-CA 3.45Å; I72-G203 PolarHBondContact N-O 2.89Å; I72-G203 PolarHBondContact O-N 2.81Å; I72-L205 HydrophobicContact CD1-CD1 3.57Å; I72-L205 HydrophobicContact CD1-CG 3.94Å; I72-F214 HydrophobicContact CD1-CD2 4.06Å; I72-F214 HydrophobicContact CD1-CE2 3.75Å; I72-F214 HydrophobicContact CD1-CZ 4.19Å; I72-F214 HydrophobicContact CG1-CE2 4.45Å; I72-F216 HydrophobicContact CD1-CZ 4.4Å; I72-F216 HydrophobicContact CG2-CE1 4.32Å; I72-F216 HydrophobicContact CG2-CZ 3.69Å; I72-L249 HydrophobicContact CG1-CD1 3.97Å
73	D	96.4	Very high	89.5	Confident	35 Å²	35	45.8 Å²	45.8	19%	0.187	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	103	161.4	-172.5	-14.8	0	0	0	108	Q200 V201 Q247 H248	D73-Q200 PolarHBondContact OD1-NE2 2.78Å; D73-Q200 PolarHBondContact OD2-NE2 2.78Å; D73-V201 WeakPolarHBondContact CA-O 3.44Å; D73-Q247 HydrophobicContact CB-CB 3.98Å; D73-Q247 WeakPolarHBondContact O-CB 3.49Å; D73-Q247 PolarHBondContact O-N 3.2Å; D73-Q247 PolarHBondContact OD1-NE2 2.9Å; D73-H248 HydrophobicContact CB-CB 4.19Å; D73-H248 PolarHBondContact N-O 3.31Å; D73-H248 PolarHBondContact O-N 3.25Å
74	V	96.4	Very high	89.6	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.3	-175.8	-172.7	0	0	0	0	110	I72 F76 V201 F216 H244 Y245 I246	I72-V74 HydrophobicContact CG2-CG2 3.85Å; V74-F76 HydrophobicContact CB-CE2 3.96Å; V74-F76 HydrophobicContact CG1-CD2 4.16Å; V74-F76 HydrophobicContact CG1-CE1 4.5Å; V74-F76 HydrophobicContact CG1-CE2 3.48Å; V74-F76 VanDerWaalsContact CG1-CE2 3.48Å; V74-F76 HydrophobicContact CG1-CZ 3.68Å; V74-V201 PolarHBondContact N-O 2.85Å; V74-V201 PolarHBondContact O-N 2.79Å; V74-F216 HydrophobicContact CB-CZ 4.43Å; V74-F216 HydrophobicContact CG2-CE2 4.35Å; V74-F216 HydrophobicContact CG2-CZ 4.14Å; V74-H244 HydrophobicContact CG1-CB 4.17Å; V74-Y245 WeakPolarHBondContact CA-O 3.31Å; V74-I246 HydrophobicContact CG1-CG1 4.33Å; V74-I246 HydrophobicContact CG2-CG1 4.33Å; V74-I246 HydrophobicContact CG2-CG2 4.35Å
75	L	95.6	Very high	89.9	Confident	36 Å²	36	33.1 Å²	33.1	19%	0.188	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.3	178.4	176.4	76.6	0	0	0	110.3	P77 L108 Q200 H244 Y245	L75-P77 HydrophobicContact CD2-CG 4.22Å; L75-P77 HydrophobicContact CG-CG 4.25Å; L75-L108 HydrophobicContact CD1-CD1 2.95Å; L75-L108 HydrophobicContact CD1-CG 4.44Å; L75-L108 HydrophobicContact CG-CD1 4.41Å; L75-Q200 HydrophobicContact CD1-CB 4.17Å; L75-H244 CarbonylContact O-C 3.6Å; L75-H244 WeakPolarHBondContact O-CA 3.43Å; L75-Y245 HydrophobicContact CB-CD1 4.35Å; L75-Y245 HydrophobicContact CD2-CD1 4.15Å; L75-Y245 PolarHBondContact N-O 2.86Å; L75-Y245 PolarHBondContact O-N 2.95Å
76	F	94.9	Very high	90.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	92.5	174.1	-65.3	-90.9	0	0	0	109.7	V74 H78 M79 L84 G198 C199 V201 F216 M242 H244 V321	V74-F76 HydrophobicContact CB-CE2 3.96Å; V74-F76 HydrophobicContact CG1-CD2 4.16Å; V74-F76 HydrophobicContact CG1-CE1 4.5Å; V74-F76 HydrophobicContact CG1-CE2 3.48Å; V74-F76 VanDerWaalsContact CG1-CE2 3.48Å; V74-F76 HydrophobicContact CG1-CZ 3.68Å; F76-H78 PolarHBondContact O-N 3.24Å; F76-H78 VanDerWaalsContact O-N 3.14Å; F76-M79 HydrophobicContact CB-CB 3.86Å; F76-M79 PolarHBondContact O-N 2.66Å; F76-L84 HydrophobicContact CB-CD2 4.46Å; F76-L84 HydrophobicContact CD2-CD2 3.4Å; F76-L84 VanDerWaalsContact CD2-CD2 3.4Å; F76-L84 HydrophobicContact CE2-CD2 3.71Å; F76-L84 HydrophobicContact CG-CD2 3.95Å; F76-L84 HydrophobicContact CZ-CD2 4.48Å; F76-G198 CarbonylContact O-C 3.53Å; F76-G198 WeakPolarHBondContact O-CA 2.95Å; F76-C199 PolarHBondContact N-O 2.81Å; F76-C199 PolarHBondContact O-N 3.13Å; F76-V201 HydrophobicContact CE2-CG2 4.49Å; F76-F216 HydrophobicContact CE1-CB 4.17Å; F76-F216 HydrophobicContact CE2-CB 4.25Å; F76-F216 AromaticContact CE2-CD1 3.83Å; F76-F216 HydrophobicContact CE2-CD1 3.83Å; F76-F216 HydrophobicContact CE2-CD2 4.49Å; F76-F216 HydrophobicContact CE2-CE1 4.27Å; F76-F216 AromaticContact CE2-CG 3.95Å; F76-F216 HydrophobicContact CE2-CG 3.95Å; F76-F216 HydrophobicContact CZ-CB 3.54Å; F76-F216 AromaticContact CZ-CD1 3.9Å; F76-F216 HydrophobicContact CZ-CD1 3.9Å; F76-F216 AromaticContact CZ-CD2 3.87Å; F76-F216 HydrophobicContact CZ-CD2 3.87Å; F76-F216 AromaticContact CZ-CG 3.5Å; F76-F216 HydrophobicContact CZ-CG 3.5Å; F76-M242 HydrophobicContact CD1-CE 4.08Å; F76-M242 HydrophobicContact CE1-CE 3.8Å; F76-H244 HydrophobicContact CD1-CB 3.77Å; F76-H244 HydrophobicContact CE1-CB 3.68Å; F76-H244 HydrophobicContact CG-CB 4.45Å; F76-H244 HydrophobicContact CZ-CB 4.29Å; F76-V321 HydrophobicContact CE1-CB 4.44Å; F76-V321 HydrophobicContact CE1-CG2 3.82Å; F76-V321 HydrophobicContact CZ-CG2 4.36Å
77	P	92.5	Very high	90.5	Very high	46 Å²	46	26.6 Å²	26.6	30%	0.299	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.9	-172.4	-23.8	35	0	0	0	115.5	L75 T243	L75-P77 HydrophobicContact CD2-CG 4.22Å; L75-P77 HydrophobicContact CG-CG 4.25Å; P77-T243 VanDerWaalsContact CD-O 3.29Å; P77-T243 WeakPolarHBondContact CD-O 3.01Å
78	H	89.9	Confident	90.5	Very high	105 Å²	105	22 Å²	22	49%	0.486	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	20.1	-174.1	-57.9	-48.1	0	0	0	112.5	F76 N241	F76-H78 PolarHBondContact O-N 3.24Å; F76-H78 VanDerWaalsContact O-N 3.14Å; H78-N241 HydrophobicContact CB-CB 3.91Å; H78-N241 PolarHBondContact CD2-ND2 2.46Å; H78-N241 VanDerWaalsContact CD2-ND2 3.28Å
79	M	88.7	Confident	90.3	Very high	10 Å²	10	25.2 Å²	25.2	5%	0.049	13%	0.133	C	C	.	.	S	Bend	trans	-131.6	118	179.1	-157.7	88.2	-76	0	0	110.7	F76 L84 E197 G198 C199 P218 F235 M242	F76-M79 HydrophobicContact CB-CB 3.86Å; F76-M79 PolarHBondContact O-N 2.66Å; M79-L84 HydrophobicContact CG-CB 4.4Å; M79-L84 HydrophobicContact CG-CD1 4.25Å; M79-E197 CarbonylContact C-O 3.57Å; M79-G198 CarbonylContact O-C 3.59Å; M79-G198 VanDerWaalsContact O-C 3.32Å; M79-C199 WeakPolarHBondContact O-CB 3.45Å; M79-C199 PolarHBondContact O-N 2.86Å; M79-C199 VanDerWaalsContact O-N 3.07Å; M79-P218 HydrophobicContact SD-CB 4.17Å; M79-F235 HydrophobicContact CE-CE1 4.47Å; M79-M242 HydrophobicContact SD-SD 3.79Å
80	P	86.9	Confident	90.1	Very high	5 Å²	5	22 Å²	22	3%	0.032	12%	0.12	C	C	.	.			trans	-70.2	146.3	178.4	-20.6	34.8	0	0	0	112.3	A82 Y83 L84 Q194	P80-A82 VanDerWaalsContact C-N 3.31Å; P80-A82 PolarHBondContact O-N 3.15Å; P80-Y83 HydrophobicContact CB-CD2 4.03Å; P80-Y83 HydrophobicContact CG-CD2 3.98Å; P80-Y83 WeakPolarHBondContact O-CB 3.35Å; P80-Y83 PolarHBondContact O-N 3.14Å; P80-L84 PolarHBondContact O-N 2.56Å; P80-Q194 HydrophobicContact CB-CB 4.14Å; P80-Q194 WeakPolarHBondContact CG-O 3.26Å
81	C	86.6	Confident	89.8	Confident	6 Å²	6	27.3 Å²	27.3	4%	0.041	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-61.1	-35.4	-176.8	-69.2	0	0	0	0	114.1	Y83 L84 K105 Q106 R107 C199	C81-Y83 PolarHBondContact O-N 2.92Å; C81-Y83 VanDerWaalsContact O-N 3.12Å; C81-L84 PolarHBondContact O-N 2.68Å; C81-K105 HydrophobicContact CB-CB 4.01Å; C81-Q106 VanDerWaalsContact SG-C 3.5Å; C81-Q106 PolarHBondContact SG-O 3.23Å; C81-Q106 VanDerWaalsContact SG-O 3.33Å; C81-R107 HydrophobicContact CB-CG 4.11Å; C81-C199 WeakPolarHBondContact CA-SG 3.31Å; C81-C199 HydrophobicContact CB-CB 3.93Å; C81-C199 WeakPolarHBondContact CB-SG 3.45Å; C81-C199 WeakPolarHBondContact SG-CA 3.41Å; C81-C199 WeakPolarHBondContact SG-CB 3.22Å; C81-C199 CovalentContact SG-SG 2.04Å; C81-C199 PolarHBondContact SG-SG 3.28Å
82	A	79.3	Confident	89.2	Confident	45 Å²	45	29.8 Å²	29.8	37%	0.372	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-62.2	-20.6	178.3	0	0	0	0	0	113.4	P80 M191	P80-A82 VanDerWaalsContact C-N 3.31Å; P80-A82 PolarHBondContact O-N 3.15Å; A82-M191 HydrophobicContact CB-CE 3.74Å; A82-M191 HydrophobicContact CB-SD 4.31Å
83	Y	80.1	Confident	88.4	Confident	44 Å²	44	31.8 Å²	31.8	17%	0.173	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-103.8	-15.8	-176.2	-79.2	-44.7	0	0	0	113.6	P80 C81 M191 P218 G219 F235	P80-Y83 HydrophobicContact CB-CD2 4.03Å; P80-Y83 HydrophobicContact CG-CD2 3.98Å; P80-Y83 WeakPolarHBondContact O-CB 3.35Å; P80-Y83 PolarHBondContact O-N 3.14Å; C81-Y83 PolarHBondContact O-N 2.92Å; C81-Y83 VanDerWaalsContact O-N 3.12Å; Y83-M191 HydrophobicContact CD2-SD 4.34Å; Y83-M191 HydrophobicContact CE1-SD 3.89Å; Y83-M191 HydrophobicContact CE2-SD 3.53Å; Y83-M191 VanDerWaalsContact CE2-SD 3.53Å; Y83-M191 WeakPolarHBondContact OH-CG 3.21Å; Y83-M191 PolarHBondContact OH-SD 3.5Å; Y83-P218 CarbonylContact O-C 3.43Å; Y83-P218 VanDerWaalsContact O-CA 3.31Å; Y83-P218 WeakPolarHBondContact O-CA 3.32Å; Y83-G219 PolarHBondContact O-N 3.43Å; Y83-F235 VanDerWaalsContact CB-CZ 3.45Å; Y83-F235 AromaticContact CD1-CE1 3.6Å; Y83-F235 HydrophobicContact CD1-CE1 3.6Å; Y83-F235 AromaticContact CD1-CE2 3.86Å; Y83-F235 HydrophobicContact CD1-CE2 3.86Å; Y83-F235 AromaticContact CD1-CZ 3.03Å; Y83-F235 HydrophobicContact CD1-CZ 3.03Å; Y83-F235 AromaticContact CD2-CE1 3.88Å; Y83-F235 HydrophobicContact CD2-CE1 3.88Å; Y83-F235 HydrophobicContact CD2-CZ 4.13Å; Y83-F235 HydrophobicContact CE1-CE1 4.04Å; Y83-F235 HydrophobicContact CE1-CE2 4.35Å; Y83-F235 AromaticContact CE1-CZ 3.72Å; Y83-F235 HydrophobicContact CE1-CZ 3.72Å; Y83-F235 HydrophobicContact CE2-CE1 4.34Å; Y83-F235 AromaticContact CG-CE1 3.47Å; Y83-F235 HydrophobicContact CG-CE1 3.47Å; Y83-F235 VanDerWaalsContact CG-CE1 3.47Å; Y83-F235 HydrophobicContact CG-CE2 4.44Å; Y83-F235 AromaticContact CG-CZ 3.26Å; Y83-F235 HydrophobicContact CG-CZ 3.26Å
84	L	86.3	Confident	87.7	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.6	-178.9	-172.1	64.4	0	0	0	109.6	F76 M79 P80 C81 K105 C199 V201 F216 M242	F76-L84 HydrophobicContact CB-CD2 4.46Å; F76-L84 HydrophobicContact CD2-CD2 3.4Å; F76-L84 VanDerWaalsContact CD2-CD2 3.4Å; F76-L84 HydrophobicContact CE2-CD2 3.71Å; F76-L84 HydrophobicContact CG-CD2 3.95Å; F76-L84 HydrophobicContact CZ-CD2 4.48Å; M79-L84 HydrophobicContact CG-CB 4.4Å; M79-L84 HydrophobicContact CG-CD1 4.25Å; P80-L84 PolarHBondContact O-N 2.56Å; C81-L84 PolarHBondContact O-N 2.68Å; L84-K105 WeakPolarHBondContact O-CE 3.49Å; L84-K105 PolarHBondContact O-NZ 3.09Å; L84-C199 HydrophobicContact CD2-CB 4.16Å; L84-V201 HydrophobicContact CD2-CG2 3.46Å; L84-V201 VanDerWaalsContact CD2-CG2 3.46Å; L84-V201 HydrophobicContact CG-CG2 4.49Å; L84-F216 HydrophobicContact CD1-CB 3.94Å; L84-M242 HydrophobicContact CD1-CE 4.23Å
85	S	87.3	Confident	86.8	Confident	1 Å²	1	36 Å²	36	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	151.8	168.7	58.9	0	0	0	0	110.4	F216 A217 G219 H230	S85-F216 WeakPolarHBondContact O-CA 3.3Å; S85-A217 PolarHBondContact N-O 3.49Å; S85-A217 PolarHBondContact O-N 3.18Å; S85-A217 VanDerWaalsContact O-N 3.17Å; S85-A217 PolarHBondContact OG-O 2.96Å; S85-A217 VanDerWaalsContact OG-O 3.13Å; S85-G219 WeakPolarHBondContact CB-O 3.43Å; S85-G219 PolarHBondContact OG-O 2.97Å; S85-H230 PolarHBondContact OG-CE1 3.14Å; S85-H230 PolarHBondContact OG-ND1 2.61Å
86	I	90.1	Very high	85.9	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.2	171.8	-171.4	178.8	0	0	0	108.7	I72 D98 V99 L103 L205 H215 F216	I72-I86 HydrophobicContact CD1-CD1 3.88Å; I86-D98 VanDerWaalsContact O-CA 3.26Å; I86-D98 WeakPolarHBondContact O-CA 3.48Å; I86-D98 PolarHBondContact O-N 2.88Å; I86-V99 PolarHBondContact O-N 2.88Å; I86-L103 HydrophobicContact CD1-CD1 3.51Å; I86-L103 HydrophobicContact CG1-CD1 4.43Å; I86-L103 HydrophobicContact CG2-CD1 3.6Å; I86-L205 HydrophobicContact CD1-CD1 3.89Å; I86-L205 HydrophobicContact CD1-CG 4.43Å; I86-H215 WeakPolarHBondContact CA-O 3.19Å; I86-F216 HydrophobicContact CB-CD1 4.17Å; I86-F216 HydrophobicContact CB-CE1 4.29Å; I86-F216 HydrophobicContact CD1-CD1 4.15Å; I86-F216 HydrophobicContact CD1-CE1 3.47Å; I86-F216 VanDerWaalsContact CD1-CE1 3.47Å; I86-F216 HydrophobicContact CD1-CZ 3.81Å; I86-F216 HydrophobicContact CG1-CD1 4.07Å; I86-F216 HydrophobicContact CG1-CE1 3.91Å; I86-F216 HydrophobicContact CG1-CZ 4.44Å
87	D	89	Confident	84.7	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.011	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	151.9	176.1	-52.8	-49.6	0	0	0	110.2	Q96 L97 D98 F214 H215 S221 H228 H230	D87-Q96 WeakPolarHBondContact CA-O 3.48Å; D87-L97 HydrophobicContact CB-CD2 4.43Å; D87-L97 WeakPolarHBondContact OD1-CA 3.29Å; D87-D98 PolarHBondContact OD1-N 2.82Å; D87-F214 CarbonylContact O-C 3.55Å; D87-F214 WeakPolarHBondContact O-CA 3.44Å; D87-F214 VanDerWaalsContact O-CB 3.29Å; D87-F214 WeakPolarHBondContact O-CB 3.46Å; D87-H215 PolarHBondContact N-O 3.45Å; D87-H215 VanDerWaalsContact N-O 3.14Å; D87-H215 PolarHBondContact O-N 2.93Å; D87-H215 IonicContact OD2-CE1 2.97Å; D87-H215 IonicContact OD2-NE2 2.68Å; D87-H215 PolarHBondContact OD2-NE2 3.29Å; D87-H215 VanDerWaalsContact OD2-NE2 3.13Å; D87-S221 VanDerWaalsContact CG-OG 3.23Å; D87-S221 WeakPolarHBondContact OD1-CB 3.42Å; D87-S221 PolarHBondContact OD1-OG 2.85Å; D87-S221 WeakPolarHBondContact OD2-CB 3.37Å; D87-S221 PolarHBondContact OD2-OG 2.85Å; D87-H228 IonicContact OD2-CE1 3.54Å; D87-H228 PolarHBondContact OD2-CE1 2.68Å; D87-H228 VanDerWaalsContact OD2-CE1 3.24Å; D87-H228 IonicContact OD2-NE2 3.02Å; D87-H228 PolarHBondContact OD2-NE2 2.94Å; D87-H230 IonicContact OD2-CE1 3.88Å; D87-H230 PolarHBondContact OD2-CE1 3.24Å; D87-H230 IonicContact OD2-NE2 3.32Å; D87-H230 PolarHBondContact OD2-NE2 3.14Å; D87-H230 VanDerWaalsContact OD2-NE2 3.11Å
88	A	90.5	Very high	83.4	Confident	4 Å²	4	38.8 Å²	38.8	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137	169.3	0	0	0	0	0	109.9	Q95 Q96 L205 V207 N213 F214	A88-Q95 WeakPolarHBondContact O-CA 3.4Å; A88-Q96 PolarHBondContact N-O 2.94Å; A88-Q96 PolarHBondContact O-N 2.84Å; A88-L205 HydrophobicContact CB-CD1 4.46Å; A88-V207 HydrophobicContact CB-CG1 4.12Å; A88-N213 CarbonylContact C-O 3.46Å; A88-N213 WeakPolarHBondContact CA-O 3.45Å; A88-F214 HydrophobicContact CB-CB 4.09Å
89	M	87.6	Confident	82.2	Confident	70 Å²	70	34.5 Å²	34.5	35%	0.345	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.1	176.3	-178.9	174.7	-177.8	0	0	110.1	E94 Q95 G212 N213	M89-E94 WeakPolarHBondContact CA-O 3.42Å; M89-Q95 HydrophobicContact CB-CG 4.26Å; M89-Q95 HydrophobicContact CG-CG 3.88Å; M89-Q95 HydrophobicContact SD-CG 4.24Å; M89-Q95 PolarHBondContact SD-NE2 2.91Å; M89-G212 CarbonylContact O-C 3.59Å; M89-G212 VanDerWaalsContact O-CA 3.23Å; M89-G212 WeakPolarHBondContact O-CA 3.42Å; M89-N213 PolarHBondContact N-O 2.81Å; M89-N213 PolarHBondContact O-N 3.12Å; M89-N213 VanDerWaalsContact O-O 3.14Å
90	D	88.3	Confident	81.1	Confident	11 Å²	11	36.1 Å²	36.1	6%	0.059	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	168.3	176.1	79.5	12.1	0	0	0	113	A92 G93 E94 N208 V210	D90-A92 PolarHBondContact O-N 2.97Å; D90-A92 VanDerWaalsContact OD1-CA 3.27Å; D90-A92 WeakPolarHBondContact OD1-CA 3.42Å; D90-A92 VanDerWaalsContact OD1-CB 3.29Å; D90-A92 WeakPolarHBondContact OD1-CB 2.96Å; D90-A92 PolarHBondContact OD1-N 2.71Å; D90-G93 PolarHBondContact O-N 2.87Å; D90-G93 VanDerWaalsContact O-N 3.09Å; D90-G93 PolarHBondContact OD1-N 2.95Å; D90-E94 PolarHBondContact N-O 2.62Å; D90-E94 WeakPolarHBondContact OD1-CB 3.43Å; D90-E94 PolarHBondContact OD1-N 3.14Å; D90-E94 WeakPolarHBondContact OD2-CB 3.4Å; D90-N208 PolarHBondContact OD2-ND2 2.81Å; D90-V210 HydrophobicContact CB-CG2 3.72Å
91	V	88.1	Confident	80.3	Confident	111 Å²	111	42 Å²	42	67%	0.673	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-15.3	176.3	-68	0	0	0	0	113.9	V210 A211	V91-V210 HydrophobicContact CG2-CB 4.19Å; V91-V210 HydrophobicContact CG2-CG2 4.25Å; V91-A211 HydrophobicContact CG1-CB 3.86Å; V91-A211 WeakPolarHBondContact CG1-O 3.39Å; V91-A211 HydrophobicContact CG2-CB 4.39Å; V91-A211 WeakPolarHBondContact CG2-O 3.46Å; V91-A211 PolarHBondContact N-O 3.22Å
92	A	83.5	Confident	80.2	Confident	82 Å²	82	44 Å²	44	68%	0.678	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.1	173	0	0	0	0	0	111.8	D90 E94	D90-A92 PolarHBondContact O-N 2.97Å; D90-A92 VanDerWaalsContact OD1-CA 3.27Å; D90-A92 WeakPolarHBondContact OD1-CA 3.42Å; D90-A92 VanDerWaalsContact OD1-CB 3.29Å; D90-A92 WeakPolarHBondContact OD1-CB 2.96Å; D90-A92 PolarHBondContact OD1-N 2.71Å; A92-E94 VanDerWaalsContact C-N 3.33Å
93	G	78.8	Confident	80.5	Confident	45 Å²	45	42.1 Å²	42.1	46%	0.464	24%	0.236	S	C	.	.			trans	83.2	9.1	-176.5	0	0	0	0	0	113.3	D90 Q95	D90-G93 PolarHBondContact O-N 2.87Å; D90-G93 VanDerWaalsContact O-N 3.09Å; D90-G93 PolarHBondContact OD1-N 2.95Å; G93-Q95 PolarHBondContact O-N 2.8Å
94	E	81.8	Confident	81	Confident	86 Å²	86	42.9 Å²	42.9	40%	0.402	24%	0.24	S	C	.	.			trans	-68.5	123.5	168.4	-164.9	176.9	138.5	0	0	108	M89 D90 A92 N208	M89-E94 WeakPolarHBondContact CA-O 3.42Å; D90-E94 PolarHBondContact N-O 2.62Å; D90-E94 WeakPolarHBondContact OD1-CB 3.43Å; D90-E94 PolarHBondContact OD1-N 3.14Å; D90-E94 WeakPolarHBondContact OD2-CB 3.4Å; A92-E94 VanDerWaalsContact C-N 3.33Å; E94-N208 PolarHBondContact OE2-ND2 2.9Å
95	Q	77.5	Confident	81.2	Confident	42 Å²	42	43.4 Å²	43.4	20%	0.196	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.1	178.4	-69.5	179.9	-17.5	0	0	108.2	A88 M89 G93 L97	A88-Q95 WeakPolarHBondContact O-CA 3.4Å; M89-Q95 HydrophobicContact CB-CG 4.26Å; M89-Q95 HydrophobicContact CG-CG 3.88Å; M89-Q95 HydrophobicContact SD-CG 4.24Å; M89-Q95 PolarHBondContact SD-NE2 2.91Å; G93-Q95 PolarHBondContact O-N 2.8Å; Q95-L97 HydrophobicContact CB-CD2 4.25Å; Q95-L97 HydrophobicContact CB-CG 4.46Å
96	Q	76.6	Confident	81.4	Confident	50 Å²	50	44 Å²	44	23%	0.234	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	103.3	166.3	-56.9	-175.5	24.6	0	0	106.5	D87 A88 V99 E206	D87-Q96 WeakPolarHBondContact CA-O 3.48Å; A88-Q96 PolarHBondContact N-O 2.94Å; A88-Q96 PolarHBondContact O-N 2.84Å; Q96-V99 HydrophobicContact CB-CG2 3.4Å; Q96-V99 VanDerWaalsContact CB-CG2 3.4Å; Q96-V99 WeakPolarHBondContact O-CG2 3.31Å; Q96-E206 PolarHBondContact NE2-O 3.46Å
97	L	70.6	Confident	81.4	Confident	63 Å²	63	46 Å²	46	33%	0.33	25%	0.253	S	S	.	.			trans	-90.5	133.5	-178.4	-56.5	179.4	0	0	0	109.5	D87 Q95 V99 H228	D87-L97 HydrophobicContact CB-CD2 4.43Å; D87-L97 WeakPolarHBondContact OD1-CA 3.29Å; Q95-L97 HydrophobicContact CB-CD2 4.25Å; Q95-L97 HydrophobicContact CB-CG 4.46Å; L97-V99 PolarHBondContact O-N 2.7Å; L97-H228 VanDerWaalsContact CD2-CD2 3.42Å; L97-H228 WeakPolarHBondContact CD2-CD2 3.48Å
98	D	65.3	Low	81.5	Confident	27 Å²	27	46.1 Å²	46.1	14%	0.144	25%	0.253	C	S	.	.	S	Bend	trans	45.1	62.2	179.1	-152	16.7	0	0	0	112.7	I86 D87 E100 K105 K220	I86-D98 VanDerWaalsContact O-CA 3.26Å; I86-D98 WeakPolarHBondContact O-CA 3.48Å; I86-D98 PolarHBondContact O-N 2.88Å; D87-D98 PolarHBondContact OD1-N 2.82Å; D98-E100 WeakPolarHBondContact O-CG 3.27Å; D98-E100 PolarHBondContact O-N 2.93Å; D98-K105 IonicContact OD1-NZ 2.66Å; D98-K105 PolarHBondContact OD1-NZ 3.31Å; D98-K105 VanDerWaalsContact OD1-NZ 3.15Å; D98-K220 VanDerWaalsContact OD2-CD 3.22Å; D98-K220 WeakPolarHBondContact OD2-CD 3.47Å; D98-K220 WeakPolarHBondContact OD2-CE 3.5Å; D98-K220 IonicContact OD2-NZ 3.51Å; D98-K220 PolarHBondContact OD2-NZ 3.19Å
99	V	64.7	Low	81.3	Confident	15 Å²	15	48.3 Å²	48.3	9%	0.091	26%	0.264	C	S	.	.			trans	-68.5	100.2	-171.4	-170.8	0	0	0	0	110.8	I86 Q96 L97 L103 L205	I86-V99 PolarHBondContact O-N 2.88Å; Q96-V99 HydrophobicContact CB-CG2 3.4Å; Q96-V99 VanDerWaalsContact CB-CG2 3.4Å; Q96-V99 WeakPolarHBondContact O-CG2 3.31Å; L97-V99 PolarHBondContact O-N 2.7Å; V99-L103 HydrophobicContact CB-CD1 4.48Å; V99-L103 WeakPolarHBondContact O-CD1 3.47Å; V99-L205 HydrophobicContact CB-CD2 3.55Å; V99-L205 HydrophobicContact CG1-CD2 3.53Å; V99-L205 HydrophobicContact CG2-CD2 3.85Å
100	E	64.6	Low	81.2	Confident	44 Å²	44	52.4 Å²	52.4	21%	0.206	28%	0.28	C	S	.	.			trans	-101.1	-12.8	-175.3	-72.7	170.8	172.8	0	0	114	D98 N102 H122 K220	D98-E100 WeakPolarHBondContact O-CG 3.27Å; D98-E100 PolarHBondContact O-N 2.93Å; E100-N102 PolarHBondContact O-N 3.02Å; E100-H122 HydrophobicContact CB-CB 4.39Å; E100-H122 WeakPolarHBondContact CB-O 3.38Å; E100-H122 HydrophobicContact CG-CB 4.04Å; E100-H122 VanDerWaalsContact OE2-CB 3.3Å; E100-H122 WeakPolarHBondContact OE2-CB 3.39Å; E100-K220 IonicContact OE1-NZ 2.72Å
101	H	70.8	Confident	81.1	Confident	129 Å²	129	58.5 Å²	58.5	60%	0.597	31%	0.313	S	S	*	.	S	Bend	trans	-66	-37.2	-170.4	-67.6	-47.2	0	0	0	114.4	R121	H101-R121 PolarHBondContact O-NE 3.13Å; H101-R121 PolarHBondContact O-NH2 3.1Å
102	N	84	Confident	80.9	Confident	47 Å²	47	55.3 Å²	55.3	25%	0.251	30%	0.302	S	S	.	.	S	Bend	trans	-126.2	10.6	-174.1	-67.4	-39	0	0	0	113.2	E100 G203 F204	E100-N102 PolarHBondContact O-N 3.02Å; N102-G203 WeakPolarHBondContact O-CA 3.5Å; N102-F204 HydrophobicContact CB-CD1 4.09Å; N102-F204 HydrophobicContact CB-CD2 3.95Å; N102-F204 HydrophobicContact CB-CE1 3.86Å; N102-F204 HydrophobicContact CB-CE2 3.73Å; N102-F204 HydrophobicContact CB-CG 4.13Å; N102-F204 HydrophobicContact CB-CZ 3.68Å; N102-F204 WeakPolarHBondContact CB-O 3.3Å; N102-F204 VanDerWaalsContact CG-CE2 3.46Å; N102-F204 WeakPolarHBondContact ND2-CE2 3.4Å; N102-F204 PolarHBondContact O-N 3.11Å; N102-F204 WeakPolarHBondContact OD1-CZ 3.38Å
103	L	86.5	Confident	81.1	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.037	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143	177.6	-70.8	175.3	0	0	0	109.9	I72 I86 V99 L205	I72-L103 HydrophobicContact CB-CD2 4.47Å; I86-L103 HydrophobicContact CD1-CD1 3.51Å; I86-L103 HydrophobicContact CG1-CD1 4.43Å; I86-L103 HydrophobicContact CG2-CD1 3.6Å; V99-L103 HydrophobicContact CB-CD1 4.48Å; V99-L103 WeakPolarHBondContact O-CD1 3.47Å; L103-L205 HydrophobicContact CD1-CD2 3.4Å; L103-L205 VanDerWaalsContact CD1-CD2 3.4Å; L103-L205 HydrophobicContact CD1-CG 3.87Å; L103-L205 HydrophobicContact CG-CD2 4.18Å
104	F	90.1	Very high	81.6	Confident	60 Å²	60	57.4 Å²	57.4	26%	0.263	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.6	-178.8	-59.7	-88.9	0	0	0	108.7	A119 R121 V201 Y202	F104-A119 HydrophobicContact CB-CB 4.22Å; F104-R121 HydrophobicContact CD1-CB 3.99Å; F104-R121 HydrophobicContact CD1-CG 4.2Å; F104-R121 HydrophobicContact CE1-CB 3.86Å; F104-R121 HydrophobicContact CE1-CG 3.81Å; F104-V201 WeakPolarHBondContact O-CA 3.34Å; F104-Y202 HydrophobicContact CB-CD1 4.11Å; F104-Y202 HydrophobicContact CB-CD2 4.3Å; F104-Y202 HydrophobicContact CB-CE1 3.62Å; F104-Y202 HydrophobicContact CB-CE2 3.82Å; F104-Y202 HydrophobicContact CB-CG 4.44Å; F104-Y202 VanDerWaalsContact CB-CZ 3.46Å; F104-Y202 HydrophobicContact CD2-CD2 4.24Å; F104-Y202 AromaticContact CD2-CE2 3.81Å; F104-Y202 HydrophobicContact CD2-CE2 3.81Å; F104-Y202 AromaticContact CG-CE2 3.98Å; F104-Y202 HydrophobicContact CG-CE2 3.98Å; F104-Y202 AromaticContact CG-CZ 3.95Å; F104-Y202 PolarHBondContact N-O 2.75Å; F104-Y202 PolarHBondContact O-N 3.33Å
105	K	90.1	Very high	81.6	Confident	15 Å²	15	56.7 Å²	56.7	7%	0.065	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	112.5	174.8	-63.4	-178.3	-171.2	170.2	0	108	C81 L84 D98 E120 Q200 V201	C81-K105 HydrophobicContact CB-CB 4.01Å; L84-K105 WeakPolarHBondContact O-CE 3.49Å; L84-K105 PolarHBondContact O-NZ 3.09Å; D98-K105 IonicContact OD1-NZ 2.66Å; D98-K105 PolarHBondContact OD1-NZ 3.31Å; D98-K105 VanDerWaalsContact OD1-NZ 3.15Å; K105-E120 PolarHBondContact O-N 2.82Å; K105-Q200 WeakPolarHBondContact CA-O 3.29Å; K105-V201 HydrophobicContact CG-CG2 4.36Å
106	Q	90.6	Very high	81.5	Confident	14 Å²	14	56.3 Å²	56.3	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.8	177	177.6	63.6	63	0	0	109.5	C81 L108 P114 S116 A119 Q200 Y202	C81-Q106 VanDerWaalsContact SG-C 3.5Å; C81-Q106 PolarHBondContact SG-O 3.23Å; C81-Q106 VanDerWaalsContact SG-O 3.33Å; Q106-L108 HydrophobicContact CG-CD2 4.05Å; Q106-P114 HydrophobicContact CG-CB 4.18Å; Q106-P114 HydrophobicContact CG-CG 4.37Å; Q106-S116 PolarHBondContact NE2-O 2.9Å; Q106-S116 PolarHBondContact NE2-OG 3.35Å; Q106-A119 HydrophobicContact CB-CB 4.41Å; Q106-A119 VanDerWaalsContact OE1-CA 3.27Å; Q106-Q200 HydrophobicContact CB-CB 4.3Å; Q106-Q200 PolarHBondContact N-O 2.73Å; Q106-Q200 PolarHBondContact O-N 3Å; Q106-Y202 HydrophobicContact CB-CE1 4.15Å
107	R	90.5	Very high	80.9	Confident	43 Å²	43	59.8 Å²	59.8	16%	0.162	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	134.6	174.6	-69.1	173.1	59.2	-160.2	-3.4	110.3	C81 P114 V115 E197	C81-R107 HydrophobicContact CB-CG 4.11Å; R107-P114 WeakPolarHBondContact O-CA 3.24Å; R107-V115 HydrophobicContact CB-CB 4.37Å; R107-V115 PolarHBondContact O-N 3.26Å; R107-E197 IonicContact CZ-OE1 2.61Å; R107-E197 IonicContact CZ-OE2 3.89Å; R107-E197 IonicContact NE-OE1 3.31Å; R107-E197 IonicContact NE-OE2 2.8Å; R107-E197 PolarHBondContact NE-OE2 3.31Å; R107-E197 VanDerWaalsContact NH2-CD 3.33Å; R107-E197 IonicContact NH2-OE1 3.97Å; R107-E197 PolarHBondContact NH2-OE1 3.19Å; R107-E197 IonicContact NH2-OE2 3.68Å; R107-E197 PolarHBondContact NH2-OE2 2.88Å; R107-E197 VanDerWaalsContact NH2-OE2 3.09Å
108	L	90.7	Very high	80.6	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140.8	-178.9	-57.6	177	0	0	0	110.6	L75 Q106 I113 P114 E197 G198 Q200	L75-L108 HydrophobicContact CD1-CD1 2.95Å; L75-L108 HydrophobicContact CD1-CG 4.44Å; L75-L108 HydrophobicContact CG-CD1 4.41Å; Q106-L108 HydrophobicContact CG-CD2 4.05Å; L108-I113 CarbonylContact C-O 3.51Å; L108-I113 WeakPolarHBondContact CA-O 3.41Å; L108-P114 HydrophobicContact CD2-CB 4.42Å; L108-P114 HydrophobicContact CD2-CG 4.01Å; L108-E197 CarbonylContact O-C 3.53Å; L108-E197 VanDerWaalsContact O-CA 3.24Å; L108-E197 WeakPolarHBondContact O-CA 3.37Å; L108-E197 WeakPolarHBondContact O-CB 3.21Å; L108-G198 PolarHBondContact N-O 3.41Å; L108-G198 PolarHBondContact O-N 2.79Å; L108-Q200 HydrophobicContact CD1-CB 3.99Å
109	D	87.6	Confident	80.4	Confident	50 Å²	50	64.1 Å²	64.1	27%	0.267	35%	0.349	S	S	.	.			trans	-72.6	-177.3	172.1	70.8	13.6	0	0	0	111.6	D111 G112 I113 V115	D109-D111 PolarHBondContact O-N 3.27Å; D109-D111 WeakPolarHBondContact OD1-CA 3.08Å; D109-D111 PolarHBondContact OD1-N 3.33Å; D109-G112 PolarHBondContact O-N 3.06Å; D109-G112 VanDerWaalsContact O-N 3.11Å; D109-G112 PolarHBondContact OD1-N 3.03Å; D109-I113 PolarHBondContact N-O 2.75Å; D109-I113 PolarHBondContact OD1-N 3.32Å; D109-I113 WeakPolarHBondContact OD2-CB 3.49Å; D109-V115 HydrophobicContact CB-CG2 3.98Å
110	K	85.4	Confident	80.1	Confident	155 Å²	155	66.4 Å²	66.4	67%	0.674	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.7	179.2	-69.8	174.3	178.6	175.9	0	113.7	N196	K110-N196 HydrophobicContact CD-CB 4.22Å; K110-N196 HydrophobicContact CG-CB 4.05Å; K110-N196 VanDerWaalsContact CG-O 3.29Å; K110-N196 WeakPolarHBondContact CG-O 3.14Å
111	D	85.7	Confident	79.7	Confident	140 Å²	140	69.3 Å²	69.3	75%	0.749	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-0.6	-178.7	-61.7	-49.2	0	0	0	111.6	D109 I113	D109-D111 PolarHBondContact O-N 3.27Å; D109-D111 WeakPolarHBondContact OD1-CA 3.08Å; D109-D111 PolarHBondContact OD1-N 3.33Å; D111-I113 HydrophobicContact CB-CD1 4.36Å; D111-I113 HydrophobicContact CB-CG1 4.42Å
112	G	84.3	Confident	78.8	Confident	44 Å²	44	65.9 Å²	65.9	45%	0.454	35%	0.352	S	S	.	.	S	Bend	trans	84.1	16.7	179.8	0	0	0	0	0	114	D109	D109-G112 PolarHBondContact O-N 3.06Å; D109-G112 VanDerWaalsContact O-N 3.11Å; D109-G112 PolarHBondContact OD1-N 3.03Å
113	I	87.8	Confident	76.6	Confident	99 Å²	99	67 Å²	67	51%	0.508	36%	0.356	S	S	.	.			trans	-93.4	137	-179.7	-55.1	173	0	0	0	109.4	L108 D109 D111 V115	L108-I113 CarbonylContact C-O 3.51Å; L108-I113 WeakPolarHBondContact CA-O 3.41Å; D109-I113 PolarHBondContact N-O 2.75Å; D109-I113 PolarHBondContact OD1-N 3.32Å; D109-I113 WeakPolarHBondContact OD2-CB 3.49Å; D111-I113 HydrophobicContact CB-CD1 4.36Å; D111-I113 HydrophobicContact CB-CG1 4.42Å; I113-V115 PolarHBondContact O-N 3.24Å
114	P	87.7	Confident	73.9	Confident	71 Å²	71	75.1 Å²	75.1	46%	0.461	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-53.9	120.8	173.2	-28.3	36.7	0	0	0	113.2	Q106 R107 L108	Q106-P114 HydrophobicContact CG-CB 4.18Å; Q106-P114 HydrophobicContact CG-CG 4.37Å; R107-P114 WeakPolarHBondContact O-CA 3.24Å; L108-P114 HydrophobicContact CD2-CB 4.42Å; L108-P114 HydrophobicContact CD2-CG 4.01Å
115	V	83	Confident	71	Confident	72 Å²	72	76 Å²	76	44%	0.436	42%	0.424	S	S	.	.	S	Bend	trans	-72.3	-36.8	177.8	-179.6	0	0	0	0	111	R107 D109 I113	R107-V115 HydrophobicContact CB-CB 4.37Å; R107-V115 PolarHBondContact O-N 3.26Å; D109-V115 HydrophobicContact CB-CG2 3.98Å; I113-V115 PolarHBondContact O-N 3.24Å
116	S	74.3	Confident	68.3	Low	33 Å²	33	83 Å²	83	23%	0.231	46%	0.455	C	S	.	.	S	Bend	trans	-111.9	144.6	175	59.3	0	0	0	0	110.2	Q106 E118	Q106-S116 PolarHBondContact NE2-O 2.9Å; Q106-S116 PolarHBondContact NE2-OG 3.35Å; S116-E118 PolarHBondContact OG-O 3.15Å
117	S	64.4	Low	65.8	Low	124 Å²	124	87.5 Å²	87.5	87%	0.867	48%	0.483	S	S	*	.	S	Bend	trans	-73.6	-19.1	172.8	53.4	0	0	0	0	113.2
118	E	64.4	Low	63.6	Low	156 Å²	156	89.7 Å²	89.7	73%	0.729	50%	0.495	S	S	*	.	S	Bend	trans	-106	121.7	177.1	-63.9	-176.2	171.8	0	0	108.4	S116 E120	S116-E118 PolarHBondContact OG-O 3.15Å; E118-E120 PolarHBondContact O-N 3.27Å
119	A	60.9	Low	61.4	Low	24 Å²	24	96.4 Å²	96.4	20%	0.198	54%	0.536	C	S	.	.			trans	-67	127.2	166.1	0	0	0	0	0	107.7	F104 Q106 R121 Y202	F104-A119 HydrophobicContact CB-CB 4.22Å; Q106-A119 HydrophobicContact CB-CB 4.41Å; Q106-A119 VanDerWaalsContact OE1-CA 3.27Å; A119-R121 PolarHBondContact O-N 3.1Å; A119-Y202 HydrophobicContact CB-CE1 4.18Å; A119-Y202 WeakPolarHBondContact CB-OH 3.26Å
120	E	59.4	Low	59.5	Low	64 Å²	64	95.5 Å²	95.5	30%	0.299	53%	0.532	S	S	.	.	B	Isolated β-bridge	trans	-68.7	107.5	178.8	-71.1	173.9	-176.4	0	0	107.7	K105 E118 H122	K105-E120 PolarHBondContact O-N 2.82Å; E118-E120 PolarHBondContact O-N 3.27Å; E120-H122 IonicContact OE2-CE1 2.7Å; E120-H122 PolarHBondContact OE2-CE1 2.64Å; E120-H122 VanDerWaalsContact OE2-CE1 3.32Å; E120-H122 IonicContact OE2-NE2 3.5Å
121	R	54.7	Low	58	Low	105 Å²	105	93.5 Å²	93.5	40%	0.396	53%	0.533	S	S	.	.			trans	-84.8	103.3	157.7	-162.9	-174.6	-174.3	-179.7	8.5	104.6	H101 F104 A119 E123	H101-R121 PolarHBondContact O-NE 3.13Å; H101-R121 PolarHBondContact O-NH2 3.1Å; F104-R121 HydrophobicContact CD1-CB 3.99Å; F104-R121 HydrophobicContact CD1-CG 4.2Å; F104-R121 HydrophobicContact CE1-CB 3.86Å; F104-R121 HydrophobicContact CE1-CG 3.81Å; A119-R121 PolarHBondContact O-N 3.1Å; R121-E123 WeakPolarHBondContact CD-OE1 3.45Å; R121-E123 HydrophobicContact CG-CG 3.95Å; R121-E123 IonicContact CZ-OE1 3.92Å; R121-E123 IonicContact NE-OE1 2.74Å; R121-E123 PolarHBondContact NE-OE1 3.27Å; R121-E123 IonicContact NH1-OE1 3.93Å; R121-E123 PolarHBondContact NH1-OE1 3.47Å; R121-E123 IonicContact NH2-OE1 2.72Å; R121-E123 PolarHBondContact O-N 2.8Å
122	H	52.2	Low	56.8	Low	57 Å²	57	89 Å²	89	26%	0.264	51%	0.507	S	S	.	.			trans	-67.6	76.6	169.2	-74.6	89.9	0	0	0	108.2	E100 E120 E128	E100-H122 HydrophobicContact CB-CB 4.39Å; E100-H122 WeakPolarHBondContact CB-O 3.38Å; E100-H122 HydrophobicContact CG-CB 4.04Å; E100-H122 VanDerWaalsContact OE2-CB 3.3Å; E100-H122 WeakPolarHBondContact OE2-CB 3.39Å; E120-H122 IonicContact OE2-CE1 2.7Å; E120-H122 PolarHBondContact OE2-CE1 2.64Å; E120-H122 VanDerWaalsContact OE2-CE1 3.32Å; E120-H122 IonicContact OE2-NE2 3.5Å; H122-E128 IonicContact CD2-OE1 3.68Å; H122-E128 IonicContact NE2-OE1 3.49Å; H122-E128 PolarHBondContact NE2-OE1 2.95Å
123	E	37.6	Very low	55.8	Low	71 Å²	71	91.5 Å²	91.5	33%	0.332	51%	0.509	S	S	.	.			trans	-82.5	123	161.1	-75.9	179.9	168.7	0	0	106.7	R121 G125 K126	R121-E123 WeakPolarHBondContact CD-OE1 3.45Å; R121-E123 HydrophobicContact CG-CG 3.95Å; R121-E123 IonicContact CZ-OE1 3.92Å; R121-E123 IonicContact NE-OE1 2.74Å; R121-E123 PolarHBondContact NE-OE1 3.27Å; R121-E123 IonicContact NH1-OE1 3.93Å; R121-E123 PolarHBondContact NH1-OE1 3.47Å; R121-E123 IonicContact NH2-OE1 2.72Å; R121-E123 PolarHBondContact O-N 2.8Å; E123-G125 PolarHBondContact O-N 2.84Å; E123-K126 PolarHBondContact O-N 3.14Å
124	L	30.6	Very low	54.7	Low	176 Å²	176	89 Å²	89	92%	0.921	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.6	101.9	164	-78.4	152.4	0	0	0	109.8
125	G	30.2	Very low	53.6	Low	78 Å²	78	92.1 Å²	92.1	80%	0.804	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.8	13.4	172.7	0	0	0	0	0	118.2	E123	E123-G125 PolarHBondContact O-N 2.84Å
126	K	31.9	Very low	53.1	Low	163 Å²	163	92.2 Å²	92.2	71%	0.709	52%	0.517	S	S	*	.			trans	-111	126	163.9	-79.1	-175.4	179.4	168	0	112.5	E123 E128	E123-K126 PolarHBondContact O-N 3.14Å; K126-E128 PolarHBondContact O-N 2.79Å; K126-E128 VanDerWaalsContact O-N 3.07Å
127	V	37.8	Very low	53.3	Low	109 Å²	109	92.9 Å²	92.9	66%	0.661	52%	0.517	S	S	*	.			trans	-52.2	106.2	-180	179.1	0	0	0	0	109.2	P134	V127-P134 HydrophobicContact CG1-CG 4.34Å
128	E	44.6	Very low	53.9	Low	89 Å²	89	91.8 Å²	91.8	42%	0.416	50%	0.502	S	S	.	.			trans	-51.4	144.1	158	-75	-171.2	171.9	0	0	107.7	H122 K126 T130 K190	H122-E128 IonicContact CD2-OE1 3.68Å; H122-E128 IonicContact NE2-OE1 3.49Å; H122-E128 PolarHBondContact NE2-OE1 2.95Å; K126-E128 PolarHBondContact O-N 2.79Å; K126-E128 VanDerWaalsContact O-N 3.07Å; E128-T130 HydrophobicContact CB-CG2 4.25Å; E128-T130 PolarHBondContact O-N 2.94Å; E128-T130 PolarHBondContact O-OG1 3.32Å; E128-K190 IonicContact OE2-NZ 3.87Å; E128-K190 PolarHBondContact OE2-NZ 3.34Å
129	V	44.5	Very low	54.6	Low	144 Å²	144	89.8 Å²	89.8	87%	0.873	50%	0.502	S	S	*	.			trans	-65.3	83	166.3	-176.7	0	0	0	0	107.3
130	T	47.6	Very low	55.5	Low	32 Å²	32	95.9 Å²	95.9	20%	0.196	53%	0.531	C	S	.	.			trans	-74.9	137.9	171.5	39.6	0	0	0	0	106.8	E128 F132	E128-T130 HydrophobicContact CB-CG2 4.25Å; E128-T130 PolarHBondContact O-N 2.94Å; E128-T130 PolarHBondContact O-OG1 3.32Å; T130-F132 WeakPolarHBondContact CB-O 3.46Å; T130-F132 PolarHBondContact O-N 3.24Å; T130-F132 PolarHBondContact OG1-O 3.35Å
131	V	54.7	Low	56.9	Low	113 Å²	113	95.3 Å²	95.3	69%	0.685	53%	0.527	S	S	*	.	S	Bend	trans	-54.4	-18.6	169.2	-179.2	0	0	0	0	110.9
132	F	60.8	Low	58.6	Low	45 Å²	45	94.2 Å²	94.2	20%	0.197	53%	0.534	C	S	.	.	S	Bend	trans	-114.6	126.2	179.6	-179.4	-99.7	0	0	0	110.8	T130 P134 S136 L137 R184	T130-F132 WeakPolarHBondContact CB-O 3.46Å; T130-F132 PolarHBondContact O-N 3.24Å; T130-F132 PolarHBondContact OG1-O 3.35Å; F132-P134 VanDerWaalsContact O-CD 3.3Å; F132-P134 WeakPolarHBondContact O-CD 3.29Å; F132-S136 WeakPolarHBondContact CE2-OG 3.25Å; F132-S136 WeakPolarHBondContact CZ-OG 3.03Å; F132-L137 HydrophobicContact CE1-CD1 3.42Å; F132-L137 VanDerWaalsContact CE1-CD1 3.42Å; F132-L137 HydrophobicContact CE1-CG 3.83Å; F132-L137 HydrophobicContact CZ-CD1 3.52Å; F132-L137 HydrophobicContact CZ-CD2 4.1Å; F132-L137 HydrophobicContact CZ-CG 3.57Å; F132-R184 WeakPolarHBondContact CB-O 3.37Å; F132-R184 HydrophobicContact CD1-CG 3.98Å; F132-R184 HydrophobicContact CD2-CG 3.67Å; F132-R184 HydrophobicContact CE1-CG 4.04Å; F132-R184 HydrophobicContact CE2-CG 3.73Å; F132-R184 HydrophobicContact CG-CG 3.79Å; F132-R184 HydrophobicContact CZ-CG 3.89Å
133	D	62.8	Low	60.4	Low	96 Å²	96	93.1 Å²	93.1	51%	0.513	53%	0.529	S	S	.	.			trans	-71.2	112.5	173.2	-172.5	-7.8	0	0	0	110	D135 S136	D133-D135 PolarHBondContact O-N 3.48Å; D133-D135 WeakPolarHBondContact OD1-CB 3.09Å; D133-D135 PolarHBondContact OD1-N 3.13Å; D133-D135 VanDerWaalsContact OD1-N 3.09Å; D133-S136 WeakPolarHBondContact O-CB 3.41Å; D133-S136 PolarHBondContact O-N 3.11Å; D133-S136 VanDerWaalsContact O-N 3.11Å; D133-S136 PolarHBondContact O-OG 3.11Å
134	P	64	Low	63	Low	47 Å²	47	92.7 Å²	92.7	31%	0.305	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-61.3	-24.6	-179.4	-3.8	14	0	0	0	112.6	V127 F132 S136 L137	V127-P134 HydrophobicContact CG1-CG 4.34Å; F132-P134 VanDerWaalsContact O-CD 3.3Å; F132-P134 WeakPolarHBondContact O-CD 3.29Å; P134-S136 PolarHBondContact O-N 3.07Å; P134-L137 PolarHBondContact O-N 3.14Å
135	D	66.4	Low	65.9	Low	137 Å²	137	84.3 Å²	84.3	73%	0.733	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-72.5	-11.3	-179.8	-65.3	-20.5	0	0	0	112.5	D133 L137	D133-D135 PolarHBondContact O-N 3.48Å; D133-D135 WeakPolarHBondContact OD1-CB 3.09Å; D133-D135 PolarHBondContact OD1-N 3.13Å; D133-D135 VanDerWaalsContact OD1-N 3.09Å; D135-L137 PolarHBondContact O-N 2.91Å
136	S	72.4	Confident	68.8	Low	74 Å²	74	84.7 Å²	84.7	52%	0.517	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-73.6	-6.6	175.8	68.2	0	0	0	0	113.9	F132 D133 P134	F132-S136 WeakPolarHBondContact CE2-OG 3.25Å; F132-S136 WeakPolarHBondContact CZ-OG 3.03Å; D133-S136 WeakPolarHBondContact O-CB 3.41Å; D133-S136 PolarHBondContact O-N 3.11Å; D133-S136 VanDerWaalsContact O-N 3.11Å; D133-S136 PolarHBondContact O-OG 3.11Å; P134-S136 PolarHBondContact O-N 3.07Å
137	L	76.9	Confident	71.5	Confident	47 Å²	47	79 Å²	79	25%	0.246	46%	0.455	C	S	.	.	S	Bend	trans	-117	152.4	-178.4	-65	173.2	0	0	0	111.2	F132 P134 D135 P139 R141	F132-L137 HydrophobicContact CE1-CD1 3.42Å; F132-L137 VanDerWaalsContact CE1-CD1 3.42Å; F132-L137 HydrophobicContact CE1-CG 3.83Å; F132-L137 HydrophobicContact CZ-CD1 3.52Å; F132-L137 HydrophobicContact CZ-CD2 4.1Å; F132-L137 HydrophobicContact CZ-CG 3.57Å; P134-L137 PolarHBondContact O-N 3.14Å; D135-L137 PolarHBondContact O-N 2.91Å; L137-P139 WeakPolarHBondContact O-CD 3.23Å; L137-R141 VanDerWaalsContact CD1-CZ 3.46Å
138	D	78.7	Confident	74	Confident	101 Å²	101	73.9 Å²	73.9	54%	0.54	42%	0.424	S	S	.	.			trans	-55.1	123.8	177.5	-170.2	-10.5	0	0	0	110.7	D140 R141	D138-D140 PolarHBondContact O-N 2.8Å; D138-D140 PolarHBondContact OD1-N 3.07Å; D138-R141 HydrophobicContact CB-CB 4.4Å; D138-R141 WeakPolarHBondContact O-CB 3.27Å; D138-R141 WeakPolarHBondContact O-CD 3.02Å; D138-R141 VanDerWaalsContact O-CG 3.23Å; D138-R141 WeakPolarHBondContact O-CG 3.33Å; D138-R141 PolarHBondContact O-N 2.83Å; D138-R141 PolarHBondContact O-NH1 2.99Å
139	P	78.5	Confident	76.1	Confident	114 Å²	114	72.6 Å²	72.6	74%	0.74	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.4	175.5	-23.6	33.5	0	0	0	113.3	L137 R141	L137-P139 WeakPolarHBondContact O-CD 3.23Å; P139-R141 VanDerWaalsContact C-N 3.31Å; P139-R141 PolarHBondContact O-N 2.79Å
140	D	80.3	Confident	78.2	Confident	151 Å²	151	67.2 Å²	67.2	81%	0.807	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	11.5	-176	-69.2	-30.7	0	0	0	113	D138	D138-D140 PolarHBondContact O-N 2.8Å; D138-D140 PolarHBondContact OD1-N 3.07Å
141	R	87.6	Confident	79.9	Confident	53 Å²	53	74.7 Å²	74.7	20%	0.2	42%	0.422	C	S	.	.			trans	-68	148.2	178.9	74.6	-171.4	-178	-91.6	4.9	111.8	L137 D138 P139 E143 N157	L137-R141 VanDerWaalsContact CD1-CZ 3.46Å; D138-R141 HydrophobicContact CB-CB 4.4Å; D138-R141 WeakPolarHBondContact O-CB 3.27Å; D138-R141 WeakPolarHBondContact O-CD 3.02Å; D138-R141 VanDerWaalsContact O-CG 3.23Å; D138-R141 WeakPolarHBondContact O-CG 3.33Å; D138-R141 PolarHBondContact O-N 2.83Å; D138-R141 PolarHBondContact O-NH1 2.99Å; P139-R141 VanDerWaalsContact C-N 3.31Å; P139-R141 PolarHBondContact O-N 2.79Å; R141-E143 VanDerWaalsContact CD-OE1 3.27Å; R141-E143 WeakPolarHBondContact CD-OE1 3.18Å; R141-E143 HydrophobicContact CG-CG 4.4Å; R141-E143 IonicContact CZ-OE1 3.7Å; R141-E143 IonicContact NE-OE1 3.79Å; R141-E143 PolarHBondContact NE-OE1 3.01Å; R141-E143 IonicContact NH2-OE1 2.6Å; R141-N157 PolarHBondContact O-ND2 2.96Å; R141-N157 PolarHBondContact O-OD1 2.88Å; R141-N157 VanDerWaalsContact O-OD1 3.09Å
142	C	89.8	Confident	81.3	Confident	82 Å²	82	74 Å²	74	55%	0.554	41%	0.414	S	S	*	.			trans	-127.2	92	171.8	-179.2	0	0	0	0	108.2	C155	C142-C155 HydrophobicContact CB-CB 3.82Å; C142-C155 WeakPolarHBondContact CB-SG 3.39Å; C142-C155 WeakPolarHBondContact SG-CB 3.38Å; C142-C155 CovalentContact SG-SG 2.02Å; C142-C155 PolarHBondContact SG-SG 2.97Å
143	E	90.5	Very high	82.5	Confident	34 Å²	34	73 Å²	73	16%	0.159	41%	0.411	C	S	.	.			trans	-81.1	153.2	178	-67.4	177.9	-109.8	0	0	110.9	R141 C156 N157 R184	R141-E143 VanDerWaalsContact CD-OE1 3.27Å; R141-E143 WeakPolarHBondContact CD-OE1 3.18Å; R141-E143 HydrophobicContact CG-CG 4.4Å; R141-E143 IonicContact CZ-OE1 3.7Å; R141-E143 IonicContact NE-OE1 3.79Å; R141-E143 PolarHBondContact NE-OE1 3.01Å; R141-E143 IonicContact NH2-OE1 2.6Å; E143-C156 VanDerWaalsContact CB-O 3.27Å; E143-C156 WeakPolarHBondContact CB-O 3.45Å; E143-C156 PolarHBondContact O-N 2.85Å; E143-N157 PolarHBondContact N-OD1 2.81Å; E143-R184 IonicContact OE1-CZ 3.23Å; E143-R184 IonicContact OE1-NH1 2.74Å; E143-R184 PolarHBondContact OE1-NH1 2.89Å; E143-R184 IonicContact OE1-NH2 3.44Å; E143-R184 PolarHBondContact OE1-NH2 3.11Å; E143-R184 IonicContact OE2-CZ 2.78Å; E143-R184 IonicContact OE2-NH1 3.99Å; E143-R184 PolarHBondContact OE2-NH1 2.87Å; E143-R184 IonicContact OE2-NH2 3.49Å; E143-R184 PolarHBondContact OE2-NH2 3.42Å
144	S	91.8	Very high	83.7	Confident	62 Å²	62	75.7 Å²	75.7	43%	0.434	42%	0.418	S	S	.	.			trans	-72.4	143.7	-177.8	175.6	0	0	0	0	111.7	Y146 E149 Q181	S144-Y146 WeakPolarHBondContact O-CD2 3.29Å; S144-Y146 PolarHBondContact O-N 3.45Å; S144-Y146 PolarHBondContact OG-N 3.37Å; S144-E149 PolarHBondContact OG-OE1 2.74Å; S144-Q181 PolarHBondContact O-NE2 3.07Å
145	C	91.8	Very high	85	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	42%	0.419	C	S	.	.			trans	-88.9	18.5	169.9	-52.9	0	0	0	0	112.2	G147 A148 E149 C156 A165 Y166	C145-G147 VanDerWaalsContact C-N 3.28Å; C145-G147 PolarHBondContact O-N 2.82Å; C145-A148 HydrophobicContact CB-CB 4.29Å; C145-A148 WeakPolarHBondContact O-CB 3.2Å; C145-A148 PolarHBondContact O-N 3.09Å; C145-E149 HydrophobicContact CB-CG 3.75Å; C145-E149 PolarHBondContact N-OE1 2.79Å; C145-C156 HydrophobicContact CB-CB 3.92Å; C145-C156 WeakPolarHBondContact CB-SG 3.05Å; C145-C156 WeakPolarHBondContact SG-CB 3.42Å; C145-C156 PolarHBondContact SG-N 3.28Å; C145-C156 VanDerWaalsContact SG-N 3.43Å; C145-C156 CovalentContact SG-SG 2.03Å; C145-C156 PolarHBondContact SG-SG 2.04Å; C145-A165 HydrophobicContact CB-CB 4.03Å; C145-Y166 WeakPolarHBondContact O-CE2 3.18Å
146	Y	90.8	Very high	86.2	Confident	85 Å²	85	69.2 Å²	69.2	33%	0.333	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	38.5	177.2	-62.5	-98	0	0	0	114.1	S144 V162 Y166 I179 E180 Q181	S144-Y146 WeakPolarHBondContact O-CD2 3.29Å; S144-Y146 PolarHBondContact O-N 3.45Å; S144-Y146 PolarHBondContact OG-N 3.37Å; Y146-V162 HydrophobicContact CD2-CG1 4.23Å; Y146-Y166 WeakPolarHBondContact CB-OH 3.4Å; Y146-I179 HydrophobicContact CD1-CD1 3.82Å; Y146-I179 HydrophobicContact CD2-CD1 3.51Å; Y146-I179 HydrophobicContact CD2-CG2 4.19Å; Y146-I179 HydrophobicContact CE1-CD1 4.02Å; Y146-I179 HydrophobicContact CE2-CB 4.31Å; Y146-I179 HydrophobicContact CE2-CD1 3.75Å; Y146-I179 HydrophobicContact CE2-CG2 3.66Å; Y146-I179 HydrophobicContact CG-CD1 3.56Å; Y146-E180 WeakPolarHBondContact OH-CB 3.16Å; Y146-E180 PolarHBondContact OH-N 3.32Å; Y146-Q181 VanDerWaalsContact CE2-OE1 3.27Å
147	G	90	Very high	87	Confident	43 Å²	43	67.5 Å²	67.5	44%	0.443	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	-3	179.6	0	0	0	0	0	114.3	C145 E149 W171	C145-G147 VanDerWaalsContact C-N 3.28Å; C145-G147 PolarHBondContact O-N 2.82Å; G147-E149 WeakPolarHBondContact CA-OE2 3.36Å; G147-E149 PolarHBondContact N-OE2 2.99Å; G147-W171 VanDerWaalsContact O-CH2 3.3Å; G147-W171 WeakPolarHBondContact O-CH2 3.1Å
148	A	88.9	Confident	87.5	Confident	2 Å²	2	67.7 Å²	67.7	2%	0.017	37%	0.372	C	S	.	.			trans	-88.3	1.2	177	0	0	0	0	0	113.9	C145 A165 Y166 R169 W171	C145-A148 HydrophobicContact CB-CB 4.29Å; C145-A148 WeakPolarHBondContact O-CB 3.2Å; C145-A148 PolarHBondContact O-N 3.09Å; A148-A165 HydrophobicContact CB-CB 3.7Å; A148-Y166 HydrophobicContact CB-CD2 3.6Å; A148-Y166 HydrophobicContact CB-CE2 3.9Å; A148-R169 HydrophobicContact CB-CG 3.96Å; A148-R169 PolarHBondContact O-NE 3.02Å; A148-W171 HydrophobicContact CB-CE3 4.26Å; A148-W171 HydrophobicContact CB-CZ3 4.19Å
149	E	90.3	Very high	87.9	Confident	62 Å²	62	62.9 Å²	62.9	29%	0.29	35%	0.346	S	S	.	.			trans	-54.7	136.5	-179.6	-62.2	81.9	176.1	0	0	111.5	S144 C145 G147 I153 R169	S144-E149 PolarHBondContact OG-OE1 2.74Å; C145-E149 HydrophobicContact CB-CG 3.75Å; C145-E149 PolarHBondContact N-OE1 2.79Å; G147-E149 WeakPolarHBondContact CA-OE2 3.36Å; G147-E149 PolarHBondContact N-OE2 2.99Å; E149-I153 CarbonylContact C-O 3.59Å; E149-I153 WeakPolarHBondContact CA-O 3.44Å; E149-R169 PolarHBondContact O-NH2 3.22Å
150	A	86.6	Confident	88.1	Confident	31 Å²	31	61 Å²	61	26%	0.256	33%	0.328	S	S	.	.			trans	-133.6	176.8	178.8	0	0	0	0	0	110.7	D152 I153	A150-D152 WeakPolarHBondContact CB-OD1 3.38Å; A150-D152 PolarHBondContact O-N 3.49Å; A150-I153 PolarHBondContact N-O 3.07Å; A150-I153 CarbonylContact O-C 3.36Å; A150-I153 PolarHBondContact O-N 3.42Å
151	E	84.8	Confident	88.5	Confident	190 Å²	190	56.6 Å²	56.6	89%	0.888	30%	0.304	S	S	*	.	S	Bend	trans	-61.5	-30.8	-176.8	-68.5	-171.5	171.2	0	0	112.6	K154	E151-K154 WeakPolarHBondContact O-CE 2.96Å
152	D	84	Confident	88.5	Confident	98 Å²	98	54.1 Å²	54.1	52%	0.524	30%	0.295	S	S	.	.	S	Bend	trans	-87.4	-38.2	179.4	52.7	-9.8	0	0	0	113.5	A150 R168	A150-D152 WeakPolarHBondContact CB-OD1 3.38Å; A150-D152 PolarHBondContact O-N 3.49Å; D152-R168 IonicContact OD2-CZ 2.74Å; D152-R168 IonicContact OD2-NH1 2.79Å; D152-R168 PolarHBondContact OD2-NH1 2.89Å
153	I	85.4	Confident	88.3	Confident	25 Å²	25	52.2 Å²	52.2	13%	0.128	28%	0.276	C	S	.	.			trans	-115.8	92.7	177.5	-53.7	178.8	0	0	0	109.3	E149 A150 E164 A165	E149-I153 CarbonylContact C-O 3.59Å; E149-I153 WeakPolarHBondContact CA-O 3.44Å; A150-I153 PolarHBondContact N-O 3.07Å; A150-I153 CarbonylContact O-C 3.36Å; A150-I153 PolarHBondContact O-N 3.42Å; I153-E164 HydrophobicContact CD1-CG 3.71Å; I153-A165 HydrophobicContact CG2-CB 4.31Å
154	K	88.9	Confident	87.9	Confident	152 Å²	152	52.2 Å²	52.2	66%	0.661	28%	0.276	S	S	*	.			trans	-87.9	-28.6	179.2	-65.3	-177.6	-177.6	176	0	113.5	E151	E151-K154 WeakPolarHBondContact O-CE 2.96Å
155	C	90.8	Very high	87.7	Confident	48 Å²	48	49.3 Å²	49.3	32%	0.324	26%	0.256	S	S	.	.			trans	-133.4	137.2	-173.2	-52.2	0	0	0	0	108.6	C142	C142-C155 HydrophobicContact CB-CB 3.82Å; C142-C155 WeakPolarHBondContact CB-SG 3.39Å; C142-C155 WeakPolarHBondContact SG-CB 3.38Å; C142-C155 CovalentContact SG-SG 2.02Å; C142-C155 PolarHBondContact SG-SG 2.97Å
156	C	90.8	Very high	87.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.			trans	-121	94.5	176.8	-68	0	0	0	0	109.8	E143 C145 D161 V162 Q181	E143-C156 VanDerWaalsContact CB-O 3.27Å; E143-C156 WeakPolarHBondContact CB-O 3.45Å; E143-C156 PolarHBondContact O-N 2.85Å; C145-C156 HydrophobicContact CB-CB 3.92Å; C145-C156 WeakPolarHBondContact CB-SG 3.05Å; C145-C156 WeakPolarHBondContact SG-CB 3.42Å; C145-C156 PolarHBondContact SG-N 3.28Å; C145-C156 VanDerWaalsContact SG-N 3.43Å; C145-C156 CovalentContact SG-SG 2.03Å; C145-C156 PolarHBondContact SG-SG 2.04Å; C156-D161 HydrophobicContact CB-CB 3.72Å; C156-D161 PolarHBondContact SG-O 3.28Å; C156-D161 VanDerWaalsContact SG-O 3.39Å; C156-V162 HydrophobicContact CB-CB 4.37Å; C156-V162 HydrophobicContact CB-CG2 3.53Å; C156-Q181 PolarHBondContact O-NE2 3.33Å
157	N	89.4	Confident	86.8	Confident	38 Å²	38	49.9 Å²	49.9	20%	0.203	26%	0.258	C	S	.	.			trans	-91.2	-18.8	-170.4	-70.2	-17.7	0	0	0	113.2	R141 E143 D161 R184	R141-N157 PolarHBondContact O-ND2 2.96Å; R141-N157 PolarHBondContact O-OD1 2.88Å; R141-N157 VanDerWaalsContact O-OD1 3.09Å; E143-N157 PolarHBondContact N-OD1 2.81Å; N157-D161 PolarHBondContact N-OD2 3.21Å; N157-R184 PolarHBondContact O-NH2 3.4Å; N157-R184 VanDerWaalsContact O-NH2 3.13Å
158	T	87.6	Confident	86.3	Confident	50 Å²	50	54.2 Å²	54.2	31%	0.307	26%	0.26	S	S	.	.	S	Bend	trans	-117.6	161.8	175.6	66.5	0	0	0	0	111.8	E160 D161 V162 E185	T158-E160 PolarHBondContact O-N 3.27Å; T158-D161 PolarHBondContact N-OD2 3.01Å; T158-D161 PolarHBondContact O-N 2.84Å; T158-D161 PolarHBondContact OG1-N 3.17Å; T158-D161 VanDerWaalsContact OG1-N 3.09Å; T158-D161 PolarHBondContact OG1-OD1 3.04Å; T158-D161 PolarHBondContact OG1-OD2 2.97Å; T158-V162 PolarHBondContact O-N 2.73Å; T158-E185 WeakPolarHBondContact CA-OE1 3.27Å
159	C	87.1	Confident	86	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	28%	0.281	C	S	.	.	H	α-helix	trans	-57.2	-36.6	171.8	-175.9	0	0	0	0	111.3	V162 R163 C182 E185	C159-V162 PolarHBondContact O-N 2.85Å; C159-R163 VanDerWaalsContact O-CG 3.29Å; C159-R163 WeakPolarHBondContact O-CG 3.38Å; C159-R163 PolarHBondContact O-N 3.26Å; C159-C182 WeakPolarHBondContact CA-SG 3.41Å; C159-C182 HydrophobicContact CB-CB 3.85Å; C159-C182 WeakPolarHBondContact CB-SG 3.18Å; C159-C182 WeakPolarHBondContact SG-CA 3.37Å; C159-C182 WeakPolarHBondContact SG-CB 3.48Å; C159-C182 CovalentContact SG-SG 2.03Å; C159-C182 PolarHBondContact SG-SG 2.74Å; C159-E185 WeakPolarHBondContact CB-OE2 3.49Å; C159-E185 PolarHBondContact N-OE1 2.97Å; C159-E185 PolarHBondContact N-OE2 2.85Å; C159-E185 VanDerWaalsContact N-OE2 3.15Å
160	E	83.8	Confident	85.3	Confident	74 Å²	74	58.8 Å²	58.8	35%	0.346	29%	0.287	S	S	.	.	H	α-helix	trans	-67.2	-38.4	178.8	-165.9	62.2	-172.4	0	0	112.1	T158 V162 R163 E164	T158-E160 PolarHBondContact O-N 3.27Å; E160-V162 VanDerWaalsContact C-N 3.32Å; E160-V162 PolarHBondContact O-N 2.81Å; E160-R163 PolarHBondContact O-N 3.12Å; E160-R163 IonicContact OE1-NH1 3.82Å; E160-R163 IonicContact OE2-CZ 2.97Å; E160-R163 IonicContact OE2-NE 2.89Å; E160-R163 IonicContact OE2-NH1 3.67Å; E160-R163 PolarHBondContact OE2-NH1 2.82Å; E160-E164 WeakPolarHBondContact O-CB 3.5Å; E160-E164 PolarHBondContact O-N 3.06Å
161	D	87.7	Confident	85.1	Confident	59 Å²	59	62.8 Å²	62.8	32%	0.316	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-42.3	174.7	-58.7	-36.4	0	0	0	111.5	C156 N157 T158 E164 A165	C156-D161 HydrophobicContact CB-CB 3.72Å; C156-D161 PolarHBondContact SG-O 3.28Å; C156-D161 VanDerWaalsContact SG-O 3.39Å; N157-D161 PolarHBondContact N-OD2 3.21Å; T158-D161 PolarHBondContact N-OD2 3.01Å; T158-D161 PolarHBondContact O-N 2.84Å; T158-D161 PolarHBondContact OG1-N 3.17Å; T158-D161 VanDerWaalsContact OG1-N 3.09Å; T158-D161 PolarHBondContact OG1-OD1 3.04Å; T158-D161 PolarHBondContact OG1-OD2 2.97Å; D161-E164 PolarHBondContact O-N 3.02Å; D161-A165 WeakPolarHBondContact O-CB 3.37Å; D161-A165 PolarHBondContact O-N 2.82Å
162	V	88.6	Confident	84.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-45	177.3	-178.7	0	0	0	0	110.6	Y146 C156 T158 C159 E160 E164 A165 Y166 F173 I179 Q181	Y146-V162 HydrophobicContact CD2-CG1 4.23Å; C156-V162 HydrophobicContact CB-CB 4.37Å; C156-V162 HydrophobicContact CB-CG2 3.53Å; T158-V162 PolarHBondContact O-N 2.73Å; C159-V162 PolarHBondContact O-N 2.85Å; E160-V162 VanDerWaalsContact C-N 3.32Å; E160-V162 PolarHBondContact O-N 2.81Å; V162-E164 VanDerWaalsContact C-N 3.32Å; V162-E164 PolarHBondContact O-N 2.98Å; V162-A165 PolarHBondContact O-N 2.59Å; V162-Y166 HydrophobicContact CG1-CD2 3.98Å; V162-Y166 HydrophobicContact CG1-CE2 3.88Å; V162-Y166 VanDerWaalsContact O-CD2 3.28Å; V162-Y166 WeakPolarHBondContact O-CD2 3.35Å; V162-Y166 PolarHBondContact O-N 3.08Å; V162-F173 HydrophobicContact CG1-CE2 4.19Å; V162-I179 HydrophobicContact CB-CG2 4.16Å; V162-I179 HydrophobicContact CG1-CD1 4.31Å; V162-I179 HydrophobicContact CG1-CG1 4.44Å; V162-I179 HydrophobicContact CG1-CG2 3.88Å; V162-I179 HydrophobicContact CG2-CG2 3.91Å; V162-Q181 HydrophobicContact CG2-CG 4.3Å
163	R	84.1	Confident	83.9	Confident	42 Å²	42	51.4 Å²	51.4	16%	0.158	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-42.1	177.7	-71.2	173	69.6	-153.8	6.1	111.2	C159 E160 Y166 R167 F173	C159-R163 VanDerWaalsContact O-CG 3.29Å; C159-R163 WeakPolarHBondContact O-CG 3.38Å; C159-R163 PolarHBondContact O-N 3.26Å; E160-R163 PolarHBondContact O-N 3.12Å; E160-R163 IonicContact OE1-NH1 3.82Å; E160-R163 IonicContact OE2-CZ 2.97Å; E160-R163 IonicContact OE2-NE 2.89Å; E160-R163 IonicContact OE2-NH1 3.67Å; E160-R163 PolarHBondContact OE2-NH1 2.82Å; R163-Y166 PolarHBondContact O-N 2.72Å; R163-R167 VanDerWaalsContact O-CB 3.31Å; R163-R167 WeakPolarHBondContact O-CB 3.29Å; R163-R167 PolarHBondContact O-N 2.8Å; R163-F173 HydrophobicContact CG-CD1 4.04Å; R163-F173 HydrophobicContact CG-CD2 4Å; R163-F173 HydrophobicContact CG-CE1 3.86Å; R163-F173 HydrophobicContact CG-CE2 3.84Å; R163-F173 HydrophobicContact CG-CG 4.11Å; R163-F173 HydrophobicContact CG-CZ 3.78Å
164	E	82.5	Confident	83.3	Confident	34 Å²	34	58.4 Å²	58.4	16%	0.159	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-43.8	176.2	169.3	58.7	168.5	0	0	111.9	I153 E160 D161 V162 Y166 R167 R168	I153-E164 HydrophobicContact CD1-CG 3.71Å; E160-E164 WeakPolarHBondContact O-CB 3.5Å; E160-E164 PolarHBondContact O-N 3.06Å; D161-E164 PolarHBondContact O-N 3.02Å; V162-E164 VanDerWaalsContact C-N 3.32Å; V162-E164 PolarHBondContact O-N 2.98Å; E164-Y166 PolarHBondContact O-N 3.22Å; E164-R167 VanDerWaalsContact CD-NH2 3.26Å; E164-R167 WeakPolarHBondContact O-CB 3.31Å; E164-R167 PolarHBondContact O-N 3.28Å; E164-R167 IonicContact OE1-NH2 2.98Å; E164-R167 IonicContact OE2-CZ 2.76Å; E164-R167 IonicContact OE2-NE 2.59Å; E164-R167 PolarHBondContact OE2-NE 2.98Å; E164-R167 IonicContact OE2-NH2 3.27Å; E164-R167 PolarHBondContact OE2-NH2 3.2Å; E164-R168 WeakPolarHBondContact O-CG 3.46Å; E164-R168 PolarHBondContact O-N 2.83Å; E164-R168 IonicContact OE1-CZ 3.19Å; E164-R168 VanDerWaalsContact OE1-CZ 3.23Å; E164-R168 IonicContact OE1-NE 2.81Å; E164-R168 PolarHBondContact OE1-NE 3.12Å; E164-R168 IonicContact OE1-NH2 2.85Å; E164-R168 PolarHBondContact OE1-NH2 3.32Å
165	A	87.3	Confident	82.8	Confident	1 Å²	1	56 Å²	56	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-44.9	175.4	0	0	0	0	0	111.8	C145 A148 I153 D161 V162 R167 R168 R169	C145-A165 HydrophobicContact CB-CB 4.03Å; A148-A165 HydrophobicContact CB-CB 3.7Å; I153-A165 HydrophobicContact CG2-CB 4.31Å; D161-A165 WeakPolarHBondContact O-CB 3.37Å; D161-A165 PolarHBondContact O-N 2.82Å; V162-A165 PolarHBondContact O-N 2.59Å; A165-R167 VanDerWaalsContact C-N 3.33Å; A165-R167 PolarHBondContact O-N 3.12Å; A165-R168 PolarHBondContact O-N 3.29Å; A165-R169 WeakPolarHBondContact O-CG 3.46Å; A165-R169 PolarHBondContact O-N 2.68Å; A165-R169 VanDerWaalsContact O-N 3.14Å
166	Y	85.9	Confident	82.4	Confident	34 Å²	34	54.9 Å²	54.9	13%	0.133	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-43	175.6	-88.9	-127.7	0	0	0	111.6	C145 Y146 A148 V162 R163 E164 R169 G170 W171 F173	C145-Y166 WeakPolarHBondContact O-CE2 3.18Å; Y146-Y166 WeakPolarHBondContact CB-OH 3.4Å; A148-Y166 HydrophobicContact CB-CD2 3.6Å; A148-Y166 HydrophobicContact CB-CE2 3.9Å; V162-Y166 HydrophobicContact CG1-CD2 3.98Å; V162-Y166 HydrophobicContact CG1-CE2 3.88Å; V162-Y166 VanDerWaalsContact O-CD2 3.28Å; V162-Y166 WeakPolarHBondContact O-CD2 3.35Å; V162-Y166 PolarHBondContact O-N 3.08Å; R163-Y166 PolarHBondContact O-N 2.72Å; E164-Y166 PolarHBondContact O-N 3.22Å; Y166-R169 CarbonylContact O-C 3.51Å; Y166-R169 PolarHBondContact O-N 3.19Å; Y166-R169 VanDerWaalsContact O-N 3.17Å; Y166-G170 PolarHBondContact O-N 2.89Å; Y166-W171 HydrophobicContact CD1-CB 3.93Å; Y166-W171 HydrophobicContact CE1-CE3 4.4Å; Y166-W171 HydrophobicContact CG-CB 4.32Å; Y166-W171 PolarHBondContact O-N 2.85Å; Y166-F173 AromaticContact CD1-CD2 3.96Å; Y166-F173 HydrophobicContact CD1-CD2 3.96Å; Y166-F173 HydrophobicContact CE1-CD2 4.39Å; Y166-F173 HydrophobicContact CG-CD2 4.19Å
167	R	77.7	Confident	82	Confident	64 Å²	64	59.8 Å²	59.8	24%	0.242	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-45.9	178	-172.4	173.2	70.2	169.5	1.3	111.8	R163 E164 A165 R169 G170 S221 F222	R163-R167 VanDerWaalsContact O-CB 3.31Å; R163-R167 WeakPolarHBondContact O-CB 3.29Å; R163-R167 PolarHBondContact O-N 2.8Å; E164-R167 VanDerWaalsContact CD-NH2 3.26Å; E164-R167 WeakPolarHBondContact O-CB 3.31Å; E164-R167 PolarHBondContact O-N 3.28Å; E164-R167 IonicContact OE1-NH2 2.98Å; E164-R167 IonicContact OE2-CZ 2.76Å; E164-R167 IonicContact OE2-NE 2.59Å; E164-R167 PolarHBondContact OE2-NE 2.98Å; E164-R167 IonicContact OE2-NH2 3.27Å; E164-R167 PolarHBondContact OE2-NH2 3.2Å; A165-R167 VanDerWaalsContact C-N 3.33Å; A165-R167 PolarHBondContact O-N 3.12Å; R167-R169 PolarHBondContact O-N 2.97Å; R167-G170 PolarHBondContact O-N 3.33Å; R167-S221 PolarHBondContact NH1-O 3.38Å; R167-S221 VanDerWaalsContact NH1-O 3.14Å; R167-F222 HydrophobicContact CG-CB 3.94Å; R167-F222 HydrophobicContact CG-CD1 3.78Å; R167-F222 HydrophobicContact CG-CD2 4.37Å; R167-F222 HydrophobicContact CG-CE1 4.38Å; R167-F222 HydrophobicContact CG-CG 3.78Å
168	R	80.3	Confident	81.9	Confident	133 Å²	133	62.5 Å²	62.5	50%	0.502	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-33.1	175.3	-70.9	-168.8	-173.8	-168.8	4.7	112.9	D152 E164 A165 G170	D152-R168 IonicContact OD2-CZ 2.74Å; D152-R168 IonicContact OD2-NH1 2.79Å; D152-R168 PolarHBondContact OD2-NH1 2.89Å; E164-R168 WeakPolarHBondContact O-CG 3.46Å; E164-R168 PolarHBondContact O-N 2.83Å; E164-R168 IonicContact OE1-CZ 3.19Å; E164-R168 VanDerWaalsContact OE1-CZ 3.23Å; E164-R168 IonicContact OE1-NE 2.81Å; E164-R168 PolarHBondContact OE1-NE 3.12Å; E164-R168 IonicContact OE1-NH2 2.85Å; E164-R168 PolarHBondContact OE1-NH2 3.32Å; A165-R168 PolarHBondContact O-N 3.29Å; R168-G170 VanDerWaalsContact C-N 3.3Å
169	R	82.5	Confident	81.9	Confident	121 Å²	121	60.2 Å²	60.2	46%	0.457	29%	0.291	S	S	.	.	H	α-helix	trans	-78.7	-10.5	173.8	-66.5	-65.3	-170	167.4	2	113.7	A148 E149 A165 Y166 R167 W171	A148-R169 HydrophobicContact CB-CG 3.96Å; A148-R169 PolarHBondContact O-NE 3.02Å; E149-R169 PolarHBondContact O-NH2 3.22Å; A165-R169 WeakPolarHBondContact O-CG 3.46Å; A165-R169 PolarHBondContact O-N 2.68Å; A165-R169 VanDerWaalsContact O-N 3.14Å; Y166-R169 CarbonylContact O-C 3.51Å; Y166-R169 PolarHBondContact O-N 3.19Å; Y166-R169 VanDerWaalsContact O-N 3.17Å; R167-R169 PolarHBondContact O-N 2.97Å; R169-W171 VanDerWaalsContact C-N 3.25Å; R169-W171 HydrophobicContact CB-CB 4.45Å; R169-W171 HydrophobicContact CB-CD2 3.91Å; R169-W171 HydrophobicContact CB-CG 3.84Å
170	G	75.4	Confident	82	Confident	39 Å²	39	65.1 Å²	65.1	40%	0.402	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	25.7	-172.4	0	0	0	0	0	113	Y166 R167 R168	Y166-G170 PolarHBondContact O-N 2.89Å; R167-G170 PolarHBondContact O-N 3.33Å; R168-G170 VanDerWaalsContact C-N 3.3Å
171	W	81.6	Confident	82.2	Confident	115 Å²	115	61.7 Å²	61.7	44%	0.436	30%	0.297	S	S	.	.			trans	-91.1	139.5	-179.3	-69.5	1.8	0	0	0	111.1	G147 A148 Y166 R169 F173	G147-W171 VanDerWaalsContact O-CH2 3.3Å; G147-W171 WeakPolarHBondContact O-CH2 3.1Å; A148-W171 HydrophobicContact CB-CE3 4.26Å; A148-W171 HydrophobicContact CB-CZ3 4.19Å; Y166-W171 HydrophobicContact CD1-CB 3.93Å; Y166-W171 HydrophobicContact CE1-CE3 4.4Å; Y166-W171 HydrophobicContact CG-CB 4.32Å; Y166-W171 PolarHBondContact O-N 2.85Å; R169-W171 VanDerWaalsContact C-N 3.25Å; R169-W171 HydrophobicContact CB-CB 4.45Å; R169-W171 HydrophobicContact CB-CD2 3.91Å; R169-W171 HydrophobicContact CB-CG 3.84Å; W171-F173 PolarHBondContact O-N 2.91Å
172	A	69.7	Low	82.2	Confident	32 Å²	32	58.9 Å²	58.9	26%	0.264	28%	0.282	S	S	.	.			trans	-70	123.2	177.8	0	0	0	0	0	111.2	K174	A172-K174 HydrophobicContact CB-CD 4.48Å; A172-K174 HydrophobicContact CB-CG 3.93Å; A172-K174 PolarHBondContact O-N 2.84Å; A172-K174 VanDerWaalsContact O-N 3.14Å
173	F	75.2	Confident	82.1	Confident	18 Å²	18	66.5 Å²	66.5	8%	0.079	31%	0.311	C	S	.	.			trans	-85.2	80.5	173.3	-165.6	-99	0	0	0	110.7	V162 R163 Y166 W171 P176 I179	V162-F173 HydrophobicContact CG1-CE2 4.19Å; R163-F173 HydrophobicContact CG-CD1 4.04Å; R163-F173 HydrophobicContact CG-CD2 4Å; R163-F173 HydrophobicContact CG-CE1 3.86Å; R163-F173 HydrophobicContact CG-CE2 3.84Å; R163-F173 HydrophobicContact CG-CG 4.11Å; R163-F173 HydrophobicContact CG-CZ 3.78Å; Y166-F173 AromaticContact CD1-CD2 3.96Å; Y166-F173 HydrophobicContact CD1-CD2 3.96Å; Y166-F173 HydrophobicContact CE1-CD2 4.39Å; Y166-F173 HydrophobicContact CG-CD2 4.19Å; W171-F173 PolarHBondContact O-N 2.91Å; F173-P176 HydrophobicContact CE1-CB 3.77Å; F173-P176 HydrophobicContact CE1-CG 4.39Å; F173-P176 HydrophobicContact CZ-CB 4.2Å; F173-I179 HydrophobicContact CE2-CG1 3.94Å; F173-I179 HydrophobicContact CZ-CG1 4.13Å
174	K	73.3	Confident	82.3	Confident	171 Å²	171	67 Å²	67	74%	0.743	31%	0.313	S	S	*	.			trans	-80.2	-46.1	-170	-65.1	-177.2	179.4	179.8	0	114.3	A172	A172-K174 HydrophobicContact CB-CD 4.48Å; A172-K174 HydrophobicContact CB-CG 3.93Å; A172-K174 PolarHBondContact O-N 2.84Å; A172-K174 VanDerWaalsContact O-N 3.14Å
175	N	78.6	Confident	82.4	Confident	103 Å²	103	66.8 Å²	66.8	55%	0.551	31%	0.312	S	S	*	.			trans	-127.7	92.5	-170.2	-70	-13.3	0	0	0	110.4	D177 T178	N175-D177 PolarHBondContact O-N 2.94Å; N175-T178 HydrophobicContact CB-CG2 4.01Å; N175-T178 PolarHBondContact O-N 2.98Å; N175-T178 PolarHBondContact O-OG1 2.92Å
176	P	81.2	Confident	82.1	Confident	24 Å²	24	67.3 Å²	67.3	16%	0.156	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-53.4	-34	173.4	13.4	-26.7	0	0	0	113.2	F173 T178 I179 C182 F187 S188	F173-P176 HydrophobicContact CE1-CB 3.77Å; F173-P176 HydrophobicContact CE1-CG 4.39Å; F173-P176 HydrophobicContact CZ-CB 4.2Å; P176-T178 PolarHBondContact O-N 3.28Å; P176-I179 WeakPolarHBondContact O-CB 3.41Å; P176-I179 PolarHBondContact O-N 2.89Å; P176-C182 HydrophobicContact CB-CB 4.17Å; P176-C182 WeakPolarHBondContact O-CB 3.49Å; P176-F187 HydrophobicContact CB-CD1 3.75Å; P176-F187 HydrophobicContact CB-CE1 4.41Å; P176-F187 HydrophobicContact CG-CD1 4.14Å; P176-S188 VanDerWaalsContact CG-OG 3.31Å; P176-S188 WeakPolarHBondContact CG-OG 3.27Å
177	D	82.6	Confident	81.6	Confident	102 Å²	102	67.1 Å²	67.1	55%	0.545	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-67.7	-17.4	-175.5	-61.1	-35.9	0	0	0	114.3	N175 I179 S188	N175-D177 PolarHBondContact O-N 2.94Å; D177-I179 VanDerWaalsContact C-N 3.28Å; D177-S188 VanDerWaalsContact OD1-CB 3.24Å; D177-S188 WeakPolarHBondContact OD1-CB 3.19Å; D177-S188 PolarHBondContact OD1-OG 2.95Å
178	T	86.2	Confident	81.6	Confident	95 Å²	95	65 Å²	65	58%	0.583	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-80.4	-12.1	174.9	56.4	0	0	0	0	113.2	N175 P176	N175-T178 HydrophobicContact CB-CG2 4.01Å; N175-T178 PolarHBondContact O-N 2.98Å; N175-T178 PolarHBondContact O-OG1 2.92Å; P176-T178 PolarHBondContact O-N 3.28Å
179	I	88.5	Confident	81.4	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.015	31%	0.312	C	S	.	.	S	Bend	trans	-101.2	123.4	-177.2	-54.6	-59.8	0	0	0	108.2	Y146 V162 F173 P176 D177 Q181 C182 R183	Y146-I179 HydrophobicContact CD1-CD1 3.82Å; Y146-I179 HydrophobicContact CD2-CD1 3.51Å; Y146-I179 HydrophobicContact CD2-CG2 4.19Å; Y146-I179 HydrophobicContact CE1-CD1 4.02Å; Y146-I179 HydrophobicContact CE2-CB 4.31Å; Y146-I179 HydrophobicContact CE2-CD1 3.75Å; Y146-I179 HydrophobicContact CE2-CG2 3.66Å; Y146-I179 HydrophobicContact CG-CD1 3.56Å; V162-I179 HydrophobicContact CB-CG2 4.16Å; V162-I179 HydrophobicContact CG1-CD1 4.31Å; V162-I179 HydrophobicContact CG1-CG1 4.44Å; V162-I179 HydrophobicContact CG1-CG2 3.88Å; V162-I179 HydrophobicContact CG2-CG2 3.91Å; F173-I179 HydrophobicContact CE2-CG1 3.94Å; F173-I179 HydrophobicContact CZ-CG1 4.13Å; P176-I179 WeakPolarHBondContact O-CB 3.41Å; P176-I179 PolarHBondContact O-N 2.89Å; D177-I179 VanDerWaalsContact C-N 3.28Å; I179-Q181 HydrophobicContact CG2-CB 4.41Å; I179-Q181 PolarHBondContact O-N 2.75Å; I179-C182 HydrophobicContact CB-CB 4.09Å; I179-C182 HydrophobicContact CG2-CB 4.25Å; I179-C182 PolarHBondContact O-N 2.88Å; I179-R183 PolarHBondContact O-N 2.87Å
180	E	89.3	Confident	81	Confident	103 Å²	103	59.3 Å²	59.3	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-64.1	-42.4	-172	-177.6	168.4	-170.8	0	0	111.6	Y146 C182 R183 R184	Y146-E180 WeakPolarHBondContact OH-CB 3.16Å; Y146-E180 PolarHBondContact OH-N 3.32Å; E180-C182 PolarHBondContact O-N 3.42Å; E180-R183 PolarHBondContact O-N 2.83Å; E180-R184 WeakPolarHBondContact O-CB 3.37Å; E180-R184 PolarHBondContact O-N 2.73Å
181	Q	88.7	Confident	80.9	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-48.5	176.7	-57.2	88.4	-30.7	0	0	110.8	S144 Y146 C156 V162 I179 R184 E185	S144-Q181 PolarHBondContact O-NE2 3.07Å; Y146-Q181 VanDerWaalsContact CE2-OE1 3.27Å; C156-Q181 PolarHBondContact O-NE2 3.33Å; V162-Q181 HydrophobicContact CG2-CG 4.3Å; I179-Q181 HydrophobicContact CG2-CB 4.41Å; I179-Q181 PolarHBondContact O-N 2.75Å; Q181-R184 PolarHBondContact O-N 2.87Å; Q181-E185 WeakPolarHBondContact O-CB 3.17Å; Q181-E185 WeakPolarHBondContact O-CG 3.23Å; Q181-E185 PolarHBondContact O-N 2.85Å
182	C	86.3	Confident	80.6	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.5	-39	179.9	-62.4	0	0	0	0	113.4	C159 P176 I179 E180 G186 F187	C159-C182 WeakPolarHBondContact CA-SG 3.41Å; C159-C182 HydrophobicContact CB-CB 3.85Å; C159-C182 WeakPolarHBondContact CB-SG 3.18Å; C159-C182 WeakPolarHBondContact SG-CA 3.37Å; C159-C182 WeakPolarHBondContact SG-CB 3.48Å; C159-C182 CovalentContact SG-SG 2.03Å; C159-C182 PolarHBondContact SG-SG 2.74Å; P176-C182 HydrophobicContact CB-CB 4.17Å; P176-C182 WeakPolarHBondContact O-CB 3.49Å; I179-C182 HydrophobicContact CB-CB 4.09Å; I179-C182 HydrophobicContact CG2-CB 4.25Å; I179-C182 PolarHBondContact O-N 2.88Å; E180-C182 PolarHBondContact O-N 3.42Å; C182-G186 PolarHBondContact O-N 2.83Å; C182-G186 VanDerWaalsContact O-N 3.14Å; C182-F187 HydrophobicContact CB-CB 4.12Å; C182-F187 PolarHBondContact O-N 2.88Å
183	R	87.7	Confident	80.8	Confident	161 Å²	161	63.7 Å²	63.7	61%	0.608	31%	0.306	S	S	*	.	H	α-helix	trans	-65.3	-42.5	174.3	-172.1	-174.7	66.4	177.2	-2.8	111.1	I179 E180 G186	I179-R183 PolarHBondContact O-N 2.87Å; E180-R183 PolarHBondContact O-N 2.83Å; R183-G186 PolarHBondContact O-N 2.97Å
184	R	87.6	Confident	80.8	Confident	51 Å²	51	63.6 Å²	63.6	19%	0.192	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-41.9	179	-179.2	175	68.9	-153.1	2.9	112	F132 E143 N157 E180 Q181 G186	F132-R184 WeakPolarHBondContact CB-O 3.37Å; F132-R184 HydrophobicContact CD1-CG 3.98Å; F132-R184 HydrophobicContact CD2-CG 3.67Å; F132-R184 HydrophobicContact CE1-CG 4.04Å; F132-R184 HydrophobicContact CE2-CG 3.73Å; F132-R184 HydrophobicContact CG-CG 3.79Å; F132-R184 HydrophobicContact CZ-CG 3.89Å; E143-R184 IonicContact OE1-CZ 3.23Å; E143-R184 IonicContact OE1-NH1 2.74Å; E143-R184 PolarHBondContact OE1-NH1 2.89Å; E143-R184 IonicContact OE1-NH2 3.44Å; E143-R184 PolarHBondContact OE1-NH2 3.11Å; E143-R184 IonicContact OE2-CZ 2.78Å; E143-R184 IonicContact OE2-NH1 3.99Å; E143-R184 PolarHBondContact OE2-NH1 2.87Å; E143-R184 IonicContact OE2-NH2 3.49Å; E143-R184 PolarHBondContact OE2-NH2 3.42Å; N157-R184 PolarHBondContact O-NH2 3.4Å; N157-R184 VanDerWaalsContact O-NH2 3.13Å; E180-R184 WeakPolarHBondContact O-CB 3.37Å; E180-R184 PolarHBondContact O-N 2.73Å; Q181-R184 PolarHBondContact O-N 2.87Å; R184-G186 PolarHBondContact O-N 2.82Å
185	E	83.7	Confident	81	Confident	30 Å²	30	63 Å²	63	14%	0.14	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.7	177.5	-70.5	167.6	-152.1	0	0	113.5	T158 C159 Q181 F187	T158-E185 WeakPolarHBondContact CA-OE1 3.27Å; C159-E185 WeakPolarHBondContact CB-OE2 3.49Å; C159-E185 PolarHBondContact N-OE1 2.97Å; C159-E185 PolarHBondContact N-OE2 2.85Å; C159-E185 VanDerWaalsContact N-OE2 3.15Å; Q181-E185 WeakPolarHBondContact O-CB 3.17Å; Q181-E185 WeakPolarHBondContact O-CG 3.23Å; Q181-E185 PolarHBondContact O-N 2.85Å; E185-F187 VanDerWaalsContact C-N 3.35Å
186	G	81	Confident	81.1	Confident	12 Å²	12	62.4 Å²	62.4	12%	0.124	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	29.6	-179.8	0	0	0	0	0	113.3	C182 R183 R184 S188 Q189 K190	C182-G186 PolarHBondContact O-N 2.83Å; C182-G186 VanDerWaalsContact O-N 3.14Å; R183-G186 PolarHBondContact O-N 2.97Å; R184-G186 PolarHBondContact O-N 2.82Å; G186-S188 PolarHBondContact O-N 2.53Å; G186-Q189 WeakPolarHBondContact O-CB 3.39Å; G186-Q189 PolarHBondContact O-N 3.25Å; G186-K190 WeakPolarHBondContact O-CG 3.42Å; G186-K190 PolarHBondContact O-N 3.09Å
187	F	77.1	Confident	81.3	Confident	30 Å²	30	62.1 Å²	62.1	13%	0.132	30%	0.296	C	S	.	.	H	α-helix	trans	-54.1	-49.1	-173.4	-177.2	-94.6	0	0	0	112.5	P176 C182 E185 Q189 K190 M191	P176-F187 HydrophobicContact CB-CD1 3.75Å; P176-F187 HydrophobicContact CB-CE1 4.41Å; P176-F187 HydrophobicContact CG-CD1 4.14Å; C182-F187 HydrophobicContact CB-CB 4.12Å; C182-F187 PolarHBondContact O-N 2.88Å; E185-F187 VanDerWaalsContact C-N 3.35Å; F187-Q189 VanDerWaalsContact C-N 3.29Å; F187-Q189 PolarHBondContact O-N 3.36Å; F187-K190 PolarHBondContact O-N 2.8Å; F187-M191 HydrophobicContact CD1-CG 4.01Å; F187-M191 HydrophobicContact CE1-CG 3.61Å; F187-M191 HydrophobicContact CE1-SD 4.45Å; F187-M191 HydrophobicContact CE2-CE 4.36Å; F187-M191 HydrophobicContact CE2-CG 4.23Å; F187-M191 HydrophobicContact CE2-SD 4.32Å; F187-M191 HydrophobicContact CG-CG 4.48Å; F187-M191 HydrophobicContact CZ-CG 3.73Å; F187-M191 HydrophobicContact CZ-SD 3.98Å; F187-M191 VanDerWaalsContact O-CG 3.29Å; F187-M191 WeakPolarHBondContact O-CG 3.39Å; F187-M191 PolarHBondContact O-N 3.09Å
188	S	76.2	Confident	81.7	Confident	19 Å²	19	57.2 Å²	57.2	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-37.2	178.9	-54.7	0	0	0	0	112.8	P176 D177 G186 Q192	P176-S188 VanDerWaalsContact CG-OG 3.31Å; P176-S188 WeakPolarHBondContact CG-OG 3.27Å; D177-S188 VanDerWaalsContact OD1-CB 3.24Å; D177-S188 WeakPolarHBondContact OD1-CB 3.19Å; D177-S188 PolarHBondContact OD1-OG 2.95Å; G186-S188 PolarHBondContact O-N 2.53Å; S188-Q192 VanDerWaalsContact O-CG 3.31Å; S188-Q192 WeakPolarHBondContact O-CG 3.21Å; S188-Q192 PolarHBondContact O-N 2.83Å
189	Q	76.9	Confident	82	Confident	106 Å²	106	52.7 Å²	52.7	50%	0.495	24%	0.242	S	C	.	.	H	α-helix	trans	-69.3	-48.6	176.6	-179.1	178.9	-4.8	0	0	110.7	G186 F187 M191 Q192 E193	G186-Q189 WeakPolarHBondContact O-CB 3.39Å; G186-Q189 PolarHBondContact O-N 3.25Å; F187-Q189 VanDerWaalsContact C-N 3.29Å; F187-Q189 PolarHBondContact O-N 3.36Å; Q189-M191 PolarHBondContact O-N 2.85Å; Q189-Q192 PolarHBondContact O-N 2.62Å; Q189-E193 HydrophobicContact CG-CG 4.39Å; Q189-E193 VanDerWaalsContact CG-OE1 3.29Å; Q189-E193 WeakPolarHBondContact CG-OE1 3.1Å; Q189-E193 PolarHBondContact NE2-OE1 2.79Å; Q189-E193 WeakPolarHBondContact O-CG 3.24Å; Q189-E193 PolarHBondContact O-N 2.78Å
190	K	73.7	Confident	82.3	Confident	30 Å²	30	54.3 Å²	54.3	13%	0.13	25%	0.25	C	C	.	.	H	α-helix	trans	-52.4	-45.7	174.2	-71	-176.6	175	-172.5	0	110.8	E128 G186 F187 Q192 E193 Q194	E128-K190 IonicContact OE2-NZ 3.87Å; E128-K190 PolarHBondContact OE2-NZ 3.34Å; G186-K190 WeakPolarHBondContact O-CG 3.42Å; G186-K190 PolarHBondContact O-N 3.09Å; F187-K190 PolarHBondContact O-N 2.8Å; K190-Q192 PolarHBondContact O-N 2.78Å; K190-E193 PolarHBondContact O-N 3.41Å; K190-Q194 WeakPolarHBondContact O-CB 3.42Å; K190-Q194 WeakPolarHBondContact O-CG 3.27Å; K190-Q194 PolarHBondContact O-N 2.99Å
191	M	73.4	Confident	82.5	Confident	19 Å²	19	49.4 Å²	49.4	9%	0.094	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-33.9	179.6	-68.1	-56.5	97.2	0	0	113.4	A82 Y83 F187 Q189 K195	A82-M191 HydrophobicContact CB-CE 3.74Å; A82-M191 HydrophobicContact CB-SD 4.31Å; Y83-M191 HydrophobicContact CD2-SD 4.34Å; Y83-M191 HydrophobicContact CE1-SD 3.89Å; Y83-M191 HydrophobicContact CE2-SD 3.53Å; Y83-M191 VanDerWaalsContact CE2-SD 3.53Å; Y83-M191 WeakPolarHBondContact OH-CG 3.21Å; Y83-M191 PolarHBondContact OH-SD 3.5Å; F187-M191 HydrophobicContact CD1-CG 4.01Å; F187-M191 HydrophobicContact CE1-CG 3.61Å; F187-M191 HydrophobicContact CE1-SD 4.45Å; F187-M191 HydrophobicContact CE2-CE 4.36Å; F187-M191 HydrophobicContact CE2-CG 4.23Å; F187-M191 HydrophobicContact CE2-SD 4.32Å; F187-M191 HydrophobicContact CG-CG 4.48Å; F187-M191 HydrophobicContact CZ-CG 3.73Å; F187-M191 HydrophobicContact CZ-SD 3.98Å; F187-M191 VanDerWaalsContact O-CG 3.29Å; F187-M191 WeakPolarHBondContact O-CG 3.39Å; F187-M191 PolarHBondContact O-N 3.09Å; Q189-M191 PolarHBondContact O-N 2.85Å; M191-K195 PolarHBondContact O-N 2.82Å
192	Q	75.9	Confident	82.8	Confident	145 Å²	145	52.9 Å²	52.9	68%	0.678	24%	0.241	S	C	*	.	H	α-helix	trans	-71.8	-40.1	175.1	-76.5	-179.5	25	0	0	112.3	S188 Q189 K190 Q194 K195	S188-Q192 VanDerWaalsContact O-CG 3.31Å; S188-Q192 WeakPolarHBondContact O-CG 3.21Å; S188-Q192 PolarHBondContact O-N 2.83Å; Q189-Q192 PolarHBondContact O-N 2.62Å; K190-Q192 PolarHBondContact O-N 2.78Å; Q192-Q194 VanDerWaalsContact C-N 3.32Å; Q192-K195 VanDerWaalsContact O-CB 3.26Å; Q192-K195 WeakPolarHBondContact O-CB 3.46Å; Q192-K195 PolarHBondContact O-N 2.84Å
193	E	74.5	Confident	83.1	Confident	114 Å²	114	53.8 Å²	53.8	53%	0.533	25%	0.25	S	S	.	.	H	α-helix	trans	-61.8	-43.6	175.2	-72.1	172.1	-176.2	0	0	110.6	Q189 K190 K195	Q189-E193 HydrophobicContact CG-CG 4.39Å; Q189-E193 VanDerWaalsContact CG-OE1 3.29Å; Q189-E193 WeakPolarHBondContact CG-OE1 3.1Å; Q189-E193 PolarHBondContact NE2-OE1 2.79Å; Q189-E193 WeakPolarHBondContact O-CG 3.24Å; Q189-E193 PolarHBondContact O-N 2.78Å; K190-E193 PolarHBondContact O-N 3.41Å; E193-K195 VanDerWaalsContact C-N 3.28Å; E193-K195 PolarHBondContact O-N 2.78Å
194	Q	75.5	Confident	83.4	Confident	16 Å²	16	48.8 Å²	48.8	8%	0.075	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-76.3	-6.8	179.4	-67	-179.5	17.3	0	0	114.4	P80 K190 Q192 N196 E197	P80-Q194 HydrophobicContact CB-CB 4.14Å; P80-Q194 WeakPolarHBondContact CG-O 3.26Å; K190-Q194 WeakPolarHBondContact O-CB 3.42Å; K190-Q194 WeakPolarHBondContact O-CG 3.27Å; K190-Q194 PolarHBondContact O-N 2.99Å; Q192-Q194 VanDerWaalsContact C-N 3.32Å; Q194-N196 PolarHBondContact O-N 2.95Å; Q194-E197 WeakPolarHBondContact O-CB 3.21Å; Q194-E197 PolarHBondContact O-N 2.78Å
195	K	75.7	Confident	83.6	Confident	157 Å²	157	46.3 Å²	46.3	68%	0.683	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-55.9	-27.6	-170.3	-178.3	174	178.6	179.9	0	114.8	M191 Q192 E193	M191-K195 PolarHBondContact O-N 2.82Å; Q192-K195 VanDerWaalsContact O-CB 3.26Å; Q192-K195 WeakPolarHBondContact O-CB 3.46Å; Q192-K195 PolarHBondContact O-N 2.84Å; E193-K195 VanDerWaalsContact C-N 3.28Å; E193-K195 PolarHBondContact O-N 2.78Å
196	N	80.6	Confident	83.9	Confident	91 Å²	91	49.5 Å²	49.5	49%	0.487	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-116.6	19.4	179.9	-54.4	-66.6	0	0	0	112.8	K110 Q194	K110-N196 HydrophobicContact CD-CB 4.22Å; K110-N196 HydrophobicContact CG-CB 4.05Å; K110-N196 VanDerWaalsContact CG-O 3.29Å; K110-N196 WeakPolarHBondContact CG-O 3.14Å; Q194-N196 PolarHBondContact O-N 2.95Å
197	E	87.2	Confident	84.4	Confident	18 Å²	18	49.2 Å²	49.2	8%	0.084	23%	0.234	C	C	.	.			trans	-84.7	157.2	174.2	-69.7	-177.9	-166	0	0	110.9	M79 R107 L108 Q194	M79-E197 CarbonylContact C-O 3.57Å; R107-E197 IonicContact CZ-OE1 2.61Å; R107-E197 IonicContact CZ-OE2 3.89Å; R107-E197 IonicContact NE-OE1 3.31Å; R107-E197 IonicContact NE-OE2 2.8Å; R107-E197 PolarHBondContact NE-OE2 3.31Å; R107-E197 VanDerWaalsContact NH2-CD 3.33Å; R107-E197 IonicContact NH2-OE1 3.97Å; R107-E197 PolarHBondContact NH2-OE1 3.19Å; R107-E197 IonicContact NH2-OE2 3.68Å; R107-E197 PolarHBondContact NH2-OE2 2.88Å; R107-E197 VanDerWaalsContact NH2-OE2 3.09Å; L108-E197 CarbonylContact O-C 3.53Å; L108-E197 VanDerWaalsContact O-CA 3.24Å; L108-E197 WeakPolarHBondContact O-CA 3.37Å; L108-E197 WeakPolarHBondContact O-CB 3.21Å; Q194-E197 WeakPolarHBondContact O-CB 3.21Å; Q194-E197 PolarHBondContact O-N 2.78Å
198	G	90.9	Very high	85	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	173.8	165.4	0	0	0	0	0	111.9	F76 M79 L108	F76-G198 CarbonylContact O-C 3.53Å; F76-G198 WeakPolarHBondContact O-CA 2.95Å; M79-G198 CarbonylContact O-C 3.59Å; M79-G198 VanDerWaalsContact O-C 3.32Å; L108-G198 PolarHBondContact N-O 3.41Å; L108-G198 PolarHBondContact O-N 2.79Å
199	C	92.5	Very high	85.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.6	175.1	-167.2	0	0	0	0	111.1	F76 M79 C81 L84	F76-C199 PolarHBondContact N-O 2.81Å; F76-C199 PolarHBondContact O-N 3.13Å; M79-C199 WeakPolarHBondContact O-CB 3.45Å; M79-C199 PolarHBondContact O-N 2.86Å; M79-C199 VanDerWaalsContact O-N 3.07Å; C81-C199 WeakPolarHBondContact CA-SG 3.31Å; C81-C199 HydrophobicContact CB-CB 3.93Å; C81-C199 WeakPolarHBondContact CB-SG 3.45Å; C81-C199 WeakPolarHBondContact SG-CA 3.41Å; C81-C199 WeakPolarHBondContact SG-CB 3.22Å; C81-C199 CovalentContact SG-SG 2.04Å; C81-C199 PolarHBondContact SG-SG 3.28Å; L84-C199 HydrophobicContact CD2-CB 4.16Å
200	Q	94.8	Very high	86.4	Confident	36 Å²	36	48 Å²	48	17%	0.168	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.4	163.9	-178.1	-174.6	8	0	0	108.9	D73 L75 K105 Q106 L108 Y202	D73-Q200 PolarHBondContact OD1-NE2 2.78Å; D73-Q200 PolarHBondContact OD2-NE2 2.78Å; L75-Q200 HydrophobicContact CD1-CB 4.17Å; K105-Q200 WeakPolarHBondContact CA-O 3.29Å; Q106-Q200 HydrophobicContact CB-CB 4.3Å; Q106-Q200 PolarHBondContact N-O 2.73Å; Q106-Q200 PolarHBondContact O-N 3Å; L108-Q200 HydrophobicContact CD1-CB 3.99Å; Q200-Y202 HydrophobicContact CG-CD1 4.17Å
201	V	93.4	Very high	87.4	Confident	1 Å²	1	48 Å²	48	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116.8	173.2	-174.2	0	0	0	0	108.1	D73 V74 F76 L84 F104 K105 F216	D73-V201 WeakPolarHBondContact CA-O 3.44Å; V74-V201 PolarHBondContact N-O 2.85Å; V74-V201 PolarHBondContact O-N 2.79Å; F76-V201 HydrophobicContact CE2-CG2 4.49Å; L84-V201 HydrophobicContact CD2-CG2 3.46Å; L84-V201 VanDerWaalsContact CD2-CG2 3.46Å; L84-V201 HydrophobicContact CG-CG2 4.49Å; F104-V201 WeakPolarHBondContact O-CA 3.34Å; K105-V201 HydrophobicContact CG-CG2 4.36Å; V201-F216 HydrophobicContact CB-CE1 4.16Å; V201-F216 HydrophobicContact CG1-CE1 4.02Å; V201-F216 HydrophobicContact CG2-CE1 4.45Å
202	Y	94.4	Very high	88.3	Confident	74 Å²	74	47.6 Å²	47.6	29%	0.29	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.5	-180	71	-85.1	0	0	0	112.8	I72 F104 Q106 A119 Q200	I72-Y202 CarbonylContact O-C 3.49Å; I72-Y202 WeakPolarHBondContact O-CA 3.45Å; F104-Y202 HydrophobicContact CB-CD1 4.11Å; F104-Y202 HydrophobicContact CB-CD2 4.3Å; F104-Y202 HydrophobicContact CB-CE1 3.62Å; F104-Y202 HydrophobicContact CB-CE2 3.82Å; F104-Y202 HydrophobicContact CB-CG 4.44Å; F104-Y202 VanDerWaalsContact CB-CZ 3.46Å; F104-Y202 HydrophobicContact CD2-CD2 4.24Å; F104-Y202 AromaticContact CD2-CE2 3.81Å; F104-Y202 HydrophobicContact CD2-CE2 3.81Å; F104-Y202 AromaticContact CG-CE2 3.98Å; F104-Y202 HydrophobicContact CG-CE2 3.98Å; F104-Y202 AromaticContact CG-CZ 3.95Å; F104-Y202 PolarHBondContact N-O 2.75Å; F104-Y202 PolarHBondContact O-N 3.33Å; Q106-Y202 HydrophobicContact CB-CE1 4.15Å; A119-Y202 HydrophobicContact CB-CE1 4.18Å; A119-Y202 WeakPolarHBondContact CB-OH 3.26Å; Q200-Y202 HydrophobicContact CG-CD1 4.17Å
203	G	93.3	Very high	89.2	Confident	20 Å²	20	42.7 Å²	42.7	21%	0.206	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.4	-143.7	-179.6	0	0	0	0	0	111.5	N71 I72 N102	N71-G203 WeakPolarHBondContact CA-O 3.09Å; I72-G203 PolarHBondContact N-O 2.89Å; I72-G203 PolarHBondContact O-N 2.81Å; N102-G203 WeakPolarHBondContact O-CA 3.5Å
204	F	93	Very high	90.1	Very high	55 Å²	55	37.3 Å²	37.3	24%	0.241	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.9	177.6	67	-88.3	0	0	0	113.8	K69 I70 N102	K69-F204 HydrophobicContact CD-CB 4.37Å; K69-F204 HydrophobicContact CD-CD2 4.07Å; K69-F204 HydrophobicContact CD-CG 4.21Å; K69-F204 HydrophobicContact CG-CB 3.89Å; K69-F204 HydrophobicContact CG-CD2 3.78Å; K69-F204 HydrophobicContact CG-CG 4.05Å; I70-F204 CarbonylContact O-C 3.32Å; I70-F204 WeakPolarHBondContact O-CA 3.25Å; N102-F204 HydrophobicContact CB-CD1 4.09Å; N102-F204 HydrophobicContact CB-CD2 3.95Å; N102-F204 HydrophobicContact CB-CE1 3.86Å; N102-F204 HydrophobicContact CB-CE2 3.73Å; N102-F204 HydrophobicContact CB-CG 4.13Å; N102-F204 HydrophobicContact CB-CZ 3.68Å; N102-F204 WeakPolarHBondContact CB-O 3.3Å; N102-F204 VanDerWaalsContact CG-CE2 3.46Å; N102-F204 WeakPolarHBondContact ND2-CE2 3.4Å; N102-F204 PolarHBondContact O-N 3.11Å; N102-F204 WeakPolarHBondContact OD1-CZ 3.38Å
205	L	91.5	Very high	90.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138.6	167	-68.2	173.1	0	0	0	109.7	K69 I70 I72 I86 A88 V99 L103 V207 F214	K69-L205 CarbonylContact C-O 3.5Å; K69-L205 WeakPolarHBondContact CA-O 3.05Å; I70-L205 HydrophobicContact CB-CB 4.31Å; I70-L205 PolarHBondContact N-O 2.85Å; I70-L205 PolarHBondContact O-N 3.22Å; I72-L205 HydrophobicContact CD1-CD1 3.57Å; I72-L205 HydrophobicContact CD1-CG 3.94Å; I86-L205 HydrophobicContact CD1-CD1 3.89Å; I86-L205 HydrophobicContact CD1-CG 4.43Å; A88-L205 HydrophobicContact CB-CD1 4.46Å; V99-L205 HydrophobicContact CB-CD2 3.55Å; V99-L205 HydrophobicContact CG1-CD2 3.53Å; V99-L205 HydrophobicContact CG2-CD2 3.85Å; L103-L205 HydrophobicContact CD1-CD2 3.4Å; L103-L205 VanDerWaalsContact CD1-CD2 3.4Å; L103-L205 HydrophobicContact CD1-CG 3.87Å; L103-L205 HydrophobicContact CG-CD2 4.18Å; L205-V207 HydrophobicContact CB-CG1 4.35Å; L205-F214 HydrophobicContact CD1-CB 4.07Å; L205-F214 HydrophobicContact CD1-CD2 4.42Å; L205-F214 HydrophobicContact CD1-CG 4.17Å
206	E	90.5	Very high	91.7	Very high	97 Å²	97	29.5 Å²	29.5	45%	0.453	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	106.8	172.2	-169.1	175.3	158.9	0	0	109.4	K67 Q96	K67-E206 HydrophobicContact CB-CG 4.03Å; K67-E206 HydrophobicContact CG-CG 4.4Å; Q96-E206 PolarHBondContact NE2-O 3.46Å
207	V	90.6	Very high	92.1	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.03	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	164.8	-174.8	-60	0	0	0	0	111	K67 L68 I70 A88 L205	K67-V207 CarbonylContact C-O 3.56Å; K67-V207 WeakPolarHBondContact CA-O 3.45Å; K67-V207 WeakPolarHBondContact CD-O 3.07Å; L68-V207 HydrophobicContact CB-CG2 4.03Å; L68-V207 HydrophobicContact CD2-CG2 4.48Å; L68-V207 HydrophobicContact CG-CG2 4.47Å; L68-V207 PolarHBondContact N-O 2.88Å; L68-V207 WeakPolarHBondContact O-CG2 3.21Å; L68-V207 PolarHBondContact O-N 2.95Å; I70-V207 HydrophobicContact CD1-CG1 4.5Å; I70-V207 HydrophobicContact CD1-CG2 3.75Å; I70-V207 HydrophobicContact CG1-CG2 4.16Å; A88-V207 HydrophobicContact CB-CG1 4.12Å; L205-V207 HydrophobicContact CB-CG1 4.35Å
208	N	90.4	Very high	92	Very high	34 Å²	34	24.3 Å²	24.3	18%	0.182	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	142.1	168.9	-68.6	-39.1	0	0	0	110.2	K67 D90 E94 V210	K67-N208 WeakPolarHBondContact CE-OD1 3.44Å; K67-N208 PolarHBondContact NZ-OD1 2.66Å; D90-N208 PolarHBondContact OD2-ND2 2.81Å; E94-N208 PolarHBondContact OE2-ND2 2.9Å; N208-V210 HydrophobicContact CB-CG2 3.8Å; N208-V210 PolarHBondContact O-N 3.11Å
209	K	91	Very high	91.4	Very high	42 Å²	42	24.6 Å²	24.6	18%	0.183	13%	0.132	C	C	.	.	S	Bend	trans	-75.2	64.2	172.8	-168.5	-175.1	170.4	-171.9	0	111	D61 S63 D66 L68 L327	D61-K209 IonicContact OD1-NZ 3.91Å; D61-K209 IonicContact OD2-NZ 3.19Å; D61-K209 PolarHBondContact OD2-NZ 3.4Å; S63-K209 PolarHBondContact OG-NZ 2.85Å; D66-K209 HydrophobicContact CB-CB 4.41Å; D66-K209 HydrophobicContact CB-CD 3.98Å; D66-K209 WeakPolarHBondContact O-CB 3.21Å; D66-K209 PolarHBondContact O-N 3.4Å; L68-K209 HydrophobicContact CB-CB 4.28Å; K209-L327 HydrophobicContact CD-CD2 4.23Å; K209-L327 HydrophobicContact CG-CD1 4.42Å; K209-L327 HydrophobicContact CG-CD2 3.45Å; K209-L327 VanDerWaalsContact CG-CD2 3.45Å
210	V	91.6	Very high	90.4	Very high	53 Å²	53	26.9 Å²	26.9	32%	0.321	14%	0.142	S	C	.	.	S	Bend	trans	-134.8	166.9	175.2	-61.8	0	0	0	0	108.7	D90 V91 N208 Y325 L327	D90-V210 HydrophobicContact CB-CG2 3.72Å; V91-V210 HydrophobicContact CG2-CB 4.19Å; V91-V210 HydrophobicContact CG2-CG2 4.25Å; N208-V210 HydrophobicContact CB-CG2 3.8Å; N208-V210 PolarHBondContact O-N 3.11Å; V210-Y325 VanDerWaalsContact O-CE2 3.23Å; V210-Y325 WeakPolarHBondContact O-CE2 3.24Å; V210-L327 WeakPolarHBondContact O-CD1 3.49Å
211	A	94.1	Very high	89.3	Confident	30 Å²	30	25.4 Å²	25.4	25%	0.248	14%	0.135	C	C	.	.	S	Bend	trans	-61.2	145.7	175	0	0	0	0	0	110.5	V91 Y325 E326	V91-A211 HydrophobicContact CG1-CB 3.86Å; V91-A211 WeakPolarHBondContact CG1-O 3.39Å; V91-A211 HydrophobicContact CG2-CB 4.39Å; V91-A211 WeakPolarHBondContact CG2-O 3.46Å; V91-A211 PolarHBondContact N-O 3.22Å; A211-Y325 WeakPolarHBondContact CA-O 3.43Å; A211-E326 HydrophobicContact CB-CG 4.43Å
212	G	93.6	Very high	88	Confident	11 Å²	11	26.9 Å²	26.9	11%	0.113	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	-171.9	-177.1	0	0	0	0	0	112	M89 Y325	M89-G212 CarbonylContact O-C 3.59Å; M89-G212 VanDerWaalsContact O-CA 3.23Å; M89-G212 WeakPolarHBondContact O-CA 3.42Å; G212-Y325 PolarHBondContact N-O 2.89Å; G212-Y325 WeakPolarHBondContact O-CD1 3.3Å; G212-Y325 PolarHBondContact O-N 3.47Å; G212-Y325 VanDerWaalsContact O-O 3.12Å
213	N	93.6	Very high	86.7	Confident	42 Å²	42	28.4 Å²	28.4	23%	0.225	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154	171.6	67.8	95	0	0	0	109.9	A88 M89 V323 L324	A88-N213 CarbonylContact C-O 3.46Å; A88-N213 WeakPolarHBondContact CA-O 3.45Å; M89-N213 PolarHBondContact N-O 2.81Å; M89-N213 PolarHBondContact O-N 3.12Å; M89-N213 VanDerWaalsContact O-O 3.14Å; N213-V323 CarbonylContact C-O 3.49Å; N213-V323 WeakPolarHBondContact CA-O 3.36Å; N213-V323 WeakPolarHBondContact CB-O 3.4Å; N213-L324 HydrophobicContact CB-CB 4.48Å; N213-L324 HydrophobicContact CB-CG 4.1Å
214	F	93.5	Very high	85.3	Confident	1 Å²	1	31.8 Å²	31.8	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.8	161.1	67.1	-89.3	0	0	0	108.3	I70 I72 D87 A88 L205 F216 L249 V323 Y325	I70-F214 HydrophobicContact CD1-CD1 3.97Å; I70-F214 HydrophobicContact CD1-CE1 4.09Å; I70-F214 HydrophobicContact CG2-CE1 3.88Å; I70-F214 HydrophobicContact CG2-CZ 4.16Å; I72-F214 HydrophobicContact CD1-CD2 4.06Å; I72-F214 HydrophobicContact CD1-CE2 3.75Å; I72-F214 HydrophobicContact CD1-CZ 4.19Å; I72-F214 HydrophobicContact CG1-CE2 4.45Å; D87-F214 CarbonylContact O-C 3.55Å; D87-F214 WeakPolarHBondContact O-CA 3.44Å; D87-F214 VanDerWaalsContact O-CB 3.29Å; D87-F214 WeakPolarHBondContact O-CB 3.46Å; A88-F214 HydrophobicContact CB-CB 4.09Å; L205-F214 HydrophobicContact CD1-CB 4.07Å; L205-F214 HydrophobicContact CD1-CD2 4.42Å; L205-F214 HydrophobicContact CD1-CG 4.17Å; F214-F216 HydrophobicContact CD2-CE2 4.13Å; F214-F216 HydrophobicContact CD2-CZ 4.44Å; F214-F216 AromaticContact CE2-CE2 3.81Å; F214-F216 HydrophobicContact CE2-CE2 3.81Å; F214-F216 HydrophobicContact CE2-CZ 4.18Å; F214-L249 HydrophobicContact CZ-CD1 3.77Å; F214-L249 HydrophobicContact CZ-CD2 4.49Å; F214-V323 HydrophobicContact CD1-CB 4Å; F214-V323 HydrophobicContact CD1-CG1 4.28Å; F214-V323 HydrophobicContact CD2-CB 4.26Å; F214-V323 HydrophobicContact CD2-CG2 4.43Å; F214-V323 HydrophobicContact CE1-CB 3.49Å; F214-V323 VanDerWaalsContact CE1-CB 3.49Å; F214-V323 HydrophobicContact CE1-CG1 3.46Å; F214-V323 VanDerWaalsContact CE1-CG1 3.46Å; F214-V323 HydrophobicContact CE1-CG2 4.17Å; F214-V323 HydrophobicContact CE2-CB 3.79Å; F214-V323 HydrophobicContact CE2-CG1 4.47Å; F214-V323 HydrophobicContact CE2-CG2 3.66Å; F214-V323 HydrophobicContact CG-CB 4.36Å; F214-V323 HydrophobicContact CZ-CB 3.38Å; F214-V323 HydrophobicContact CZ-CG1 3.58Å; F214-V323 HydrophobicContact CZ-CG2 3.5Å; F214-V323 PolarHBondContact N-O 3.29Å; F214-V323 PolarHBondContact O-N 3.14Å; F214-Y325 HydrophobicContact CD1-CD1 4.08Å; F214-Y325 HydrophobicContact CD1-CE1 4.06Å; F214-Y325 HydrophobicContact CE1-CD1 4.43Å
215	H	93	Very high	83.8	Confident	7 Å²	7	34.3 Å²	34.3	3%	0.032	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	151.6	-177.5	62.3	-95.1	0	0	0	112.5	I86 D87 H228 H230 V321 F322	I86-H215 WeakPolarHBondContact CA-O 3.19Å; D87-H215 PolarHBondContact N-O 3.45Å; D87-H215 VanDerWaalsContact N-O 3.14Å; D87-H215 PolarHBondContact O-N 2.93Å; D87-H215 IonicContact OD2-CE1 2.97Å; D87-H215 IonicContact OD2-NE2 2.68Å; D87-H215 PolarHBondContact OD2-NE2 3.29Å; D87-H215 VanDerWaalsContact OD2-NE2 3.13Å; H215-H228 AromaticContact CE1-CE1 3.35Å; H215-H228 PolarHBondContact CE1-CE1 3.28Å; H215-H228 AromaticContact NE2-CE1 3.32Å; H215-H228 PolarHBondContact NE2-CE1 2.93Å; H215-H228 VanDerWaalsContact NE2-CE1 3.32Å; H215-H228 AromaticContact NE2-NE2 3.99Å; H215-H230 AromaticContact CD2-NE2 3.56Å; H215-H230 AromaticContact NE2-CE1 3.66Å; H215-H230 AromaticContact NE2-NE2 2.91Å; H215-H230 PolarHBondContact NE2-NE2 3.08Å; H215-V321 CarbonylContact C-O 3.44Å; H215-V321 WeakPolarHBondContact CA-O 3.36Å; H215-V321 WeakPolarHBondContact CB-O 3.42Å; H215-F322 HydrophobicContact CB-CB 4.24Å; H215-F322 HydrophobicContact CB-CD1 3.22Å; H215-F322 HydrophobicContact CB-CE1 3.49Å; H215-F322 VanDerWaalsContact CB-CE1 3.49Å; H215-F322 HydrophobicContact CB-CG 3.77Å; H215-F322 HydrophobicContact CB-CZ 4.24Å; H215-F322 AromaticContact CD2-CE1 3.96Å; H215-F322 AromaticContact CG-CD1 3.66Å; H215-F322 AromaticContact CG-CE1 3.46Å; H215-F322 VanDerWaalsContact CG-CE1 3.46Å; H215-F322 AromaticContact ND1-CE1 3.87Å
216	F	92.6	Very high	82.5	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.6	170.7	-52.8	-91.8	0	0	0	107.8	I72 V74 F76 L84 S85 I86 V201 F214 G320 V321	I72-F216 HydrophobicContact CD1-CZ 4.4Å; I72-F216 HydrophobicContact CG2-CE1 4.32Å; I72-F216 HydrophobicContact CG2-CZ 3.69Å; V74-F216 HydrophobicContact CB-CZ 4.43Å; V74-F216 HydrophobicContact CG2-CE2 4.35Å; V74-F216 HydrophobicContact CG2-CZ 4.14Å; F76-F216 HydrophobicContact CE1-CB 4.17Å; F76-F216 HydrophobicContact CE2-CB 4.25Å; F76-F216 AromaticContact CE2-CD1 3.83Å; F76-F216 HydrophobicContact CE2-CD1 3.83Å; F76-F216 HydrophobicContact CE2-CD2 4.49Å; F76-F216 HydrophobicContact CE2-CE1 4.27Å; F76-F216 AromaticContact CE2-CG 3.95Å; F76-F216 HydrophobicContact CE2-CG 3.95Å; F76-F216 HydrophobicContact CZ-CB 3.54Å; F76-F216 AromaticContact CZ-CD1 3.9Å; F76-F216 HydrophobicContact CZ-CD1 3.9Å; F76-F216 AromaticContact CZ-CD2 3.87Å; F76-F216 HydrophobicContact CZ-CD2 3.87Å; F76-F216 AromaticContact CZ-CG 3.5Å; F76-F216 HydrophobicContact CZ-CG 3.5Å; L84-F216 HydrophobicContact CD1-CB 3.94Å; S85-F216 WeakPolarHBondContact O-CA 3.3Å; I86-F216 HydrophobicContact CB-CD1 4.17Å; I86-F216 HydrophobicContact CB-CE1 4.29Å; I86-F216 HydrophobicContact CD1-CD1 4.15Å; I86-F216 HydrophobicContact CD1-CE1 3.47Å; I86-F216 VanDerWaalsContact CD1-CE1 3.47Å; I86-F216 HydrophobicContact CD1-CZ 3.81Å; I86-F216 HydrophobicContact CG1-CD1 4.07Å; I86-F216 HydrophobicContact CG1-CE1 3.91Å; I86-F216 HydrophobicContact CG1-CZ 4.44Å; V201-F216 HydrophobicContact CB-CE1 4.16Å; V201-F216 HydrophobicContact CG1-CE1 4.02Å; V201-F216 HydrophobicContact CG2-CE1 4.45Å; F214-F216 HydrophobicContact CD2-CE2 4.13Å; F214-F216 HydrophobicContact CD2-CZ 4.44Å; F214-F216 AromaticContact CE2-CE2 3.81Å; F214-F216 HydrophobicContact CE2-CE2 3.81Å; F214-F216 HydrophobicContact CE2-CZ 4.18Å; F216-G320 CarbonylContact O-C 3.54Å; F216-G320 WeakPolarHBondContact O-CA 3.37Å; F216-V321 HydrophobicContact CB-CB 4.34Å; F216-V321 HydrophobicContact CD2-CB 4.09Å; F216-V321 HydrophobicContact CD2-CG1 4.21Å; F216-V321 PolarHBondContact N-O 3.27Å; F216-V321 PolarHBondContact O-N 3.19Å
217	A	89.1	Confident	81.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.4	180	0	0	0	0	0	110.8	S85 L318	S85-A217 PolarHBondContact N-O 3.49Å; S85-A217 PolarHBondContact O-N 3.18Å; S85-A217 VanDerWaalsContact O-N 3.17Å; S85-A217 PolarHBondContact OG-O 2.96Å; S85-A217 VanDerWaalsContact OG-O 3.13Å; A217-L318 HydrophobicContact CB-CD2 3.55Å
218	P	85.1	Confident	80.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	148.8	172.5	20.7	-18.9	0	0	0	110.5	M79 Y83 L232 F235 I240 M242 P319	M79-P218 HydrophobicContact SD-CB 4.17Å; Y83-P218 CarbonylContact O-C 3.43Å; Y83-P218 VanDerWaalsContact O-CA 3.31Å; Y83-P218 WeakPolarHBondContact O-CA 3.32Å; P218-L232 HydrophobicContact CB-CD2 3.95Å; P218-L232 HydrophobicContact CG-CD2 3.65Å; P218-L232 WeakPolarHBondContact O-CD2 3.48Å; P218-F235 HydrophobicContact CB-CD2 4.46Å; P218-F235 HydrophobicContact CB-CE1 4.4Å; P218-F235 HydrophobicContact CB-CE2 4.11Å; P218-F235 HydrophobicContact CB-CZ 4.02Å; P218-I240 HydrophobicContact CB-CD1 4.48Å; P218-I240 HydrophobicContact CG-CD1 3.86Å; P218-I240 HydrophobicContact CG-CG1 4.4Å; P218-I240 HydrophobicContact CG-CG2 3.75Å; P218-M242 HydrophobicContact CG-SD 4.41Å; P218-P319 WeakPolarHBondContact CD-O 3.4Å; P218-P319 HydrophobicContact CG-CG 4.42Å
219	G	78.2	Confident	78.9	Confident	5 Å²	5	44.6 Å²	44.6	5%	0.052	24%	0.242	C	C	.	.	S	Bend	trans	81.4	150.6	-179.9	0	0	0	0	0	112.8	Y83 S85 H230 D231	Y83-G219 PolarHBondContact O-N 3.43Å; S85-G219 WeakPolarHBondContact CB-O 3.43Å; S85-G219 PolarHBondContact OG-O 2.97Å; G219-H230 PolarHBondContact O-ND1 3.32Å; G219-H230 VanDerWaalsContact O-ND1 3.1Å; G219-D231 WeakPolarHBondContact CA-O 3.35Å
220	K	72.1	Confident	78	Confident	48 Å²	48	43.2 Å²	43.2	21%	0.209	24%	0.236	C	C	.	.			trans	-68.2	138.2	173.9	-69.1	-84.8	-172.9	171	0	109	D98 E100 D231	D98-K220 VanDerWaalsContact OD2-CD 3.22Å; D98-K220 WeakPolarHBondContact OD2-CD 3.47Å; D98-K220 WeakPolarHBondContact OD2-CE 3.5Å; D98-K220 IonicContact OD2-NZ 3.51Å; D98-K220 PolarHBondContact OD2-NZ 3.19Å; E100-K220 IonicContact OE1-NZ 2.72Å; K220-D231 PolarHBondContact O-N 2.9Å; K220-D231 VanDerWaalsContact O-N 3.12Å
221	S	71.5	Confident	76.7	Confident	5 Å²	5	42 Å²	42	4%	0.035	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	150.8	174.4	55.1	0	0	0	0	111.2	D87 R167 H228 V229	D87-S221 VanDerWaalsContact CG-OG 3.23Å; D87-S221 WeakPolarHBondContact OD1-CB 3.42Å; D87-S221 PolarHBondContact OD1-OG 2.85Å; D87-S221 WeakPolarHBondContact OD2-CB 3.37Å; D87-S221 PolarHBondContact OD2-OG 2.85Å; R167-S221 PolarHBondContact NH1-O 3.38Å; R167-S221 VanDerWaalsContact NH1-O 3.14Å; S221-H228 WeakPolarHBondContact CB-NE2 3.49Å; S221-V229 CarbonylContact C-O 3.57Å; S221-V229 WeakPolarHBondContact CA-O 3.34Å
222	F	66.2	Low	75.4	Confident	32 Å²	32	41.7 Å²	41.7	14%	0.14	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	157.2	169.4	63.6	-80.6	0	0	0	110.6	R167 Q224 V229 D231	R167-F222 HydrophobicContact CG-CB 3.94Å; R167-F222 HydrophobicContact CG-CD1 3.78Å; R167-F222 HydrophobicContact CG-CD2 4.37Å; R167-F222 HydrophobicContact CG-CE1 4.38Å; R167-F222 HydrophobicContact CG-CG 3.78Å; F222-Q224 HydrophobicContact CD2-CB 3.99Å; F222-Q224 HydrophobicContact CE2-CB 3.77Å; F222-V229 WeakPolarHBondContact CD1-O 3.49Å; F222-V229 HydrophobicContact CE1-CB 4.05Å; F222-V229 HydrophobicContact CE1-CG1 3.93Å; F222-V229 HydrophobicContact CE2-CB 4.13Å; F222-V229 HydrophobicContact CE2-CG1 4.45Å; F222-V229 HydrophobicContact CZ-CB 3.83Å; F222-V229 HydrophobicContact CZ-CG1 3.71Å; F222-V229 PolarHBondContact N-O 3Å; F222-V229 PolarHBondContact O-N 2.8Å; F222-D231 HydrophobicContact CD1-CB 4.47Å; F222-D231 HydrophobicContact CE1-CB 3.98Å
223	Q	65.4	Low	73.8	Confident	106 Å²	106	47.5 Å²	47.5	50%	0.495	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.2	174.6	-169.4	-179.4	11.5	0	0	109
224	Q	63.8	Low	72.1	Confident	91 Å²	91	48 Å²	48	43%	0.425	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.3	172	-169	176	37.5	0	0	109	F222 H226 V227	F222-Q224 HydrophobicContact CD2-CB 3.99Å; F222-Q224 HydrophobicContact CE2-CB 3.77Å; Q224-H226 VanDerWaalsContact C-N 3.32Å; Q224-H226 PolarHBondContact O-N 3.35Å; Q224-V227 PolarHBondContact N-O 3.38Å; Q224-V227 WeakPolarHBondContact O-CB 3.19Å; Q224-V227 PolarHBondContact O-N 2.96Å
225	S	63.1	Low	70.5	Confident	108 Å²	108	49.4 Å²	49.4	76%	0.755	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	43.8	177.6	-55.9	0	0	0	0	114	V227	S225-V227 PolarHBondContact O-N 3.01Å
226	H	64.5	Low	68.7	Low	169 Å²	169	51.4 Å²	51.4	78%	0.782	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	5.7	-174.9	-51.8	-72.2	0	0	0	115.9	Q224	Q224-H226 VanDerWaalsContact C-N 3.32Å; Q224-H226 PolarHBondContact O-N 3.35Å
227	V	65	Low	67	Low	86 Å²	86	54.1 Å²	54.1	52%	0.521	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.9	171.9	-174.4	0	0	0	0	108.4	Q224 S225 V229	Q224-V227 PolarHBondContact N-O 3.38Å; Q224-V227 WeakPolarHBondContact O-CB 3.19Å; Q224-V227 PolarHBondContact O-N 2.96Å; S225-V227 PolarHBondContact O-N 3.01Å; V227-V229 HydrophobicContact CB-CG2 4.33Å; V227-V229 HydrophobicContact CG1-CG2 3.89Å
228	H	67.2	Low	65.6	Low	49 Å²	49	60.4 Å²	60.4	23%	0.227	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124	171.4	173.3	-93	0	0	0	109	D87 L97 H215 S221 H230	D87-H228 IonicContact OD2-CE1 3.54Å; D87-H228 PolarHBondContact OD2-CE1 2.68Å; D87-H228 VanDerWaalsContact OD2-CE1 3.24Å; D87-H228 IonicContact OD2-NE2 3.02Å; D87-H228 PolarHBondContact OD2-NE2 2.94Å; L97-H228 VanDerWaalsContact CD2-CD2 3.42Å; L97-H228 WeakPolarHBondContact CD2-CD2 3.48Å; H215-H228 AromaticContact CE1-CE1 3.35Å; H215-H228 PolarHBondContact CE1-CE1 3.28Å; H215-H228 AromaticContact NE2-CE1 3.32Å; H215-H228 PolarHBondContact NE2-CE1 2.93Å; H215-H228 VanDerWaalsContact NE2-CE1 3.32Å; H215-H228 AromaticContact NE2-NE2 3.99Å; S221-H228 WeakPolarHBondContact CB-NE2 3.49Å; H228-H230 AromaticContact CE1-CD2 3.48Å; H228-H230 PolarHBondContact CE1-CD2 2.82Å; H228-H230 VanDerWaalsContact CE1-CD2 3.48Å; H228-H230 AromaticContact CE1-NE2 3.11Å; H228-H230 PolarHBondContact CE1-NE2 2.77Å; H228-H230 AromaticContact NE2-NE2 3.76Å
229	V	63.8	Low	65	Low	49 Å²	49	67 Å²	67	30%	0.297	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.4	-173.3	-174.8	0	0	0	0	108.7	S221 F222 V227	S221-V229 CarbonylContact C-O 3.57Å; S221-V229 WeakPolarHBondContact CA-O 3.34Å; F222-V229 WeakPolarHBondContact CD1-O 3.49Å; F222-V229 HydrophobicContact CE1-CB 4.05Å; F222-V229 HydrophobicContact CE1-CG1 3.93Å; F222-V229 HydrophobicContact CE2-CB 4.13Å; F222-V229 HydrophobicContact CE2-CG1 4.45Å; F222-V229 HydrophobicContact CZ-CB 3.83Å; F222-V229 HydrophobicContact CZ-CG1 3.71Å; F222-V229 PolarHBondContact N-O 3Å; F222-V229 PolarHBondContact O-N 2.8Å; V227-V229 HydrophobicContact CB-CG2 4.33Å; V227-V229 HydrophobicContact CG1-CG2 3.89Å
230	H	70.2	Confident	65.1	Low	13 Å²	13	66.9 Å²	66.9	6%	0.06	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.1	166.9	-75.8	-97.9	0	0	0	110	S85 D87 H215 G219 H228 L232 L318	S85-H230 PolarHBondContact OG-CE1 3.14Å; S85-H230 PolarHBondContact OG-ND1 2.61Å; D87-H230 IonicContact OD2-CE1 3.88Å; D87-H230 PolarHBondContact OD2-CE1 3.24Å; D87-H230 IonicContact OD2-NE2 3.32Å; D87-H230 PolarHBondContact OD2-NE2 3.14Å; D87-H230 VanDerWaalsContact OD2-NE2 3.11Å; H215-H230 AromaticContact CD2-NE2 3.56Å; H215-H230 AromaticContact NE2-CE1 3.66Å; H215-H230 AromaticContact NE2-NE2 2.91Å; H215-H230 PolarHBondContact NE2-NE2 3.08Å; G219-H230 PolarHBondContact O-ND1 3.32Å; G219-H230 VanDerWaalsContact O-ND1 3.1Å; H228-H230 AromaticContact CE1-CD2 3.48Å; H228-H230 PolarHBondContact CE1-CD2 2.82Å; H228-H230 VanDerWaalsContact CE1-CD2 3.48Å; H228-H230 AromaticContact CE1-NE2 3.11Å; H228-H230 PolarHBondContact CE1-NE2 2.77Å; H228-H230 AromaticContact NE2-NE2 3.76Å; H230-L232 VanDerWaalsContact C-N 3.34Å; H230-L232 HydrophobicContact CB-CD2 4.39Å; H230-L232 HydrophobicContact CB-CG 4.46Å; H230-L232 PolarHBondContact O-N 3.06Å; H230-L318 HydrophobicContact CB-CD1 4.11Å; H230-L318 HydrophobicContact CB-CD2 3.94Å; H230-L318 WeakPolarHBondContact CD2-CD2 3.42Å
231	D	64.3	Low	65.9	Low	28 Å²	28	66.9 Å²	66.9	15%	0.15	36%	0.364	C	S	.	.			trans	-76.1	90	170.4	-173.2	5.9	0	0	0	110.2	G219 K220 F222 Q233	G219-D231 WeakPolarHBondContact CA-O 3.35Å; K220-D231 PolarHBondContact O-N 2.9Å; K220-D231 VanDerWaalsContact O-N 3.12Å; F222-D231 HydrophobicContact CD1-CB 4.47Å; F222-D231 HydrophobicContact CE1-CB 3.98Å; D231-Q233 VanDerWaalsContact C-N 3.3Å; D231-Q233 WeakPolarHBondContact OD1-CB 3.49Å; D231-Q233 VanDerWaalsContact OD1-CG 3.3Å; D231-Q233 WeakPolarHBondContact OD1-CG 3.36Å; D231-Q233 PolarHBondContact OD1-N 2.79Å
232	L	67.5	Low	66.8	Low	22 Å²	22	66.6 Å²	66.6	12%	0.115	36%	0.363	C	S	.	.			trans	-84.2	-2.5	171.7	-63.6	-170	0	0	0	113.1	P218 H230 S234 F235 L237 I240 L318 P319	P218-L232 HydrophobicContact CB-CD2 3.95Å; P218-L232 HydrophobicContact CG-CD2 3.65Å; P218-L232 WeakPolarHBondContact O-CD2 3.48Å; H230-L232 VanDerWaalsContact C-N 3.34Å; H230-L232 HydrophobicContact CB-CD2 4.39Å; H230-L232 HydrophobicContact CB-CG 4.46Å; H230-L232 PolarHBondContact O-N 3.06Å; L232-S234 PolarHBondContact O-N 2.75Å; L232-S234 VanDerWaalsContact O-N 3.14Å; L232-F235 CarbonylContact O-C 3.57Å; L232-F235 WeakPolarHBondContact O-CA 3.06Å; L232-F235 PolarHBondContact O-N 2.59Å; L232-L237 HydrophobicContact CB-CD2 4.15Å; L232-L237 HydrophobicContact CD1-CD2 3.6Å; L232-I240 HydrophobicContact CD2-CD1 4.45Å; L232-L318 HydrophobicContact CD1-CD1 3.34Å; L232-L318 HydrophobicContact CD1-CG 4.36Å; L232-L318 HydrophobicContact CD2-CD1 4.38Å; L232-L318 HydrophobicContact CG-CD1 3.85Å; L232-P319 HydrophobicContact CD1-CG 3.93Å
233	Q	60.6	Low	68.1	Low	134 Å²	134	65.5 Å²	65.5	63%	0.626	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.8	-169.5	-57.5	-179.5	11.3	0	0	112.7	D231 F235	D231-Q233 VanDerWaalsContact C-N 3.3Å; D231-Q233 WeakPolarHBondContact OD1-CB 3.49Å; D231-Q233 VanDerWaalsContact OD1-CG 3.3Å; D231-Q233 WeakPolarHBondContact OD1-CG 3.36Å; D231-Q233 PolarHBondContact OD1-N 2.79Å; Q233-F235 PolarHBondContact O-N 2.88Å
234	S	57.5	Low	69.6	Low	51 Å²	51	60.4 Å²	60.4	36%	0.357	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-14.4	171.7	-58.9	0	0	0	0	113.1	L232	L232-S234 PolarHBondContact O-N 2.75Å; L232-S234 VanDerWaalsContact O-N 3.14Å
235	F	59.4	Low	71.2	Confident	32 Å²	32	59 Å²	59	14%	0.14	33%	0.326	C	S	.	.	S	Bend	trans	-110.1	127.7	179.2	-56.1	-94.6	0	0	0	110.3	M79 Y83 P218 L232 Q233 L237 I240	M79-F235 HydrophobicContact CE-CE1 4.47Å; Y83-F235 VanDerWaalsContact CB-CZ 3.45Å; Y83-F235 AromaticContact CD1-CE1 3.6Å; Y83-F235 HydrophobicContact CD1-CE1 3.6Å; Y83-F235 AromaticContact CD1-CE2 3.86Å; Y83-F235 HydrophobicContact CD1-CE2 3.86Å; Y83-F235 AromaticContact CD1-CZ 3.03Å; Y83-F235 HydrophobicContact CD1-CZ 3.03Å; Y83-F235 AromaticContact CD2-CE1 3.88Å; Y83-F235 HydrophobicContact CD2-CE1 3.88Å; Y83-F235 HydrophobicContact CD2-CZ 4.13Å; Y83-F235 HydrophobicContact CE1-CE1 4.04Å; Y83-F235 HydrophobicContact CE1-CE2 4.35Å; Y83-F235 AromaticContact CE1-CZ 3.72Å; Y83-F235 HydrophobicContact CE1-CZ 3.72Å; Y83-F235 HydrophobicContact CE2-CE1 4.34Å; Y83-F235 AromaticContact CG-CE1 3.47Å; Y83-F235 HydrophobicContact CG-CE1 3.47Å; Y83-F235 VanDerWaalsContact CG-CE1 3.47Å; Y83-F235 HydrophobicContact CG-CE2 4.44Å; Y83-F235 AromaticContact CG-CZ 3.26Å; Y83-F235 HydrophobicContact CG-CZ 3.26Å; P218-F235 HydrophobicContact CB-CD2 4.46Å; P218-F235 HydrophobicContact CB-CE1 4.4Å; P218-F235 HydrophobicContact CB-CE2 4.11Å; P218-F235 HydrophobicContact CB-CZ 4.02Å; L232-F235 CarbonylContact O-C 3.57Å; L232-F235 WeakPolarHBondContact O-CA 3.06Å; L232-F235 PolarHBondContact O-N 2.59Å; Q233-F235 PolarHBondContact O-N 2.88Å; F235-L237 PolarHBondContact O-N 2.91Å; F235-L237 VanDerWaalsContact O-N 3.08Å; F235-I240 HydrophobicContact CB-CD1 4.05Å; F235-I240 HydrophobicContact CB-CG1 4.19Å
236	G	56.8	Low	72.8	Confident	48 Å²	48	54.1 Å²	54.1	50%	0.495	29%	0.291	S	S	.	.			trans	-61.3	114.2	155.5	0	0	0	0	0	107.8	D238 N239	G236-D238 PolarHBondContact O-N 2.76Å; G236-N239 PolarHBondContact O-N 3.06Å
237	L	55.9	Low	74.3	Confident	60 Å²	60	48.9 Å²	48.9	31%	0.314	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-49.5	-29.8	-179.7	-66.1	173	0	0	0	112.1	L232 F235 N239 I240 S273	L232-L237 HydrophobicContact CB-CD2 4.15Å; L232-L237 HydrophobicContact CD1-CD2 3.6Å; F235-L237 PolarHBondContact O-N 2.91Å; F235-L237 VanDerWaalsContact O-N 3.08Å; L237-N239 PolarHBondContact O-N 2.81Å; L237-N239 VanDerWaalsContact O-N 3.09Å; L237-I240 HydrophobicContact CD2-CD1 4.16Å; L237-S273 PolarHBondContact O-OG 3.06Å
238	D	59.1	Low	75.9	Confident	132 Å²	132	47.1 Å²	47.1	71%	0.706	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-66.4	-9.8	-178.2	-56.4	-29.9	0	0	0	114.8	G236 A272	G236-D238 PolarHBondContact O-N 2.76Å; D238-A272 WeakPolarHBondContact O-CB 3.29Å
239	N	72.5	Confident	77.3	Confident	140 Å²	140	45 Å²	45	75%	0.749	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-118.6	7.9	-174.8	-65.7	-42.1	0	0	0	114.7	G236 L237 N241	G236-N239 PolarHBondContact O-N 3.06Å; L237-N239 PolarHBondContact O-N 2.81Å; L237-N239 VanDerWaalsContact O-N 3.09Å; N239-N241 PolarHBondContact O-N 3.13Å
240	I	81.4	Confident	78.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.229	C	C	.	.			trans	-81.4	116.4	-178.3	-62.5	170.9	0	0	0	109.8	P218 L232 F235 L237 M242 A272 S273 P319	P218-I240 HydrophobicContact CB-CD1 4.48Å; P218-I240 HydrophobicContact CG-CD1 3.86Å; P218-I240 HydrophobicContact CG-CG1 4.4Å; P218-I240 HydrophobicContact CG-CG2 3.75Å; L232-I240 HydrophobicContact CD2-CD1 4.45Å; F235-I240 HydrophobicContact CB-CD1 4.05Å; F235-I240 HydrophobicContact CB-CG1 4.19Å; L237-I240 HydrophobicContact CD2-CD1 4.16Å; I240-M242 HydrophobicContact CG2-CG 3.94Å; I240-M242 HydrophobicContact CG2-SD 3.86Å; I240-A272 CarbonylContact O-C 3.59Å; I240-A272 WeakPolarHBondContact O-CA 3.49Å; I240-S273 PolarHBondContact O-N 3.21Å; I240-P319 HydrophobicContact CD1-CG 3.86Å; I240-P319 HydrophobicContact CG2-CB 4.13Å; I240-P319 HydrophobicContact CG2-CG 4.36Å
241	N	88.2	Confident	80	Confident	48 Å²	48	42.1 Å²	42.1	26%	0.257	23%	0.227	S	C	.	.			trans	-113.3	103.9	177.1	-173	-16.7	0	0	0	110.8	H78 N239 T243	H78-N241 HydrophobicContact CB-CB 3.91Å; H78-N241 PolarHBondContact CD2-ND2 2.46Å; H78-N241 VanDerWaalsContact CD2-ND2 3.28Å; N239-N241 PolarHBondContact O-N 3.13Å; N241-T243 VanDerWaalsContact C-N 3.28Å; N241-T243 PolarHBondContact O-N 3.16Å; N241-T243 VanDerWaalsContact OD1-CB 3.25Å; N241-T243 WeakPolarHBondContact OD1-CB 3.1Å; N241-T243 PolarHBondContact OD1-N 3.28Å; N241-T243 PolarHBondContact OD1-OG1 3.07Å
242	M	90.9	Very high	81.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.224	C	C	.	.			trans	-92.3	29.6	179.5	-60.4	-52.7	-64.2	0	0	113.1	F76 M79 L84 P218 I240 H244 F276 V321	F76-M242 HydrophobicContact CD1-CE 4.08Å; F76-M242 HydrophobicContact CE1-CE 3.8Å; M79-M242 HydrophobicContact SD-SD 3.79Å; L84-M242 HydrophobicContact CD1-CE 4.23Å; P218-M242 HydrophobicContact CG-SD 4.41Å; I240-M242 HydrophobicContact CG2-CG 3.94Å; I240-M242 HydrophobicContact CG2-SD 3.86Å; M242-H244 PolarHBondContact O-N 3.46Å; M242-H244 PolarHBondContact O-ND1 2.89Å; M242-F276 HydrophobicContact CB-CD2 4.23Å; M242-F276 HydrophobicContact CB-CE2 4.07Å; M242-F276 WeakPolarHBondContact O-CE2 3.48Å; M242-V321 HydrophobicContact CE-CG2 4.45Å
243	T	94	Very high	82.6	Confident	8 Å²	8	45.7 Å²	45.7	5%	0.049	24%	0.244	C	C	.	.			trans	-57	130.4	167.7	-67	0	0	0	0	108.9	P77 N241 V267 T268 A269	P77-T243 VanDerWaalsContact CD-O 3.29Å; P77-T243 WeakPolarHBondContact CD-O 3.01Å; N241-T243 VanDerWaalsContact C-N 3.28Å; N241-T243 PolarHBondContact O-N 3.16Å; N241-T243 VanDerWaalsContact OD1-CB 3.25Å; N241-T243 WeakPolarHBondContact OD1-CB 3.1Å; N241-T243 PolarHBondContact OD1-N 3.28Å; N241-T243 PolarHBondContact OD1-OG1 3.07Å; T243-V267 WeakPolarHBondContact CA-O 3.29Å; T243-T268 HydrophobicContact CG2-CG2 4.37Å; T243-A269 PolarHBondContact OG1-N 3.16Å
244	H	96	Very high	84	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154	-175	61.9	-78.1	0	0	0	112.1	V74 L75 F76 M242 V267 F276 Y278 V321	V74-H244 HydrophobicContact CG1-CB 4.17Å; L75-H244 CarbonylContact O-C 3.6Å; L75-H244 WeakPolarHBondContact O-CA 3.43Å; F76-H244 HydrophobicContact CD1-CB 3.77Å; F76-H244 HydrophobicContact CE1-CB 3.68Å; F76-H244 HydrophobicContact CG-CB 4.45Å; F76-H244 HydrophobicContact CZ-CB 4.29Å; M242-H244 PolarHBondContact O-N 3.46Å; M242-H244 PolarHBondContact O-ND1 2.89Å; H244-V267 PolarHBondContact N-O 2.9Å; H244-V267 PolarHBondContact O-N 3.04Å; H244-F276 AromaticContact CE1-CD2 3.75Å; H244-F276 AromaticContact CE1-CG 3.73Å; H244-Y278 AromaticContact NE2-CE2 3.54Å; H244-Y278 AromaticContact NE2-CZ 3.58Å; H244-Y278 PolarHBondContact NE2-OH 3.26Å; H244-V321 WeakPolarHBondContact ND1-CG2 3.34Å
245	Y	97	Very high	85.6	Confident	62 Å²	62	42.1 Å²	42.1	24%	0.243	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	114.4	174.6	173.5	-118.4	0	0	0	108.8	V74 L75 Q247 H264 T265 N266	V74-Y245 WeakPolarHBondContact CA-O 3.31Å; L75-Y245 HydrophobicContact CB-CD1 4.35Å; L75-Y245 HydrophobicContact CD2-CD1 4.15Å; L75-Y245 PolarHBondContact N-O 2.86Å; L75-Y245 PolarHBondContact O-N 2.95Å; Y245-Q247 HydrophobicContact CD1-CG 3.67Å; Y245-Q247 HydrophobicContact CE1-CB 4.48Å; Y245-Q247 HydrophobicContact CE1-CG 3.38Å; Y245-Q247 PolarHBondContact O-N 3.07Å; Y245-H264 HydrophobicContact CE2-CB 4.37Å; Y245-H264 PolarHBondContact OH-ND1 2.87Å; Y245-H264 VanDerWaalsContact OH-ND1 3.13Å; Y245-T265 WeakPolarHBondContact CA-O 3.29Å; Y245-T265 WeakPolarHBondContact CD2-O 3.44Å; Y245-N266 HydrophobicContact CD2-CB 3.8Å; Y245-N266 HydrophobicContact CE2-CB 4.4Å
246	I	97.3	Very high	87	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	106.3	177	-55	175.9	0	0	0	106.5	V74 L249 L262 H264 T265 Y278	V74-I246 HydrophobicContact CG1-CG1 4.33Å; V74-I246 HydrophobicContact CG2-CG1 4.33Å; V74-I246 HydrophobicContact CG2-CG2 4.35Å; I246-L249 HydrophobicContact CG2-CB 3.91Å; I246-L262 WeakPolarHBondContact CB-O 3.39Å; I246-L262 HydrophobicContact CD1-CB 4.29Å; I246-L262 HydrophobicContact CD1-CD1 4.32Å; I246-L262 HydrophobicContact CD1-CD2 4.29Å; I246-L262 HydrophobicContact CG2-CB 4.26Å; I246-L262 WeakPolarHBondContact CG2-O 3.36Å; I246-H264 CarbonylContact O-C 3.47Å; I246-H264 WeakPolarHBondContact O-CA 3.2Å; I246-H264 PolarHBondContact O-N 3.36Å; I246-T265 PolarHBondContact N-O 3.48Å; I246-T265 PolarHBondContact O-N 3.25Å; I246-Y278 HydrophobicContact CD1-CE2 4.1Å
247	Q	96.8	Very high	88.4	Confident	59 Å²	59	46 Å²	46	28%	0.276	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-51.6	174.7	-77.5	-172.5	90.4	0	0	109.9	D73 Y245 H264	D73-Q247 HydrophobicContact CB-CB 3.98Å; D73-Q247 WeakPolarHBondContact O-CB 3.49Å; D73-Q247 PolarHBondContact O-N 3.2Å; D73-Q247 PolarHBondContact OD1-NE2 2.9Å; Y245-Q247 HydrophobicContact CD1-CG 3.67Å; Y245-Q247 HydrophobicContact CE1-CB 4.48Å; Y245-Q247 HydrophobicContact CE1-CG 3.38Å; Y245-Q247 PolarHBondContact O-N 3.07Å; Q247-H264 PolarHBondContact O-N 2.99Å; Q247-H264 VanDerWaalsContact O-N 3.16Å
248	H	96.9	Very high	90.1	Very high	48 Å²	48	44.5 Å²	44.5	22%	0.222	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	134.4	-179.8	-176.9	70.3	0	0	0	110.8	D73 S250 D254 N260 D263	D73-H248 HydrophobicContact CB-CB 4.19Å; D73-H248 PolarHBondContact N-O 3.31Å; D73-H248 PolarHBondContact O-N 3.25Å; H248-S250 WeakPolarHBondContact NE2-CB 3.48Å; H248-S250 PolarHBondContact NE2-OG 3.42Å; H248-D254 IonicContact CE1-OD2 3.34Å; H248-D254 PolarHBondContact CE1-OD2 2.94Å; H248-D254 IonicContact NE2-OD2 3.9Å; H248-N260 PolarHBondContact CE1-ND2 2.7Å; H248-D263 VanDerWaalsContact CA-OD1 3.31Å; H248-D263 WeakPolarHBondContact CA-OD1 3.28Å; H248-D263 IonicContact CE1-OD2 3.24Å; H248-D263 IonicContact CG-OD1 2.68Å; H248-D263 IonicContact ND1-OD1 3.78Å; H248-D263 PolarHBondContact ND1-OD1 3.35Å; H248-D263 IonicContact ND1-OD2 3.13Å; H248-D263 PolarHBondContact ND1-OD2 2.93Å
249	L	96.8	Very high	91.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	115.6	169.2	-178.6	72	0	0	0	109.6	I70 N71 I72 F214 I246 F251 N260 L262 D263 F300 V323	I70-L249 HydrophobicContact CG2-CD1 4Å; N71-L249 WeakPolarHBondContact O-CA 3.24Å; I72-L249 HydrophobicContact CG1-CD1 3.97Å; F214-L249 HydrophobicContact CZ-CD1 3.77Å; F214-L249 HydrophobicContact CZ-CD2 4.49Å; I246-L249 HydrophobicContact CG2-CB 3.91Å; L249-F251 HydrophobicContact CG-CE2 4.47Å; L249-N260 WeakPolarHBondContact O-CB 3.48Å; L249-L262 HydrophobicContact CB-CB 4.42Å; L249-L262 HydrophobicContact CD2-CB 4.42Å; L249-L262 HydrophobicContact CD2-CD1 3.54Å; L249-D263 PolarHBondContact N-OD1 3.35Å; L249-F300 VanDerWaalsContact O-CE1 3.31Å; L249-F300 WeakPolarHBondContact O-CE1 3.46Å; L249-F300 WeakPolarHBondContact O-CZ 3.15Å; L249-V323 HydrophobicContact CD2-CG1 4.48Å
250	S	96.3	Very high	92.8	Very high	1 Å²	1	38 Å²	38	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159.6	-179.4	62.5	0	0	0	0	112.3	I70 N71 H248	I70-S250 CarbonylContact C-O 3.54Å; I70-S250 WeakPolarHBondContact CA-O 3.45Å; N71-S250 WeakPolarHBondContact CB-OG 3.25Å; N71-S250 PolarHBondContact N-O 2.93Å; N71-S250 PolarHBondContact ND2-OG 3.48Å; N71-S250 PolarHBondContact O-N 3.39Å; N71-S250 VanDerWaalsContact O-N 3.11Å; H248-S250 WeakPolarHBondContact NE2-CB 3.48Å; H248-S250 PolarHBondContact NE2-OG 3.42Å
251	F	95.3	Very high	93.4	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	100.9	-178.4	-68.1	-93.8	0	0	0	108.9	L68 K69 I70 L249 V280 V282 N298 F300 Y325	L68-F251 HydrophobicContact CD1-CB 4.28Å; L68-F251 HydrophobicContact CD2-CD1 3.94Å; L68-F251 HydrophobicContact CG-CD1 4.39Å; K69-F251 CarbonylContact O-C 3.49Å; I70-F251 HydrophobicContact CD1-CD1 4.31Å; I70-F251 HydrophobicContact CD1-CE1 3.91Å; I70-F251 HydrophobicContact CG1-CD1 3.85Å; I70-F251 HydrophobicContact CG1-CE1 3.92Å; I70-F251 HydrophobicContact CG2-CD1 4.32Å; I70-F251 HydrophobicContact CG2-CE1 4.08Å; I70-F251 HydrophobicContact CG2-CZ 4.45Å; L249-F251 HydrophobicContact CG-CE2 4.47Å; F251-V280 HydrophobicContact CE2-CG1 3.67Å; F251-V280 HydrophobicContact CZ-CB 4.47Å; F251-V280 HydrophobicContact CZ-CG1 3.76Å; F251-V282 HydrophobicContact CB-CG1 4.23Å; F251-V282 HydrophobicContact CD1-CG2 3.84Å; F251-V282 HydrophobicContact CD2-CG2 4.24Å; F251-V282 HydrophobicContact CE1-CG2 3.86Å; F251-V282 HydrophobicContact CE2-CG2 4.28Å; F251-V282 HydrophobicContact CG-CG1 4.36Å; F251-V282 HydrophobicContact CG-CG2 4.03Å; F251-V282 HydrophobicContact CZ-CG2 4.09Å; F251-N298 HydrophobicContact CB-CB 3.9Å; F251-N298 VanDerWaalsContact O-CB 3.25Å; F251-N298 WeakPolarHBondContact O-CB 3.36Å; F251-N298 PolarHBondContact O-N 3.23Å; F251-N298 VanDerWaalsContact O-N 3.09Å; F251-N298 PolarHBondContact O-ND2 3.02Å; F251-F300 HydrophobicContact CD2-CB 4.41Å; F251-F300 AromaticContact CD2-CD1 3.58Å; F251-F300 HydrophobicContact CD2-CD1 3.58Å; F251-F300 AromaticContact CD2-CE1 3.96Å; F251-F300 HydrophobicContact CD2-CE1 3.96Å; F251-F300 HydrophobicContact CD2-CG 4.06Å; F251-F300 AromaticContact CE2-CD1 3.92Å; F251-F300 HydrophobicContact CE2-CD1 3.92Å; F251-F300 HydrophobicContact CE2-CD2 4.44Å; F251-F300 HydrophobicContact CE2-CE1 4.14Å; F251-F300 HydrophobicContact CE2-CG 4.07Å; F251-F300 HydrophobicContact CE2-CZ 4.46Å; F251-Y325 HydrophobicContact CE1-CG 4.21Å
252	G	92.9	Very high	93.8	Very high	9 Å²	9	38.8 Å²	38.8	9%	0.093	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96	-153.3	-175.1	0	0	0	0	0	112.6	K69 N71	K69-G252 PolarHBondContact O-N 2.96Å; N71-G252 PolarHBondContact ND2-O 3.24Å
253	E	92.3	Very high	94.1	Very high	116 Å²	116	40.8 Å²	40.8	54%	0.542	24%	0.237	S	C	.	.			trans	-95	142.2	178.3	-66	-174.3	158.1	0	0	111	L295 T297	E253-L295 HydrophobicContact CB-CD1 3.84Å; E253-L295 HydrophobicContact CG-CD1 4.49Å; E253-L295 WeakPolarHBondContact OE2-CD1 3.17Å; E253-T297 WeakPolarHBondContact O-CB 3.32Å; E253-T297 PolarHBondContact O-OG1 3.19Å
254	D	91.8	Very high	94.2	Very high	81 Å²	81	46.7 Å²	46.7	43%	0.433	26%	0.264	S	S	.	.			trans	-69.7	151	178.3	-74.1	-19.5	0	0	0	112.3	H248 I258	H248-D254 IonicContact CE1-OD2 3.34Å; H248-D254 PolarHBondContact CE1-OD2 2.94Å; H248-D254 IonicContact NE2-OD2 3.9Å; D254-I258 HydrophobicContact CB-CG2 4.07Å
255	Y	90.3	Very high	94.2	Very high	29 Å²	29	48.4 Å²	48.4	11%	0.114	27%	0.274	C	S	.	.			trans	-128.7	156.7	174.7	63.7	-89.3	0	0	0	111.1	G257 I258 T285 Y287 T297 L334	Y255-G257 PolarHBondContact O-N 3.23Å; Y255-G257 VanDerWaalsContact O-N 3.16Å; Y255-I258 HydrophobicContact CD1-CB 3.95Å; Y255-I258 HydrophobicContact CD1-CD1 3.89Å; Y255-I258 HydrophobicContact CD1-CG1 4.22Å; Y255-I258 HydrophobicContact CD2-CB 4.22Å; Y255-I258 HydrophobicContact CE1-CB 3.75Å; Y255-I258 HydrophobicContact CE1-CD1 3.46Å; Y255-I258 VanDerWaalsContact CE1-CD1 3.46Å; Y255-I258 HydrophobicContact CE1-CG1 3.62Å; Y255-I258 HydrophobicContact CE2-CB 3.98Å; Y255-I258 HydrophobicContact CG-CB 4.22Å; Y255-I258 WeakPolarHBondContact O-CB 3.49Å; Y255-I258 VanDerWaalsContact O-CG2 3.24Å; Y255-I258 WeakPolarHBondContact O-CG2 3.47Å; Y255-I258 PolarHBondContact O-N 2.92Å; Y255-I258 VanDerWaalsContact O-N 3.07Å; Y255-T285 HydrophobicContact CE1-CG2 4.37Å; Y255-Y287 AromaticContact CD2-CD2 3.53Å; Y255-Y287 HydrophobicContact CD2-CD2 3.53Å; Y255-Y287 AromaticContact CD2-CE2 3.65Å; Y255-Y287 HydrophobicContact CD2-CE2 3.65Å; Y255-Y287 HydrophobicContact CD2-CG 4.39Å; Y255-Y287 HydrophobicContact CE2-CD2 4.26Å; Y255-Y287 HydrophobicContact CE2-CE2 4.41Å; Y255-Y287 AromaticContact CG-CD2 3.88Å; Y255-Y287 HydrophobicContact CG-CD2 3.88Å; Y255-Y287 HydrophobicContact CG-CE2 4.33Å; Y255-Y287 HydrophobicContact CG-CG 4.32Å; Y255-T297 HydrophobicContact CD1-CG2 3.31Å; Y255-T297 HydrophobicContact CE1-CG2 3.67Å; Y255-T297 HydrophobicContact CG-CG2 4.24Å; Y255-L334 HydrophobicContact CD2-CD1 4.16Å; Y255-L334 HydrophobicContact CE2-CD1 3.49Å; Y255-L334 VanDerWaalsContact CE2-CD1 3.49Å
256	P	87.9	Confident	94.1	Very high	85 Å²	85	50.5 Å²	50.5	55%	0.552	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	122.9	-178.1	-26.6	35.4	0	0	0	112.7
257	G	86.6	Confident	94.1	Very high	76 Å²	76	50.3 Å²	50.3	78%	0.784	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	4.1	178.5	0	0	0	0	0	115.6	Y255	Y255-G257 PolarHBondContact O-N 3.23Å; Y255-G257 VanDerWaalsContact O-N 3.16Å
258	I	91.4	Very high	93.9	Very high	30 Å²	30	52 Å²	52	15%	0.154	30%	0.303	C	S	.	.			trans	-62	138.2	168.6	-163.1	178.4	0	0	0	110.1	D254 Y255	D254-I258 HydrophobicContact CB-CG2 4.07Å; Y255-I258 HydrophobicContact CD1-CB 3.95Å; Y255-I258 HydrophobicContact CD1-CD1 3.89Å; Y255-I258 HydrophobicContact CD1-CG1 4.22Å; Y255-I258 HydrophobicContact CD2-CB 4.22Å; Y255-I258 HydrophobicContact CE1-CB 3.75Å; Y255-I258 HydrophobicContact CE1-CD1 3.46Å; Y255-I258 VanDerWaalsContact CE1-CD1 3.46Å; Y255-I258 HydrophobicContact CE1-CG1 3.62Å; Y255-I258 HydrophobicContact CE2-CB 3.98Å; Y255-I258 HydrophobicContact CG-CB 4.22Å; Y255-I258 WeakPolarHBondContact O-CB 3.49Å; Y255-I258 VanDerWaalsContact O-CG2 3.24Å; Y255-I258 WeakPolarHBondContact O-CG2 3.47Å; Y255-I258 PolarHBondContact O-N 2.92Å; Y255-I258 VanDerWaalsContact O-N 3.07Å
259	V	92.8	Very high	93.6	Very high	126 Å²	126	50.2 Å²	50.2	76%	0.764	30%	0.297	S	S	*	.			trans	-127.2	110.7	172.2	-179.8	0	0	0	0	107	P261	V259-P261 WeakPolarHBondContact O-CD 3.31Å
260	N	95.4	Very high	93.2	Very high	8 Å²	8	55 Å²	55	4%	0.043	33%	0.328	C	S	.	.			trans	-83.2	122.9	178.4	-62.3	-52.7	0	0	0	109.4	H248 L249 L262 D263 F300	H248-N260 PolarHBondContact CE1-ND2 2.7Å; L249-N260 WeakPolarHBondContact O-CB 3.48Å; N260-L262 PolarHBondContact O-N 3.44Å; N260-D263 HydrophobicContact CB-CB 4.4Å; N260-D263 WeakPolarHBondContact CB-OD1 3.43Å; N260-D263 WeakPolarHBondContact CB-OD2 3.34Å; N260-D263 PolarHBondContact ND2-OD2 3.47Å; N260-D263 PolarHBondContact O-N 3.5Å; N260-F300 HydrophobicContact CB-CE1 3.87Å; N260-F300 HydrophobicContact CB-CZ 4.13Å
261	P	95.7	Very high	92.7	Very high	59 Å²	59	60.4 Å²	60.4	38%	0.383	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.4	-173.6	-29.2	34.9	0	0	0	116.8	V259 F300 V302	V259-P261 WeakPolarHBondContact O-CD 3.31Å; P261-F300 HydrophobicContact CB-CE2 4.21Å; P261-F300 HydrophobicContact CG-CD2 4.25Å; P261-F300 HydrophobicContact CG-CE2 4.1Å; P261-F300 HydrophobicContact CG-CZ 4.5Å; P261-F300 VanDerWaalsContact CG-O 3.29Å; P261-F300 WeakPolarHBondContact CG-O 3.46Å; P261-V302 HydrophobicContact CB-CG1 3.7Å
262	L	95.9	Very high	92.1	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.037	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-4.9	-177.6	-72.7	176.9	0	0	0	113.8	I246 L249 N260 H264 T265 Y278 F300 V302	I246-L262 WeakPolarHBondContact CB-O 3.39Å; I246-L262 HydrophobicContact CD1-CB 4.29Å; I246-L262 HydrophobicContact CD1-CD1 4.32Å; I246-L262 HydrophobicContact CD1-CD2 4.29Å; I246-L262 HydrophobicContact CG2-CB 4.26Å; I246-L262 WeakPolarHBondContact CG2-O 3.36Å; L249-L262 HydrophobicContact CB-CB 4.42Å; L249-L262 HydrophobicContact CD2-CB 4.42Å; L249-L262 HydrophobicContact CD2-CD1 3.54Å; N260-L262 PolarHBondContact O-N 3.44Å; L262-H264 PolarHBondContact O-N 3.2Å; L262-T265 WeakPolarHBondContact CA-OG1 3.46Å; L262-T265 VanDerWaalsContact O-CB 3.27Å; L262-T265 WeakPolarHBondContact O-CB 3.42Å; L262-T265 PolarHBondContact O-N 2.79Å; L262-T265 PolarHBondContact O-OG1 2.86Å; L262-Y278 HydrophobicContact CD1-CD1 4.14Å; L262-Y278 HydrophobicContact CD1-CG 4.26Å; L262-Y278 HydrophobicContact CD2-CD1 3.8Å; L262-Y278 HydrophobicContact CD2-CE1 3.75Å; L262-F300 HydrophobicContact CB-CE2 4.49Å; L262-F300 HydrophobicContact CB-CZ 4.37Å; L262-F300 HydrophobicContact CD1-CE2 4.21Å; L262-F300 HydrophobicContact CG-CE2 4.18Å; L262-V302 HydrophobicContact CD1-CG2 3.97Å; L262-V302 HydrophobicContact CD2-CG1 4.07Å; L262-V302 HydrophobicContact CD2-CG2 4.14Å; L262-V302 HydrophobicContact CG-CB 4.39Å; L262-V302 HydrophobicContact CG-CG1 4.12Å; L262-V302 HydrophobicContact CG-CG2 4.17Å
263	D	96.3	Very high	91.7	Very high	43 Å²	43	62.2 Å²	62.2	23%	0.23	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	137.9	177.9	-73.8	6.9	0	0	0	110.3	H248 L249 N260 T265	H248-D263 VanDerWaalsContact CA-OD1 3.31Å; H248-D263 WeakPolarHBondContact CA-OD1 3.28Å; H248-D263 IonicContact CE1-OD2 3.24Å; H248-D263 IonicContact CG-OD1 2.68Å; H248-D263 IonicContact ND1-OD1 3.78Å; H248-D263 PolarHBondContact ND1-OD1 3.35Å; H248-D263 IonicContact ND1-OD2 3.13Å; H248-D263 PolarHBondContact ND1-OD2 2.93Å; L249-D263 PolarHBondContact N-OD1 3.35Å; N260-D263 HydrophobicContact CB-CB 4.4Å; N260-D263 WeakPolarHBondContact CB-OD1 3.43Å; N260-D263 WeakPolarHBondContact CB-OD2 3.34Å; N260-D263 PolarHBondContact ND2-OD2 3.47Å; N260-D263 PolarHBondContact O-N 3.5Å; D263-T265 VanDerWaalsContact C-N 3.25Å; D263-T265 PolarHBondContact O-N 2.97Å
264	H	96.7	Very high	91.5	Very high	132 Å²	132	57 Å²	57	61%	0.611	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	31.2	-176	-51	-60.8	0	0	0	115.5	Y245 I246 Q247 L262	Y245-H264 HydrophobicContact CE2-CB 4.37Å; Y245-H264 PolarHBondContact OH-ND1 2.87Å; Y245-H264 VanDerWaalsContact OH-ND1 3.13Å; I246-H264 CarbonylContact O-C 3.47Å; I246-H264 WeakPolarHBondContact O-CA 3.2Å; I246-H264 PolarHBondContact O-N 3.36Å; Q247-H264 PolarHBondContact O-N 2.99Å; Q247-H264 VanDerWaalsContact O-N 3.16Å; L262-H264 PolarHBondContact O-N 3.2Å
265	T	96	Very high	91.5	Very high	35 Å²	35	53.7 Å²	53.7	22%	0.215	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.8	178.5	-60.5	0	0	0	0	111.7	Y245 I246 L262 D263 V267	Y245-T265 WeakPolarHBondContact CA-O 3.29Å; Y245-T265 WeakPolarHBondContact CD2-O 3.44Å; I246-T265 PolarHBondContact N-O 3.48Å; I246-T265 PolarHBondContact O-N 3.25Å; L262-T265 WeakPolarHBondContact CA-OG1 3.46Å; L262-T265 VanDerWaalsContact O-CB 3.27Å; L262-T265 WeakPolarHBondContact O-CB 3.42Å; L262-T265 PolarHBondContact O-N 2.79Å; L262-T265 PolarHBondContact O-OG1 2.86Å; D263-T265 VanDerWaalsContact C-N 3.25Å; D263-T265 PolarHBondContact O-N 2.97Å; T265-V267 HydrophobicContact CG2-CG2 4.02Å
266	N	95.8	Very high	91.7	Very high	106 Å²	106	52.3 Å²	52.3	57%	0.567	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.5	176	-170.7	-4.1	0	0	0	111.4	Y245	Y245-N266 HydrophobicContact CD2-CB 3.8Å; Y245-N266 HydrophobicContact CE2-CB 4.4Å
267	V	95.3	Very high	92	Very high	2 Å²	2	50 Å²	50	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	113.5	179.4	-176.1	0	0	0	0	110.5	T243 H244 T265 F276 Y278	T243-V267 WeakPolarHBondContact CA-O 3.29Å; H244-V267 PolarHBondContact N-O 2.9Å; H244-V267 PolarHBondContact O-N 3.04Å; T265-V267 HydrophobicContact CG2-CG2 4.02Å; V267-F276 HydrophobicContact CG1-CD1 3.72Å; V267-F276 HydrophobicContact CG1-CE1 3.31Å; V267-F276 HydrophobicContact CG1-CZ 3.82Å; V267-Y278 VanDerWaalsContact CG2-OH 3.28Å; V267-Y278 WeakPolarHBondContact CG2-OH 3.34Å
268	T	93.6	Very high	92.5	Very high	95 Å²	95	46.5 Å²	46.5	58%	0.583	26%	0.264	S	S	*	.			trans	-92.1	134.2	174	-47.5	0	0	0	0	110.9	T243 P270	T243-T268 HydrophobicContact CG2-CG2 4.37Å; T268-P270 WeakPolarHBondContact O-CD 3.2Å
269	A	91	Very high	92.8	Very high	10 Å²	10	49.2 Å²	49.2	8%	0.083	28%	0.275	C	S	.	.			trans	-85.2	107.5	173	0	0	0	0	0	110.3	T243 Q271 M274 F276	T243-A269 PolarHBondContact OG1-N 3.16Å; A269-Q271 PolarHBondContact O-N 3.24Å; A269-M274 HydrophobicContact CB-CB 4.28Å; A269-M274 HydrophobicContact CB-SD 4.12Å; A269-F276 HydrophobicContact CB-CE2 4.05Å; A269-F276 HydrophobicContact CB-CZ 3.86Å
270	P	87.2	Confident	93	Very high	105 Å²	105	43.3 Å²	43.3	68%	0.682	24%	0.239	S	C	*	.	S	Bend	trans	-66.7	-21.3	176.1	25.1	-37.5	0	0	0	114	T268 M274	T268-P270 WeakPolarHBondContact O-CD 3.2Å; P270-M274 WeakPolarHBondContact CD-SD 3.34Å; P270-M274 HydrophobicContact CG-CE 4.22Å; P270-M274 HydrophobicContact CG-SD 3.61Å
271	Q	85.8	Confident	93.1	Very high	114 Å²	114	48.8 Å²	48.8	53%	0.533	26%	0.263	S	S	.	.	S	Bend	trans	-129.1	151.7	-178.5	-67.3	177.2	-26.5	0	0	109.7	A269 M274	A269-Q271 PolarHBondContact O-N 3.24Å; Q271-M274 HydrophobicContact CB-CG 4.18Å; Q271-M274 HydrophobicContact CB-SD 4.2Å; Q271-M274 WeakPolarHBondContact O-CG 3.35Å
272	A	83.5	Confident	93.1	Very high	41 Å²	41	46 Å²	46	34%	0.339	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	154.7	170.7	0	0	0	0	0	110.6	D238 I240 M274	D238-A272 WeakPolarHBondContact O-CB 3.29Å; I240-A272 CarbonylContact O-C 3.59Å; I240-A272 WeakPolarHBondContact O-CA 3.49Å; A272-M274 VanDerWaalsContact C-N 3.34Å; A272-M274 PolarHBondContact O-N 3.1Å
273	S	83.7	Confident	93.1	Very high	6 Å²	6	47 Å²	47	4%	0.042	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	39.3	-179.9	-78.5	0	0	0	0	114.5	L237 I240 A309	L237-S273 PolarHBondContact O-OG 3.06Å; I240-S273 PolarHBondContact O-N 3.21Å; S273-A309 WeakPolarHBondContact O-CA 3.25Å; S273-A309 VanDerWaalsContact O-CB 3.32Å; S273-A309 WeakPolarHBondContact O-CB 3.47Å; S273-A309 PolarHBondContact O-N 3.03Å
274	M	89	Confident	93	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.039	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	144.7	170.2	-73.6	-172.5	76.5	0	0	112.5	A269 P270 Q271 A272 F276 E306 G320	A269-M274 HydrophobicContact CB-CB 4.28Å; A269-M274 HydrophobicContact CB-SD 4.12Å; P270-M274 WeakPolarHBondContact CD-SD 3.34Å; P270-M274 HydrophobicContact CG-CE 4.22Å; P270-M274 HydrophobicContact CG-SD 3.61Å; Q271-M274 HydrophobicContact CB-CG 4.18Å; Q271-M274 HydrophobicContact CB-SD 4.2Å; Q271-M274 WeakPolarHBondContact O-CG 3.35Å; A272-M274 VanDerWaalsContact C-N 3.34Å; A272-M274 PolarHBondContact O-N 3.1Å; M274-F276 HydrophobicContact CB-CE2 3.92Å; M274-F276 HydrophobicContact CB-CZ 3.98Å; M274-F276 HydrophobicContact CE-CE1 4.23Å; M274-F276 HydrophobicContact CE-CZ 4.29Å; M274-F276 HydrophobicContact SD-CZ 4.36Å; M274-E306 HydrophobicContact CE-CB 4.2Å; M274-E306 HydrophobicContact CE-CG 4.38Å; M274-G320 PolarHBondContact O-N 2.93Å
275	M	91	Very high	92.9	Very high	11 Å²	11	38.9 Å²	38.9	5%	0.054	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.1	175.2	-176.5	179.8	112.2	0	0	108.7	Q277 E306 K307 A309 L318 G320 F322	M275-Q277 HydrophobicContact CE-CG 3.56Å; M275-Q277 VanDerWaalsContact CE-OE1 3.27Å; M275-Q277 HydrophobicContact CG-CG 4.43Å; M275-E306 WeakPolarHBondContact O-CA 3.48Å; M275-K307 HydrophobicContact CB-CG 4.02Å; M275-K307 HydrophobicContact CE-CD 3.69Å; M275-K307 HydrophobicContact CE-CG 3.88Å; M275-K307 PolarHBondContact N-O 2.92Å; M275-K307 PolarHBondContact O-N 2.68Å; M275-K307 HydrophobicContact SD-CD 4.32Å; M275-K307 VanDerWaalsContact SD-CE 3.52Å; M275-K307 HydrophobicContact SD-CG 4.24Å; M275-A309 HydrophobicContact CB-CB 4.31Å; M275-L318 VanDerWaalsContact CG-O 3.27Å; M275-L318 WeakPolarHBondContact CG-O 3.32Å; M275-G320 WeakPolarHBondContact CA-O 3.45Å; M275-F322 HydrophobicContact CG-CD2 3.82Å; M275-F322 HydrophobicContact CG-CE2 3.76Å; M275-F322 HydrophobicContact SD-CE2 4.32Å
276	F	94.8	Very high	92.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	129.1	177.5	-61	-79.2	0	0	0	109.3	M242 H244 V267 A269 M274 Y278 E306 G320 V321 F322	M242-F276 HydrophobicContact CB-CD2 4.23Å; M242-F276 HydrophobicContact CB-CE2 4.07Å; M242-F276 WeakPolarHBondContact O-CE2 3.48Å; H244-F276 AromaticContact CE1-CD2 3.75Å; H244-F276 AromaticContact CE1-CG 3.73Å; V267-F276 HydrophobicContact CG1-CD1 3.72Å; V267-F276 HydrophobicContact CG1-CE1 3.31Å; V267-F276 HydrophobicContact CG1-CZ 3.82Å; A269-F276 HydrophobicContact CB-CE2 4.05Å; A269-F276 HydrophobicContact CB-CZ 3.86Å; M274-F276 HydrophobicContact CB-CE2 3.92Å; M274-F276 HydrophobicContact CB-CZ 3.98Å; M274-F276 HydrophobicContact CE-CE1 4.23Å; M274-F276 HydrophobicContact CE-CZ 4.29Å; M274-F276 HydrophobicContact SD-CZ 4.36Å; F276-Y278 HydrophobicContact CB-CE2 4.44Å; F276-E306 HydrophobicContact CD1-CB 4.03Å; F276-E306 HydrophobicContact CE1-CB 4.23Å; F276-G320 PolarHBondContact N-O 3.45Å; F276-V321 HydrophobicContact CB-CG2 4.33Å; F276-V321 HydrophobicContact CD2-CG2 4.15Å; F276-F322 PolarHBondContact O-N 3.43Å
277	Q	95.2	Very high	92.7	Very high	37 Å²	37	33.4 Å²	33.4	17%	0.173	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.5	178.2	-59.2	-176	-79	0	0	110.3	M275 F279 R304 H305 F322 L324	M275-Q277 HydrophobicContact CE-CG 3.56Å; M275-Q277 VanDerWaalsContact CE-OE1 3.27Å; M275-Q277 HydrophobicContact CG-CG 4.43Å; Q277-F279 HydrophobicContact CB-CE2 3.97Å; Q277-F279 HydrophobicContact CB-CZ 4.42Å; Q277-R304 CarbonylContact O-C 3.56Å; Q277-R304 WeakPolarHBondContact O-CA 3.47Å; Q277-H305 HydrophobicContact CB-CB 4.25Å; Q277-H305 PolarHBondContact N-O 2.93Å; Q277-H305 PolarHBondContact O-N 3.45Å; Q277-F322 CarbonylContact C-O 3.47Å; Q277-F322 WeakPolarHBondContact CA-O 3.4Å; Q277-F322 HydrophobicContact CG-CB 4.33Å; Q277-L324 HydrophobicContact CB-CD1 4.22Å
278	Y	97.3	Very high	92.7	Very high	1 Å²	1	35.4 Å²	35.4	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	111.6	173.2	-62.3	-77.7	0	0	0	108.6	H244 I246 L262 V267 F276 V280 V302 R304 V321 F322 V323 L324	H244-Y278 AromaticContact NE2-CE2 3.54Å; H244-Y278 AromaticContact NE2-CZ 3.58Å; H244-Y278 PolarHBondContact NE2-OH 3.26Å; I246-Y278 HydrophobicContact CD1-CE2 4.1Å; L262-Y278 HydrophobicContact CD1-CD1 4.14Å; L262-Y278 HydrophobicContact CD1-CG 4.26Å; L262-Y278 HydrophobicContact CD2-CD1 3.8Å; L262-Y278 HydrophobicContact CD2-CE1 3.75Å; V267-Y278 VanDerWaalsContact CG2-OH 3.28Å; V267-Y278 WeakPolarHBondContact CG2-OH 3.34Å; F276-Y278 HydrophobicContact CB-CE2 4.44Å; Y278-V280 PolarHBondContact O-N 3.41Å; Y278-V302 HydrophobicContact CD1-CG2 4Å; Y278-R304 HydrophobicContact CD1-CB 4.22Å; Y278-R304 HydrophobicContact CD1-CG 4.4Å; Y278-R304 HydrophobicContact CE1-CB 4.22Å; Y278-R304 HydrophobicContact CE1-CG 4.04Å; Y278-V321 HydrophobicContact CD2-CG1 4.09Å; Y278-V321 HydrophobicContact CE2-CG1 3.75Å; Y278-F322 PolarHBondContact N-O 2.98Å; Y278-V323 HydrophobicContact CD2-CG2 4.15Å; Y278-V323 CarbonylContact O-C 3.57Å; Y278-V323 WeakPolarHBondContact O-CA 3.29Å; Y278-L324 PolarHBondContact O-N 3.4Å
279	F	97.5	Very high	92.6	Very high	87 Å²	87	33.8 Å²	33.8	38%	0.382	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	104.9	173.6	-64	-87.4	0	0	0	108.7	Q277 V302 T303 H305 L324	Q277-F279 HydrophobicContact CB-CE2 3.97Å; Q277-F279 HydrophobicContact CB-CZ 4.42Å; F279-V302 CarbonylContact O-C 3.58Å; F279-V302 WeakPolarHBondContact O-CA 3.43Å; F279-T303 PolarHBondContact N-O 2.83Å; F279-T303 PolarHBondContact O-N 3.47Å; F279-H305 HydrophobicContact CE2-CB 4Å; F279-L324 CarbonylContact C-O 3.51Å; F279-L324 WeakPolarHBondContact CA-O 3.28Å; F279-L324 HydrophobicContact CD1-CB 4.18Å; F279-L324 HydrophobicContact CD1-CD2 4.46Å; F279-L324 HydrophobicContact CE1-CD1 4.32Å; F279-L324 HydrophobicContact CE1-CD2 3.97Å
280	V	97.3	Very high	92.5	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.5	-174.9	176.5	0	0	0	0	110	F251 Y278 V282 F300 S301 V302 V323 L324 Y325 E326	F251-V280 HydrophobicContact CE2-CG1 3.67Å; F251-V280 HydrophobicContact CZ-CB 4.47Å; F251-V280 HydrophobicContact CZ-CG1 3.76Å; Y278-V280 PolarHBondContact O-N 3.41Å; V280-V282 HydrophobicContact CG1-CG2 3.82Å; V280-F300 HydrophobicContact CG1-CB 3.67Å; V280-F300 HydrophobicContact CG1-CD2 3.56Å; V280-F300 HydrophobicContact CG1-CE2 4.39Å; V280-F300 HydrophobicContact CG1-CG 3.81Å; V280-F300 HydrophobicContact CG2-CD2 4.38Å; V280-S301 CarbonylContact C-O 3.55Å; V280-S301 WeakPolarHBondContact CA-O 3.44Å; V280-V302 HydrophobicContact CG2-CB 4.5Å; V280-V302 HydrophobicContact CG2-CG2 4.08Å; V280-V323 HydrophobicContact CB-CG1 4.41Å; V280-V323 HydrophobicContact CG2-CG1 3.67Å; V280-L324 PolarHBondContact N-O 3.49Å; V280-Y325 CarbonylContact O-C 3.46Å; V280-Y325 VanDerWaalsContact O-CA 3.27Å; V280-Y325 WeakPolarHBondContact O-CA 3.42Å; V280-E326 PolarHBondContact O-N 3.17Å
281	K	96.9	Very high	92.5	Very high	124 Å²	124	37 Å²	37	54%	0.539	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	104.8	170.7	-67.8	-168.3	174.7	-171.3	0	109.5	F300 S301 E326	K281-F300 WeakPolarHBondContact O-CA 3.12Å; K281-F300 WeakPolarHBondContact O-CB 3.48Å; K281-S301 PolarHBondContact N-O 2.88Å; K281-S301 PolarHBondContact O-N 2.89Å; K281-E326 CarbonylContact C-O 3.59Å; K281-E326 WeakPolarHBondContact CA-O 3.36Å
282	V	95.9	Very high	92.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.6	-178.5	-175.3	0	0	0	0	109.3	F251 V280 N298 Q299 F300 E326 L327 S328	F251-V282 HydrophobicContact CB-CG1 4.23Å; F251-V282 HydrophobicContact CD1-CG2 3.84Å; F251-V282 HydrophobicContact CD2-CG2 4.24Å; F251-V282 HydrophobicContact CE1-CG2 3.86Å; F251-V282 HydrophobicContact CE2-CG2 4.28Å; F251-V282 HydrophobicContact CG-CG1 4.36Å; F251-V282 HydrophobicContact CG-CG2 4.03Å; F251-V282 HydrophobicContact CZ-CG2 4.09Å; V280-V282 HydrophobicContact CG1-CG2 3.82Å; V282-N298 HydrophobicContact CG1-CB 3.47Å; V282-N298 VanDerWaalsContact CG1-CB 3.47Å; V282-Q299 CarbonylContact C-O 3.49Å; V282-F300 HydrophobicContact CG2-CB 4.44Å; V282-E326 PolarHBondContact N-O 3.03Å; V282-L327 HydrophobicContact CB-CG 4.43Å; V282-L327 HydrophobicContact CG1-CD2 4.44Å; V282-L327 CarbonylContact O-C 3.58Å; V282-L327 WeakPolarHBondContact O-CA 3.42Å; V282-S328 WeakPolarHBondContact O-CB 3.31Å; V282-S328 PolarHBondContact O-N 3.02Å
283	V	95.3	Very high	93	Very high	29 Å²	29	36.5 Å²	36.5	18%	0.176	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	113.8	175.4	-178.6	0	0	0	0	107.7	T285 N298 Q299 V332	V283-T285 PolarHBondContact O-N 3.34Å; V283-T285 PolarHBondContact O-OG1 3.36Å; V283-N298 WeakPolarHBondContact O-CA 3.48Å; V283-Q299 HydrophobicContact CB-CG 3.74Å; V283-Q299 HydrophobicContact CG1-CG 4.3Å; V283-Q299 PolarHBondContact N-O 3.28Å; V283-Q299 PolarHBondContact O-N 3.5Å; V283-V332 HydrophobicContact CG1-CG2 3.75Å
284	P	95.1	Very high	93.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.013	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	133.1	174.8	-26.5	35.3	0	0	0	111.5	D61 N298 L327 M331 V332	D61-P284 WeakPolarHBondContact OD2-CG 3.37Å; P284-N298 WeakPolarHBondContact CA-OD1 3.27Å; P284-L327 HydrophobicContact CG-CD2 4.44Å; P284-M331 HydrophobicContact CB-CB 4.39Å; P284-M331 HydrophobicContact CB-CE 3.95Å; P284-M331 HydrophobicContact CB-CG 4.29Å; P284-M331 CarbonylContact O-C 3.46Å; P284-M331 WeakPolarHBondContact O-CA 3.48Å; P284-M331 WeakPolarHBondContact O-CG 3.37Å; P284-V332 PolarHBondContact O-N 3.47Å
285	T	94.3	Very high	93.5	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.2	-177.2	-60.4	0	0	0	0	110.5	Y255 V283 T297 Q299 V332 L334	Y255-T285 HydrophobicContact CE1-CG2 4.37Å; V283-T285 PolarHBondContact O-N 3.34Å; V283-T285 PolarHBondContact O-OG1 3.36Å; T285-T297 CarbonylContact C-O 3.57Å; T285-T297 WeakPolarHBondContact CA-O 3.36Å; T285-T297 HydrophobicContact CG2-CG2 4.1Å; T285-T297 PolarHBondContact N-O 2.91Å; T285-T297 CarbonylContact O-C 3.56Å; T285-T297 WeakPolarHBondContact O-CG2 3.47Å; T285-T297 PolarHBondContact O-N 3.2Å; T285-Q299 PolarHBondContact OG1-OE1 3.11Å; T285-Q299 VanDerWaalsContact OG1-OE1 3.06Å; T285-V332 CarbonylContact C-O 3.58Å; T285-V332 WeakPolarHBondContact CA-O 3.35Å; T285-V332 HydrophobicContact CG2-CB 4.31Å; T285-L334 HydrophobicContact CG2-CD1 3.67Å; T285-L334 HydrophobicContact CG2-CG 3.9Å
286	V	93.8	Very high	93.5	Very high	20 Å²	20	48.1 Å²	48.1	12%	0.121	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115.5	173.4	177.3	0	0	0	0	108	M288 V294 L295 M331 V332 K333 L334	V286-M288 HydrophobicContact CG1-CG 4.26Å; V286-V294 HydrophobicContact CG1-CG1 3.54Å; V286-L295 WeakPolarHBondContact CA-O 3.43Å; V286-M331 HydrophobicContact CG2-CE 4.21Å; V286-M331 HydrophobicContact CG2-CG 4.28Å; V286-M331 HydrophobicContact CG2-SD 3.53Å; V286-M331 VanDerWaalsContact CG2-SD 3.53Å; V286-V332 PolarHBondContact N-O 3.11Å; V286-K333 CarbonylContact O-C 3.56Å; V286-K333 WeakPolarHBondContact O-CA 3.34Å; V286-L334 PolarHBondContact O-N 3.49Å
287	Y	94.3	Very high	93.4	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.02	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.3	176.9	-165.4	-90.4	0	0	0	109.6	Y255 K289 L295 L334 E336	Y255-Y287 AromaticContact CD2-CD2 3.53Å; Y255-Y287 HydrophobicContact CD2-CD2 3.53Å; Y255-Y287 AromaticContact CD2-CE2 3.65Å; Y255-Y287 HydrophobicContact CD2-CE2 3.65Å; Y255-Y287 HydrophobicContact CD2-CG 4.39Å; Y255-Y287 HydrophobicContact CE2-CD2 4.26Å; Y255-Y287 HydrophobicContact CE2-CE2 4.41Å; Y255-Y287 AromaticContact CG-CD2 3.88Å; Y255-Y287 HydrophobicContact CG-CD2 3.88Å; Y255-Y287 HydrophobicContact CG-CE2 4.33Å; Y255-Y287 HydrophobicContact CG-CG 4.32Å; Y287-K289 HydrophobicContact CD1-CG 3.94Å; Y287-K289 HydrophobicContact CE1-CG 3.91Å; Y287-L295 PolarHBondContact N-O 3.49Å; Y287-L295 PolarHBondContact O-N 3.37Å; Y287-L334 HydrophobicContact CD2-CB 3.69Å; Y287-L334 HydrophobicContact CD2-CD1 3.86Å; Y287-L334 HydrophobicContact CD2-CG 4.42Å; Y287-L334 HydrophobicContact CE2-CB 4.22Å; Y287-L334 HydrophobicContact CE2-CD1 4.33Å; Y287-E336 HydrophobicContact CE1-CG 3.8Å; Y287-E336 WeakPolarHBondContact CE1-OE1 3.21Å; Y287-E336 VanDerWaalsContact CZ-OE1 3.23Å; Y287-E336 WeakPolarHBondContact OH-CG 3.46Å; Y287-E336 PolarHBondContact OH-OE1 3.03Å
288	M	93.8	Very high	93.4	Very high	44 Å²	44	47.1 Å²	47.1	22%	0.217	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	110.8	175.3	-57.2	-166.9	-44.7	0	0	108.8	V286 V294 K333 L334 T335 E336	V286-M288 HydrophobicContact CG1-CG 4.26Å; M288-V294 HydrophobicContact CG-CG2 4.31Å; M288-K333 HydrophobicContact CE-CD 4.45Å; M288-K333 WeakPolarHBondContact SD-CE 3.46Å; M288-L334 PolarHBondContact N-O 3.39Å; M288-T335 HydrophobicContact CB-CG2 4.5Å; M288-T335 HydrophobicContact CE-CG2 3.36Å; M288-T335 WeakPolarHBondContact CE-OG1 3.44Å; M288-E336 WeakPolarHBondContact O-CB 3.24Å; M288-E336 PolarHBondContact O-N 3.43Å
289	K	91.6	Very high	93.3	Very high	62 Å²	62	50.1 Å²	50.1	27%	0.27	26%	0.256	S	S	.	.			trans	-71	162.2	174.8	-68.7	-174.6	-164.7	164.1	0	110.9	Y287 D291 G292 E293 E336	Y287-K289 HydrophobicContact CD1-CG 3.94Å; Y287-K289 HydrophobicContact CE1-CG 3.91Å; K289-D291 WeakPolarHBondContact CB-OD1 3.5Å; K289-D291 PolarHBondContact O-N 2.91Å; K289-G292 PolarHBondContact O-N 2.76Å; K289-G292 VanDerWaalsContact O-N 3.08Å; K289-E293 HydrophobicContact CB-CB 4.27Å; K289-E293 HydrophobicContact CD-CB 4.13Å; K289-E293 HydrophobicContact CG-CB 4.49Å; K289-E293 PolarHBondContact N-O 3.36Å; K289-E293 IonicContact NZ-OE1 3.24Å; K289-E293 PolarHBondContact NZ-OE1 3.46Å; K289-E293 IonicContact NZ-OE2 3.48Å; K289-E293 PolarHBondContact NZ-OE2 3.4Å; K289-E336 WeakPolarHBondContact CA-OE2 3.32Å
290	V	88.4	Confident	93.2	Very high	65 Å²	65	46.8 Å²	46.8	39%	0.394	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-35.2	176.6	176	0	0	0	0	113	T52 G292 E336 H338	T52-V290 HydrophobicContact CG2-CG2 3.84Å; V290-G292 PolarHBondContact O-N 3.49Å; V290-E336 HydrophobicContact CG2-CB 3.76Å; V290-E336 PolarHBondContact N-OE2 2.89Å; V290-H338 WeakPolarHBondContact CG1-CD2 3.42Å; V290-H338 WeakPolarHBondContact CG1-NE2 3.48Å
291	D	88.6	Confident	93.2	Very high	117 Å²	117	49.9 Å²	49.9	63%	0.626	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-6.5	-179.8	61.2	4.2	0	0	0	113.8	K289 E293	K289-D291 WeakPolarHBondContact CB-OD1 3.5Å; K289-D291 PolarHBondContact O-N 2.91Å; D291-E293 WeakPolarHBondContact OD1-CB 3.44Å; D291-E293 PolarHBondContact OD1-N 3.03Å
292	G	87.9	Confident	93.2	Very high	55 Å²	55	46 Å²	46	57%	0.567	25%	0.25	S	S	*	.	S	Bend	trans	90.5	1	-177	0	0	0	0	0	114.2	K289 V290 V294	K289-G292 PolarHBondContact O-N 2.76Å; K289-G292 VanDerWaalsContact O-N 3.08Å; V290-G292 PolarHBondContact O-N 3.49Å; G292-V294 PolarHBondContact O-N 3.34Å
293	E	91.4	Very high	93.2	Very high	90 Å²	90	50.6 Å²	50.6	42%	0.421	28%	0.278	S	S	.	.			trans	-63	129.4	171	-166.3	-167.2	140.3	0	0	109.6	K289 D291	K289-E293 HydrophobicContact CB-CB 4.27Å; K289-E293 HydrophobicContact CD-CB 4.13Å; K289-E293 HydrophobicContact CG-CB 4.49Å; K289-E293 PolarHBondContact N-O 3.36Å; K289-E293 IonicContact NZ-OE1 3.24Å; K289-E293 PolarHBondContact NZ-OE1 3.46Å; K289-E293 IonicContact NZ-OE2 3.48Å; K289-E293 PolarHBondContact NZ-OE2 3.4Å; D291-E293 WeakPolarHBondContact OD1-CB 3.44Å; D291-E293 PolarHBondContact OD1-N 3.03Å
294	V	91.9	Very high	93.2	Very high	85 Å²	85	54.9 Å²	54.9	52%	0.515	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	107.5	-179.8	-179.6	0	0	0	0	108.7	V286 M288 G292	V286-V294 HydrophobicContact CG1-CG1 3.54Å; M288-V294 HydrophobicContact CG-CG2 4.31Å; G292-V294 PolarHBondContact O-N 3.34Å
295	L	92.1	Very high	93.2	Very high	13 Å²	13	60.1 Å²	60.1	7%	0.068	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.3	177	178.9	69.1	0	0	0	109.7	E253 V286 Y287	E253-L295 HydrophobicContact CB-CD1 3.84Å; E253-L295 HydrophobicContact CG-CD1 4.49Å; E253-L295 WeakPolarHBondContact OE2-CD1 3.17Å; V286-L295 WeakPolarHBondContact CA-O 3.43Å; Y287-L295 PolarHBondContact N-O 3.49Å; Y287-L295 PolarHBondContact O-N 3.37Å
296	R	90.5	Very high	93.1	Very high	171 Å²	171	64.3 Å²	64.3	65%	0.645	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.4	174.5	-67.2	-176	179.4	169.9	3.2	109.1	D66	D66-R296 IonicContact OD2-NH1 3.23Å
297	T	92.6	Very high	92.9	Very high	4 Å²	4	65.7 Å²	65.7	3%	0.025	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	-177.4	-173	-179.4	0	0	0	0	109.3	E253 Y255 T285	E253-T297 WeakPolarHBondContact O-CB 3.32Å; E253-T297 PolarHBondContact O-OG1 3.19Å; Y255-T297 HydrophobicContact CD1-CG2 3.31Å; Y255-T297 HydrophobicContact CE1-CG2 3.67Å; Y255-T297 HydrophobicContact CG-CG2 4.24Å; T285-T297 CarbonylContact C-O 3.57Å; T285-T297 WeakPolarHBondContact CA-O 3.36Å; T285-T297 HydrophobicContact CG2-CG2 4.1Å; T285-T297 PolarHBondContact N-O 2.91Å; T285-T297 CarbonylContact O-C 3.56Å; T285-T297 WeakPolarHBondContact O-CG2 3.47Å; T285-T297 PolarHBondContact O-N 3.2Å
298	N	94.7	Very high	92.4	Very high	12 Å²	12	67.6 Å²	67.6	6%	0.064	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144.1	174.7	-44.4	-97.9	0	0	0	109.5	L68 F251 V282 V283 P284	L68-N298 VanDerWaalsContact CD1-ND2 3.27Å; L68-N298 WeakPolarHBondContact CD1-ND2 3.35Å; F251-N298 HydrophobicContact CB-CB 3.9Å; F251-N298 VanDerWaalsContact O-CB 3.25Å; F251-N298 WeakPolarHBondContact O-CB 3.36Å; F251-N298 PolarHBondContact O-N 3.23Å; F251-N298 VanDerWaalsContact O-N 3.09Å; F251-N298 PolarHBondContact O-ND2 3.02Å; V282-N298 HydrophobicContact CG1-CB 3.47Å; V282-N298 VanDerWaalsContact CG1-CB 3.47Å; V283-N298 WeakPolarHBondContact O-CA 3.48Å; P284-N298 WeakPolarHBondContact CA-OD1 3.27Å
299	Q	94.8	Very high	91.7	Very high	64 Å²	64	65.7 Å²	65.7	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	162.2	165.1	64.1	-169.8	66.5	0	0	108.6	V282 V283 T285	V282-Q299 CarbonylContact C-O 3.49Å; V283-Q299 HydrophobicContact CB-CG 3.74Å; V283-Q299 HydrophobicContact CG1-CG 4.3Å; V283-Q299 PolarHBondContact N-O 3.28Å; V283-Q299 PolarHBondContact O-N 3.5Å; T285-Q299 PolarHBondContact OG1-OE1 3.11Å; T285-Q299 VanDerWaalsContact OG1-OE1 3.06Å
300	F	96.2	Very high	90.4	Very high	17 Å²	17	67.2 Å²	67.2	8%	0.075	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.3	175.6	70.1	-85.3	0	0	0	113.2	L249 F251 N260 P261 L262 V280 K281 V282 V302	L249-F300 VanDerWaalsContact O-CE1 3.31Å; L249-F300 WeakPolarHBondContact O-CE1 3.46Å; L249-F300 WeakPolarHBondContact O-CZ 3.15Å; F251-F300 HydrophobicContact CD2-CB 4.41Å; F251-F300 AromaticContact CD2-CD1 3.58Å; F251-F300 HydrophobicContact CD2-CD1 3.58Å; F251-F300 AromaticContact CD2-CE1 3.96Å; F251-F300 HydrophobicContact CD2-CE1 3.96Å; F251-F300 HydrophobicContact CD2-CG 4.06Å; F251-F300 AromaticContact CE2-CD1 3.92Å; F251-F300 HydrophobicContact CE2-CD1 3.92Å; F251-F300 HydrophobicContact CE2-CD2 4.44Å; F251-F300 HydrophobicContact CE2-CE1 4.14Å; F251-F300 HydrophobicContact CE2-CG 4.07Å; F251-F300 HydrophobicContact CE2-CZ 4.46Å; N260-F300 HydrophobicContact CB-CE1 3.87Å; N260-F300 HydrophobicContact CB-CZ 4.13Å; P261-F300 HydrophobicContact CB-CE2 4.21Å; P261-F300 HydrophobicContact CG-CD2 4.25Å; P261-F300 HydrophobicContact CG-CE2 4.1Å; P261-F300 HydrophobicContact CG-CZ 4.5Å; P261-F300 VanDerWaalsContact CG-O 3.29Å; P261-F300 WeakPolarHBondContact CG-O 3.46Å; L262-F300 HydrophobicContact CB-CE2 4.49Å; L262-F300 HydrophobicContact CB-CZ 4.37Å; L262-F300 HydrophobicContact CD1-CE2 4.21Å; L262-F300 HydrophobicContact CG-CE2 4.18Å; V280-F300 HydrophobicContact CG1-CB 3.67Å; V280-F300 HydrophobicContact CG1-CD2 3.56Å; V280-F300 HydrophobicContact CG1-CE2 4.39Å; V280-F300 HydrophobicContact CG1-CG 3.81Å; V280-F300 HydrophobicContact CG2-CD2 4.38Å; K281-F300 WeakPolarHBondContact O-CA 3.12Å; K281-F300 WeakPolarHBondContact O-CB 3.48Å; V282-F300 HydrophobicContact CG2-CB 4.44Å; F300-V302 HydrophobicContact CD2-CB 4.5Å; F300-V302 HydrophobicContact CE2-CB 4.41Å
301	S	96.4	Very high	88.9	Confident	66 Å²	66	67 Å²	67	46%	0.462	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	155.5	164.9	62.6	0	0	0	0	109.8	V280 K281	V280-S301 CarbonylContact C-O 3.55Å; V280-S301 WeakPolarHBondContact CA-O 3.44Å; K281-S301 PolarHBondContact N-O 2.88Å; K281-S301 PolarHBondContact O-N 2.89Å
302	V	97.1	Very high	87.1	Confident	44 Å²	44	69.1 Å²	69.1	27%	0.267	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.3	-174.1	67	0	0	0	0	112	P261 L262 Y278 F279 V280 F300	P261-V302 HydrophobicContact CB-CG1 3.7Å; L262-V302 HydrophobicContact CD1-CG2 3.97Å; L262-V302 HydrophobicContact CD2-CG1 4.07Å; L262-V302 HydrophobicContact CD2-CG2 4.14Å; L262-V302 HydrophobicContact CG-CB 4.39Å; L262-V302 HydrophobicContact CG-CG1 4.12Å; L262-V302 HydrophobicContact CG-CG2 4.17Å; Y278-V302 HydrophobicContact CD1-CG2 4Å; F279-V302 CarbonylContact O-C 3.58Å; F279-V302 WeakPolarHBondContact O-CA 3.43Å; V280-V302 HydrophobicContact CG2-CB 4.5Å; V280-V302 HydrophobicContact CG2-CG2 4.08Å; F300-V302 HydrophobicContact CD2-CB 4.5Å; F300-V302 HydrophobicContact CE2-CB 4.41Å
303	T	97.1	Very high	84.9	Confident	96 Å²	96	73.1 Å²	73.1	59%	0.589	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.7	165.2	-51.9	0	0	0	0	108.6	F279	F279-T303 PolarHBondContact N-O 2.83Å; F279-T303 PolarHBondContact O-N 3.47Å
304	R	95.5	Very high	82.7	Confident	119 Å²	119	72.9 Å²	72.9	45%	0.449	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	141.8	-179.6	173.6	176.8	144.7	-173.9	-5.1	111.2	Q277 Y278 E306	Q277-R304 CarbonylContact O-C 3.56Å; Q277-R304 WeakPolarHBondContact O-CA 3.47Å; Y278-R304 HydrophobicContact CD1-CB 4.22Å; Y278-R304 HydrophobicContact CD1-CG 4.4Å; Y278-R304 HydrophobicContact CE1-CB 4.22Å; Y278-R304 HydrophobicContact CE1-CG 4.04Å; R304-E306 IonicContact CZ-OE2 3.11Å; R304-E306 IonicContact NE-OE2 3.86Å; R304-E306 PolarHBondContact NE-OE2 3.35Å; R304-E306 IonicContact NH2-OE2 3.07Å; R304-E306 PolarHBondContact NH2-OE2 3.29Å
305	H	93.9	Very high	80.8	Confident	111 Å²	111	73 Å²	73	51%	0.514	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.1	171.4	-148.6	-93.7	0	0	0	109.7	Q277 F279	Q277-H305 HydrophobicContact CB-CB 4.25Å; Q277-H305 PolarHBondContact N-O 2.93Å; Q277-H305 PolarHBondContact O-N 3.45Å; F279-H305 HydrophobicContact CE2-CB 4Å
306	E	92.3	Very high	79.3	Confident	90 Å²	90	81.3 Å²	81.3	42%	0.421	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.5	178.4	63.2	-167.5	-157.4	0	0	109.8	M274 M275 F276 R304	M274-E306 HydrophobicContact CE-CB 4.2Å; M274-E306 HydrophobicContact CE-CG 4.38Å; M275-E306 WeakPolarHBondContact O-CA 3.48Å; F276-E306 HydrophobicContact CD1-CB 4.03Å; F276-E306 HydrophobicContact CE1-CB 4.23Å; R304-E306 IonicContact CZ-OE2 3.11Å; R304-E306 IonicContact NE-OE2 3.86Å; R304-E306 PolarHBondContact NE-OE2 3.35Å; R304-E306 IonicContact NH2-OE2 3.07Å; R304-E306 PolarHBondContact NH2-OE2 3.29Å
307	K	89.5	Confident	78.4	Confident	50 Å²	50	74.2 Å²	74.2	22%	0.217	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	157.6	174.7	75.4	177.8	-156.8	174.9	0	110.7	M275 D315 Q316	M275-K307 HydrophobicContact CB-CG 4.02Å; M275-K307 HydrophobicContact CE-CD 3.69Å; M275-K307 HydrophobicContact CE-CG 3.88Å; M275-K307 PolarHBondContact N-O 2.92Å; M275-K307 PolarHBondContact O-N 2.68Å; M275-K307 HydrophobicContact SD-CD 4.32Å; M275-K307 VanDerWaalsContact SD-CE 3.52Å; M275-K307 HydrophobicContact SD-CG 4.24Å; K307-D315 IonicContact NZ-OD1 3.91Å; K307-D315 PolarHBondContact NZ-OD1 2.92Å; K307-D315 IonicContact NZ-OD2 3.15Å; K307-Q316 PolarHBondContact NZ-O 3.21Å
308	V	85.2	Confident	77.8	Confident	45 Å²	45	76 Å²	76	27%	0.273	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.4	172.6	-173.8	0	0	0	0	108.2	N310	V308-N310 VanDerWaalsContact C-N 3.33Å; V308-N310 WeakPolarHBondContact CG1-OD1 3.2Å; V308-N310 PolarHBondContact O-N 3.34Å; V308-N310 VanDerWaalsContact O-N 3.11Å
309	A	77.7	Confident	77.5	Confident	4 Å²	4	75.6 Å²	75.6	3%	0.033	43%	0.427	C	S	.	.			trans	-83.6	76.6	176.3	0	0	0	0	0	110.1	S273 M275 G311 G317 P319	S273-A309 WeakPolarHBondContact O-CA 3.25Å; S273-A309 VanDerWaalsContact O-CB 3.32Å; S273-A309 WeakPolarHBondContact O-CB 3.47Å; S273-A309 PolarHBondContact O-N 3.03Å; M275-A309 HydrophobicContact CB-CB 4.31Å; A309-G311 PolarHBondContact O-N 3.33Å; A309-G311 VanDerWaalsContact O-N 3.13Å; A309-G317 WeakPolarHBondContact CB-O 3.39Å; A309-P319 HydrophobicContact CB-CB 4.27Å
310	N	65.4	Low	77.3	Confident	93 Å²	93	72.5 Å²	72.5	50%	0.497	41%	0.413	S	S	.	.			trans	-80.8	88.8	171.9	-80.8	-10	0	0	0	109.8	V308 L312 L313	V308-N310 VanDerWaalsContact C-N 3.33Å; V308-N310 WeakPolarHBondContact CG1-OD1 3.2Å; V308-N310 PolarHBondContact O-N 3.34Å; V308-N310 VanDerWaalsContact O-N 3.11Å; N310-L312 PolarHBondContact O-N 3.44Å; N310-L313 PolarHBondContact O-N 3.4Å
311	G	55.8	Low	77.3	Confident	60 Å²	60	71.8 Å²	71.8	62%	0.619	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-0.1	179.7	0	0	0	0	0	116.3	A309	A309-G311 PolarHBondContact O-N 3.33Å; A309-G311 VanDerWaalsContact O-N 3.13Å
312	L	50.5	Low	77.2	Confident	162 Å²	162	70 Å²	70	85%	0.848	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-14.7	-179.4	-72.9	159.5	0	0	0	114.1	N310	N310-L312 PolarHBondContact O-N 3.44Å
313	L	43.3	Very low	77.2	Confident	140 Å²	140	68.1 Å²	68.1	73%	0.733	38%	0.382	S	S	*	.	S	Bend	trans	-131.7	59.3	-167.1	-83.2	157.5	0	0	0	112.7	N310 D315	N310-L313 PolarHBondContact O-N 3.4Å; L313-D315 PolarHBondContact O-N 2.86Å
314	G	43.5	Very low	77.1	Confident	84 Å²	84	66 Å²	66	87%	0.866	37%	0.367	S	S	*	.	S	Bend	trans	63.5	-15.1	160.9	0	0	0	0	0	118.3	Q316	G314-Q316 PolarHBondContact O-N 2.9Å
315	D	52.3	Low	77.2	Confident	89 Å²	89	60.4 Å²	60.4	48%	0.476	35%	0.346	S	S	.	.			trans	-87.3	95	173.4	-168	4.5	0	0	0	107.7	K307 L313 G317	K307-D315 IonicContact NZ-OD1 3.91Å; K307-D315 PolarHBondContact NZ-OD1 2.92Å; K307-D315 IonicContact NZ-OD2 3.15Å; L313-D315 PolarHBondContact O-N 2.86Å; D315-G317 PolarHBondContact O-N 2.95Å
316	Q	61.9	Low	77.3	Confident	187 Å²	187	60.7 Å²	60.7	87%	0.874	35%	0.348	S	S	*	.			trans	-62.5	104.8	178.6	-64.3	-177.1	-3.5	0	0	108.6	K307 G314	K307-Q316 PolarHBondContact NZ-O 3.21Å; G314-Q316 PolarHBondContact O-N 2.9Å
317	G	70.2	Confident	77.3	Confident	22 Å²	22	58.3 Å²	58.3	23%	0.227	34%	0.338	C	S	.	.			trans	-150	139.1	174	0	0	0	0	0	108.5	A309 D315	A309-G317 WeakPolarHBondContact CB-O 3.39Å; D315-G317 PolarHBondContact O-N 2.95Å
318	L	81.4	Confident	77.6	Confident	41 Å²	41	57.5 Å²	57.5	22%	0.215	34%	0.338	C	S	.	.			trans	-100.5	132.7	172.6	-173.5	81	0	0	0	107.4	A217 H230 L232 M275 G320 F322	A217-L318 HydrophobicContact CB-CD2 3.55Å; H230-L318 HydrophobicContact CB-CD1 4.11Å; H230-L318 HydrophobicContact CB-CD2 3.94Å; H230-L318 WeakPolarHBondContact CD2-CD2 3.42Å; L232-L318 HydrophobicContact CD1-CD1 3.34Å; L232-L318 HydrophobicContact CD1-CG 4.36Å; L232-L318 HydrophobicContact CD2-CD1 4.38Å; L232-L318 HydrophobicContact CG-CD1 3.85Å; M275-L318 VanDerWaalsContact CG-O 3.27Å; M275-L318 WeakPolarHBondContact CG-O 3.32Å; L318-G320 PolarHBondContact O-N 3.46Å; L318-F322 HydrophobicContact CB-CZ 4.06Å; L318-F322 HydrophobicContact CD2-CZ 4.15Å; L318-F322 WeakPolarHBondContact O-CE2 3.3Å
319	P	87.9	Confident	77.9	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.019	36%	0.357	C	S	.	.	S	Bend	trans	-61.6	131.6	171.2	28.3	-35.3	0	0	0	109.3	P218 L232 I240 A309	P218-P319 WeakPolarHBondContact CD-O 3.4Å; P218-P319 HydrophobicContact CG-CG 4.42Å; L232-P319 HydrophobicContact CD1-CG 3.93Å; I240-P319 HydrophobicContact CD1-CG 3.86Å; I240-P319 HydrophobicContact CG2-CB 4.13Å; I240-P319 HydrophobicContact CG2-CG 4.36Å; A309-P319 HydrophobicContact CB-CB 4.27Å
320	G	91.2	Very high	78.6	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.5	177.3	-172.7	0	0	0	0	0	113.6	F216 M274 M275 F276 L318	F216-G320 CarbonylContact O-C 3.54Å; F216-G320 WeakPolarHBondContact O-CA 3.37Å; M274-G320 PolarHBondContact O-N 2.93Å; M275-G320 WeakPolarHBondContact CA-O 3.45Å; F276-G320 PolarHBondContact N-O 3.45Å; L318-G320 PolarHBondContact O-N 3.46Å
321	V	94.9	Very high	80	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.012	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.1	173.7	178.5	0	0	0	0	108.4	F76 H215 F216 M242 H244 F276 Y278	F76-V321 HydrophobicContact CE1-CB 4.44Å; F76-V321 HydrophobicContact CE1-CG2 3.82Å; F76-V321 HydrophobicContact CZ-CG2 4.36Å; H215-V321 CarbonylContact C-O 3.44Å; H215-V321 WeakPolarHBondContact CA-O 3.36Å; H215-V321 WeakPolarHBondContact CB-O 3.42Å; F216-V321 HydrophobicContact CB-CB 4.34Å; F216-V321 HydrophobicContact CD2-CB 4.09Å; F216-V321 HydrophobicContact CD2-CG1 4.21Å; F216-V321 PolarHBondContact N-O 3.27Å; F216-V321 PolarHBondContact O-N 3.19Å; M242-V321 HydrophobicContact CE-CG2 4.45Å; H244-V321 WeakPolarHBondContact ND1-CG2 3.34Å; F276-V321 HydrophobicContact CB-CG2 4.33Å; F276-V321 HydrophobicContact CD2-CG2 4.15Å; Y278-V321 HydrophobicContact CD2-CG1 4.09Å; Y278-V321 HydrophobicContact CE2-CG1 3.75Å
322	F	95	Very high	81.8	Confident	28 Å²	28	59.3 Å²	59.3	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.4	-175.4	-63.8	-97.3	0	0	0	109.9	H215 M275 F276 Q277 Y278 L318 L324	H215-F322 HydrophobicContact CB-CB 4.24Å; H215-F322 HydrophobicContact CB-CD1 3.22Å; H215-F322 HydrophobicContact CB-CE1 3.49Å; H215-F322 VanDerWaalsContact CB-CE1 3.49Å; H215-F322 HydrophobicContact CB-CG 3.77Å; H215-F322 HydrophobicContact CB-CZ 4.24Å; H215-F322 AromaticContact CD2-CE1 3.96Å; H215-F322 AromaticContact CG-CD1 3.66Å; H215-F322 AromaticContact CG-CE1 3.46Å; H215-F322 VanDerWaalsContact CG-CE1 3.46Å; H215-F322 AromaticContact ND1-CE1 3.87Å; M275-F322 HydrophobicContact CG-CD2 3.82Å; M275-F322 HydrophobicContact CG-CE2 3.76Å; M275-F322 HydrophobicContact SD-CE2 4.32Å; F276-F322 PolarHBondContact O-N 3.43Å; Q277-F322 CarbonylContact C-O 3.47Å; Q277-F322 WeakPolarHBondContact CA-O 3.4Å; Q277-F322 HydrophobicContact CG-CB 4.33Å; Y278-F322 PolarHBondContact N-O 2.98Å; L318-F322 HydrophobicContact CB-CZ 4.06Å; L318-F322 HydrophobicContact CD2-CZ 4.15Å; L318-F322 WeakPolarHBondContact O-CE2 3.3Å; F322-L324 HydrophobicContact CB-CD1 3.97Å
323	V	96.6	Very high	83.9	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.024	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.1	172.8	-177.4	0	0	0	0	108	N213 F214 L249 Y278 V280	N213-V323 CarbonylContact C-O 3.49Å; N213-V323 WeakPolarHBondContact CA-O 3.36Å; N213-V323 WeakPolarHBondContact CB-O 3.4Å; F214-V323 HydrophobicContact CD1-CB 4Å; F214-V323 HydrophobicContact CD1-CG1 4.28Å; F214-V323 HydrophobicContact CD2-CB 4.26Å; F214-V323 HydrophobicContact CD2-CG2 4.43Å; F214-V323 HydrophobicContact CE1-CB 3.49Å; F214-V323 VanDerWaalsContact CE1-CB 3.49Å; F214-V323 HydrophobicContact CE1-CG1 3.46Å; F214-V323 VanDerWaalsContact CE1-CG1 3.46Å; F214-V323 HydrophobicContact CE1-CG2 4.17Å; F214-V323 HydrophobicContact CE2-CB 3.79Å; F214-V323 HydrophobicContact CE2-CG1 4.47Å; F214-V323 HydrophobicContact CE2-CG2 3.66Å; F214-V323 HydrophobicContact CG-CB 4.36Å; F214-V323 HydrophobicContact CZ-CB 3.38Å; F214-V323 HydrophobicContact CZ-CG1 3.58Å; F214-V323 HydrophobicContact CZ-CG2 3.5Å; F214-V323 PolarHBondContact N-O 3.29Å; F214-V323 PolarHBondContact O-N 3.14Å; L249-V323 HydrophobicContact CD2-CG1 4.48Å; Y278-V323 HydrophobicContact CD2-CG2 4.15Å; Y278-V323 CarbonylContact O-C 3.57Å; Y278-V323 WeakPolarHBondContact O-CA 3.29Å; V280-V323 HydrophobicContact CB-CG1 4.41Å; V280-V323 HydrophobicContact CG2-CG1 3.67Å
324	L	96.2	Very high	86.4	Confident	52 Å²	52	48.5 Å²	48.5	27%	0.272	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	114	178.6	-61.8	90.2	0	0	0	107.8	N213 Q277 Y278 F279 V280 F322	N213-L324 HydrophobicContact CB-CB 4.48Å; N213-L324 HydrophobicContact CB-CG 4.1Å; Q277-L324 HydrophobicContact CB-CD1 4.22Å; Y278-L324 PolarHBondContact O-N 3.4Å; F279-L324 CarbonylContact C-O 3.51Å; F279-L324 WeakPolarHBondContact CA-O 3.28Å; F279-L324 HydrophobicContact CD1-CB 4.18Å; F279-L324 HydrophobicContact CD1-CD2 4.46Å; F279-L324 HydrophobicContact CE1-CD1 4.32Å; F279-L324 HydrophobicContact CE1-CD2 3.97Å; V280-L324 PolarHBondContact N-O 3.49Å; F322-L324 HydrophobicContact CB-CD1 3.97Å
325	Y	96.2	Very high	88.8	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	133.2	-175.8	62.9	-88.6	0	0	0	112.2	L68 I70 V210 A211 G212 F214 F251 V280	L68-Y325 HydrophobicContact CD2-CE2 4.41Å; I70-Y325 HydrophobicContact CD1-CD1 4.43Å; I70-Y325 HydrophobicContact CD1-CE1 4.04Å; V210-Y325 VanDerWaalsContact O-CE2 3.23Å; V210-Y325 WeakPolarHBondContact O-CE2 3.24Å; A211-Y325 WeakPolarHBondContact CA-O 3.43Å; G212-Y325 PolarHBondContact N-O 2.89Å; G212-Y325 WeakPolarHBondContact O-CD1 3.3Å; G212-Y325 PolarHBondContact O-N 3.47Å; G212-Y325 VanDerWaalsContact O-O 3.12Å; F214-Y325 HydrophobicContact CD1-CD1 4.08Å; F214-Y325 HydrophobicContact CD1-CE1 4.06Å; F214-Y325 HydrophobicContact CE1-CD1 4.43Å; F251-Y325 HydrophobicContact CE1-CG 4.21Å; V280-Y325 CarbonylContact O-C 3.46Å; V280-Y325 VanDerWaalsContact O-CA 3.27Å; V280-Y325 WeakPolarHBondContact O-CA 3.42Å
326	E	95.8	Very high	90.7	Very high	117 Å²	117	42.4 Å²	42.4	55%	0.547	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.3	173.9	-67.5	-175.8	162.9	0	0	109.8	A211 V280 K281 V282	A211-E326 HydrophobicContact CB-CG 4.43Å; V280-E326 PolarHBondContact O-N 3.17Å; K281-E326 CarbonylContact C-O 3.59Å; K281-E326 WeakPolarHBondContact CA-O 3.36Å; V282-E326 PolarHBondContact N-O 3.03Å
327	L	93.5	Very high	92	Very high	40 Å²	40	38.4 Å²	38.4	21%	0.209	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132.7	176.4	-66.8	112.8	0	0	0	111.7	K209 V210 V282 P284	K209-L327 HydrophobicContact CD-CD2 4.23Å; K209-L327 HydrophobicContact CG-CD1 4.42Å; K209-L327 HydrophobicContact CG-CD2 3.45Å; K209-L327 VanDerWaalsContact CG-CD2 3.45Å; V210-L327 WeakPolarHBondContact O-CD1 3.49Å; V282-L327 HydrophobicContact CB-CG 4.43Å; V282-L327 HydrophobicContact CG1-CD2 4.44Å; V282-L327 CarbonylContact O-C 3.58Å; V282-L327 WeakPolarHBondContact O-CA 3.42Å; P284-L327 HydrophobicContact CG-CD2 4.44Å
328	S	94.2	Very high	92.8	Very high	33 Å²	33	42.4 Å²	42.4	23%	0.231	22%	0.215	C	C	.	.			trans	-69.9	139.1	172.3	-178.2	0	0	0	0	110.9	V282 M330	V282-S328 WeakPolarHBondContact O-CB 3.31Å; V282-S328 PolarHBondContact O-N 3.02Å; S328-M330 PolarHBondContact O-N 2.97Å; S328-M330 PolarHBondContact OG-N 3.34Å
329	P	92.4	Very high	93	Very high	101 Å²	101	42.2 Å²	42.2	66%	0.656	21%	0.212	S	C	*	.	S	Bend	trans	-71.1	-6.7	171.9	31.4	-35.9	0	0	0	113	D61	D61-P329 PolarHBondContact N-O 3.29Å; D61-P329 VanDerWaalsContact N-O 3.12Å
330	M	93	Very high	93	Very high	91 Å²	91	45.1 Å²	45.1	45%	0.448	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.4	178.1	-59.1	178.2	67.1	0	0	110.5	L58 Y59 S328	L58-M330 HydrophobicContact CB-CE 4.21Å; L58-M330 HydrophobicContact CD1-CE 3.87Å; L58-M330 HydrophobicContact CD2-CE 4.24Å; L58-M330 HydrophobicContact CG-CE 4.34Å; Y59-M330 CarbonylContact O-C 3.6Å; Y59-M330 WeakPolarHBondContact O-CA 3.47Å; S328-M330 PolarHBondContact O-N 2.97Å; S328-M330 PolarHBondContact OG-N 3.34Å
331	M	93.7	Very high	92.9	Very high	34 Å²	34	51 Å²	51	17%	0.167	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.8	176	176.6	-179.2	-77.6	0	0	110.2	Y59 D61 P284 V286	Y59-M331 PolarHBondContact N-O 2.98Å; Y59-M331 PolarHBondContact O-N 3.31Å; D61-M331 HydrophobicContact CB-CB 4.18Å; D61-M331 HydrophobicContact CB-CE 4.19Å; D61-M331 WeakPolarHBondContact OD1-CE 3.28Å; P284-M331 HydrophobicContact CB-CB 4.39Å; P284-M331 HydrophobicContact CB-CE 3.95Å; P284-M331 HydrophobicContact CB-CG 4.29Å; P284-M331 CarbonylContact O-C 3.46Å; P284-M331 WeakPolarHBondContact O-CA 3.48Å; P284-M331 WeakPolarHBondContact O-CG 3.37Å; V286-M331 HydrophobicContact CG2-CE 4.21Å; V286-M331 HydrophobicContact CG2-CG 4.28Å; V286-M331 HydrophobicContact CG2-SD 3.53Å; V286-M331 VanDerWaalsContact CG2-SD 3.53Å
332	V	94.5	Very high	92.8	Very high	14 Å²	14	55.4 Å²	55.4	9%	0.085	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.9	172.9	-178.2	0	0	0	0	108.8	E57 L58 V283 P284 T285 V286 L334	E57-V332 CarbonylContact O-C 3.57Å; E57-V332 WeakPolarHBondContact O-CA 3.49Å; L58-V332 HydrophobicContact CD2-CG2 3.68Å; V283-V332 HydrophobicContact CG1-CG2 3.75Å; P284-V332 PolarHBondContact O-N 3.47Å; T285-V332 CarbonylContact C-O 3.58Å; T285-V332 WeakPolarHBondContact CA-O 3.35Å; T285-V332 HydrophobicContact CG2-CB 4.31Å; V286-V332 PolarHBondContact N-O 3.11Å; V332-L334 HydrophobicContact CG1-CD2 3.81Å; V332-L334 HydrophobicContact CG1-CG 4.09Å
333	K	94.5	Very high	92.6	Very high	57 Å²	57	58.4 Å²	58.4	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	112.8	172.5	-174.5	-174.4	-179.2	-171.5	0	108.7	P56 E57 Y59 V286 M288	P56-K333 CarbonylContact C-O 3.58Å; P56-K333 WeakPolarHBondContact CA-O 3.29Å; E57-K333 HydrophobicContact CB-CB 4.4Å; E57-K333 PolarHBondContact N-O 2.89Å; E57-K333 PolarHBondContact O-N 3.37Å; Y59-K333 HydrophobicContact CD2-CB 3.73Å; Y59-K333 HydrophobicContact CD2-CD 4.2Å; Y59-K333 HydrophobicContact CE2-CB 3.72Å; Y59-K333 HydrophobicContact CE2-CD 3.58Å; Y59-K333 HydrophobicContact CE2-CG 4.32Å; V286-K333 CarbonylContact O-C 3.56Å; V286-K333 WeakPolarHBondContact O-CA 3.34Å; M288-K333 HydrophobicContact CE-CD 4.45Å; M288-K333 WeakPolarHBondContact SD-CE 3.46Å
334	L	94.8	Very high	92.4	Very high	18 Å²	18	59.4 Å²	59.4	9%	0.094	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117	176.1	-61.5	178.4	0	0	0	108.2	V54 P56 Y255 T285 V286 Y287 M288 V332	V54-L334 HydrophobicContact CG1-CB 3.81Å; V54-L334 HydrophobicContact CG1-CD2 4.03Å; V54-L334 HydrophobicContact CG1-CG 4.39Å; P56-L334 HydrophobicContact CB-CD2 3.78Å; Y255-L334 HydrophobicContact CD2-CD1 4.16Å; Y255-L334 HydrophobicContact CE2-CD1 3.49Å; Y255-L334 VanDerWaalsContact CE2-CD1 3.49Å; T285-L334 HydrophobicContact CG2-CD1 3.67Å; T285-L334 HydrophobicContact CG2-CG 3.9Å; V286-L334 PolarHBondContact O-N 3.49Å; Y287-L334 HydrophobicContact CD2-CB 3.69Å; Y287-L334 HydrophobicContact CD2-CD1 3.86Å; Y287-L334 HydrophobicContact CD2-CG 4.42Å; Y287-L334 HydrophobicContact CE2-CB 4.22Å; Y287-L334 HydrophobicContact CE2-CD1 4.33Å; M288-L334 PolarHBondContact N-O 3.39Å; V332-L334 HydrophobicContact CG1-CD2 3.81Å; V332-L334 HydrophobicContact CG1-CG 4.09Å
335	T	94.6	Very high	92.3	Very high	13 Å²	13	61.1 Å²	61.1	8%	0.08	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	113.7	178.5	-47.8	0	0	0	0	110.2	V54 H55 M288 K337	V54-T335 WeakPolarHBondContact CA-O 3.37Å; H55-T335 PolarHBondContact N-O 2.82Å; H55-T335 PolarHBondContact O-N 2.91Å; M288-T335 HydrophobicContact CB-CG2 4.5Å; M288-T335 HydrophobicContact CE-CG2 3.36Å; M288-T335 WeakPolarHBondContact CE-OG1 3.44Å; T335-K337 HydrophobicContact CG2-CD 4.34Å; T335-K337 HydrophobicContact CG2-CG 3.85Å; T335-K337 PolarHBondContact O-N 3.22Å
336	E	92.3	Very high	92.2	Very high	32 Å²	32	65.3 Å²	65.3	15%	0.15	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	124.1	166.8	-70.3	-174.1	158.9	0	0	109.7	V54 Y287 M288 K289 V290	V54-E336 HydrophobicContact CG2-CG 4.09Å; Y287-E336 HydrophobicContact CE1-CG 3.8Å; Y287-E336 WeakPolarHBondContact CE1-OE1 3.21Å; Y287-E336 VanDerWaalsContact CZ-OE1 3.23Å; Y287-E336 WeakPolarHBondContact OH-CG 3.46Å; Y287-E336 PolarHBondContact OH-OE1 3.03Å; M288-E336 WeakPolarHBondContact O-CB 3.24Å; M288-E336 PolarHBondContact O-N 3.43Å; K289-E336 WeakPolarHBondContact CA-OE2 3.32Å; V290-E336 HydrophobicContact CG2-CB 3.76Å; V290-E336 PolarHBondContact N-OE2 2.89Å
337	K	90	Very high	92.2	Very high	102 Å²	102	60.4 Å²	60.4	44%	0.443	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.5	172.9	-62.9	-172.5	-177	168.9	0	110.3	E53 T335	E53-K337 PolarHBondContact N-O 3.46Å; E53-K337 PolarHBondContact O-N 2.94Å; T335-K337 HydrophobicContact CG2-CD 4.34Å; T335-K337 HydrophobicContact CG2-CG 3.85Å; T335-K337 PolarHBondContact O-N 3.22Å
338	H	87.2	Confident	92.3	Very high	106 Å²	106	59.5 Å²	59.5	49%	0.491	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-76.2	144.9	160.4	-74.2	-66.8	0	0	0	110	T52 V290	T52-H338 VanDerWaalsContact CG2-CE1 3.46Å; T52-H338 WeakPolarHBondContact CG2-CE1 3.4Å; V290-H338 WeakPolarHBondContact CG1-CD2 3.42Å; V290-H338 WeakPolarHBondContact CG1-NE2 3.48Å
339	R	85.2	Confident	92.3	Very high	38 Å²	38	61.7 Å²	61.7	14%	0.143	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-62.7	145.3	169.1	-66.7	174.5	-173.4	-81	-24.4	109.6	Y48 Y49 E53 F341	Y48-R339 VanDerWaalsContact CE2-CZ 3.41Å; Y48-R339 WeakPolarHBondContact O-CD 3.4Å; Y48-R339 PolarHBondContact O-NE 2.59Å; Y48-R339 PolarHBondContact OH-NH1 2.94Å; Y48-R339 PolarHBondContact OH-NH2 3.46Å; Y49-R339 HydrophobicContact CD2-CB 4.26Å; Y49-R339 WeakPolarHBondContact CE2-O 2.9Å; E53-R339 IonicContact OE2-CZ 3.32Å; E53-R339 IonicContact OE2-NH1 3.73Å; E53-R339 IonicContact OE2-NH2 3.36Å; E53-R339 PolarHBondContact OE2-NH2 3.49Å; R339-F341 PolarHBondContact O-N 3.39Å
340	S	88.3	Confident	92.5	Very high	63 Å²	63	60 Å²	60	44%	0.441	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-61	136.6	174.9	68.2	0	0	0	0	110.4	T342 H343 F344	S340-T342 WeakPolarHBondContact CB-OG1 3.22Å; S340-T342 PolarHBondContact O-N 3.34Å; S340-T342 PolarHBondContact OG-OG1 3.49Å; S340-T342 VanDerWaalsContact OG-OG1 3.06Å; S340-H343 WeakPolarHBondContact O-CB 3.18Å; S340-H343 PolarHBondContact O-N 2.97Å; S340-H343 VanDerWaalsContact OG-CB 3.3Å; S340-H343 WeakPolarHBondContact OG-CB 3.13Å; S340-H343 PolarHBondContact OG-N 3.31Å; S340-F344 PolarHBondContact O-N 3.45Å
341	F	89.1	Confident	92.6	Very high	124 Å²	124	56.9 Å²	56.9	54%	0.544	31%	0.309	S	S	.	.	H	α-helix	trans	-57.6	-31.4	174.5	176.8	-107.7	0	0	0	112	Y49 R339 H343 F344 L345	Y49-F341 HydrophobicContact CE2-CB 4.5Å; R339-F341 PolarHBondContact O-N 3.39Å; F341-H343 VanDerWaalsContact C-N 3.33Å; F341-H343 PolarHBondContact O-N 3.36Å; F341-F344 HydrophobicContact CD2-CD1 4.29Å; F341-F344 HydrophobicContact CE2-CD1 4.09Å; F341-F344 PolarHBondContact O-N 2.96Å; F341-L345 PolarHBondContact O-N 2.86Å
342	T	92.4	Very high	92.6	Very high	94 Å²	94	59.4 Å²	59.4	58%	0.577	32%	0.322	S	S	*	.	H	α-helix	trans	-62.7	-38.3	174.4	47.3	0	0	0	0	112.5	S340 L345 T346	S340-T342 WeakPolarHBondContact CB-OG1 3.22Å; S340-T342 PolarHBondContact O-N 3.34Å; S340-T342 PolarHBondContact OG-OG1 3.49Å; S340-T342 VanDerWaalsContact OG-OG1 3.06Å; T342-L345 PolarHBondContact O-N 2.83Å; T342-T346 WeakPolarHBondContact O-CG2 3.36Å; T342-T346 PolarHBondContact O-N 3.46Å; T342-T346 PolarHBondContact O-OG1 2.97Å; T342-T346 VanDerWaalsContact O-OG1 3.1Å
343	H	89.9	Confident	92.5	Very high	92 Å²	92	60.6 Å²	60.6	43%	0.426	34%	0.337	S	S	.	.	H	α-helix	trans	-64.5	-44.2	176.9	-172.1	-76.7	0	0	0	111.2	S340 F341 L345 T346 G347	S340-H343 WeakPolarHBondContact O-CB 3.18Å; S340-H343 PolarHBondContact O-N 2.97Å; S340-H343 VanDerWaalsContact OG-CB 3.3Å; S340-H343 WeakPolarHBondContact OG-CB 3.13Å; S340-H343 PolarHBondContact OG-N 3.31Å; F341-H343 VanDerWaalsContact C-N 3.33Å; F341-H343 PolarHBondContact O-N 3.36Å; H343-L345 PolarHBondContact O-N 3.16Å; H343-T346 WeakPolarHBondContact CA-OG1 3.39Å; H343-T346 PolarHBondContact O-N 2.72Å; H343-T346 PolarHBondContact O-OG1 3.06Å; H343-G347 PolarHBondContact O-N 2.96Å
344	F	92.6	Very high	92.6	Very high	25 Å²	25	59.5 Å²	59.5	11%	0.11	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-48.4	173.7	170.6	-106.9	0	0	0	111.3	F42 E45 L46 Y49 S340 F341 T346 G347 V348	F42-F344 AromaticContact CE2-CZ 3.96Å; F42-F344 HydrophobicContact CE2-CZ 3.96Å; F42-F344 HydrophobicContact CZ-CZ 4.34Å; E45-F344 HydrophobicContact CG-CD2 3.9Å; E45-F344 HydrophobicContact CG-CE2 4.16Å; L46-F344 HydrophobicContact CB-CE2 4.23Å; L46-F344 HydrophobicContact CD1-CE2 4.27Å; L46-F344 HydrophobicContact CD1-CZ 4.16Å; Y49-F344 HydrophobicContact CD1-CD2 4.38Å; Y49-F344 HydrophobicContact CD1-CG 4.25Å; Y49-F344 HydrophobicContact CD2-CB 3.61Å; Y49-F344 HydrophobicContact CD2-CG 4.17Å; Y49-F344 HydrophobicContact CE2-CB 4.19Å; Y49-F344 HydrophobicContact CG-CB 3.83Å; Y49-F344 AromaticContact CG-CD2 3.96Å; Y49-F344 HydrophobicContact CG-CD2 3.96Å; Y49-F344 AromaticContact CG-CG 3.88Å; Y49-F344 HydrophobicContact CG-CG 3.88Å; S340-F344 PolarHBondContact O-N 3.45Å; F341-F344 HydrophobicContact CD2-CD1 4.29Å; F341-F344 HydrophobicContact CE2-CD1 4.09Å; F341-F344 PolarHBondContact O-N 2.96Å; F344-T346 VanDerWaalsContact C-N 3.34Å; F344-T346 PolarHBondContact O-N 3.09Å; F344-G347 PolarHBondContact O-N 3.49Å; F344-G347 VanDerWaalsContact O-N 3.11Å; F344-V348 HydrophobicContact CD1-CG2 4.47Å; F344-V348 HydrophobicContact CD2-CG2 4.2Å; F344-V348 HydrophobicContact CE1-CG2 4.03Å; F344-V348 HydrophobicContact CE2-CG2 3.7Å; F344-V348 HydrophobicContact CZ-CG2 3.61Å; F344-V348 WeakPolarHBondContact O-CG2 3.37Å; F344-V348 PolarHBondContact O-N 2.83Å
345	L	94.1	Very high	92.5	Very high	88 Å²	88	60 Å²	60	46%	0.461	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-42.7	179.1	-173.4	65.3	0	0	0	112.1	F341 T342 H343 G347 V348 C349	F341-L345 PolarHBondContact O-N 2.86Å; T342-L345 PolarHBondContact O-N 2.83Å; H343-L345 PolarHBondContact O-N 3.16Å; L345-G347 VanDerWaalsContact C-N 3.33Å; L345-G347 PolarHBondContact O-N 2.97Å; L345-V348 PolarHBondContact O-N 2.93Å; L345-C349 PolarHBondContact O-N 2.97Å; L345-C349 PolarHBondContact O-SG 3.28Å; L345-C349 VanDerWaalsContact O-SG 3.36Å
346	T	94.8	Very high	92.4	Very high	90 Å²	90	67.2 Å²	67.2	55%	0.552	38%	0.375	S	S	*	.	H	α-helix	trans	-63.8	-38.2	175	50.8	0	0	0	0	112.2	T342 H343 F344 C349 A350	T342-T346 WeakPolarHBondContact O-CG2 3.36Å; T342-T346 PolarHBondContact O-N 3.46Å; T342-T346 PolarHBondContact O-OG1 2.97Å; T342-T346 VanDerWaalsContact O-OG1 3.1Å; H343-T346 WeakPolarHBondContact CA-OG1 3.39Å; H343-T346 PolarHBondContact O-N 2.72Å; H343-T346 PolarHBondContact O-OG1 3.06Å; F344-T346 VanDerWaalsContact C-N 3.34Å; F344-T346 PolarHBondContact O-N 3.09Å; T346-C349 PolarHBondContact O-N 3.39Å; T346-A350 WeakPolarHBondContact O-CB 3.47Å; T346-A350 PolarHBondContact O-N 2.94Å
347	G	94.9	Very high	92.5	Very high	14 Å²	14	70 Å²	70	14%	0.144	39%	0.394	C	S	.	.	H	α-helix	trans	-61.7	-47.3	174.8	0	0	0	0	0	112	H343 F344 L345 C349 A350 I351	H343-G347 PolarHBondContact O-N 2.96Å; F344-G347 PolarHBondContact O-N 3.49Å; F344-G347 VanDerWaalsContact O-N 3.11Å; L345-G347 VanDerWaalsContact C-N 3.33Å; L345-G347 PolarHBondContact O-N 2.97Å; G347-C349 PolarHBondContact O-N 2.84Å; G347-A350 PolarHBondContact O-N 3.24Å; G347-I351 VanDerWaalsContact O-CG1 3.28Å; G347-I351 WeakPolarHBondContact O-CG1 3.46Å; G347-I351 PolarHBondContact O-N 3.04Å
348	V	95.3	Very high	92.7	Very high	21 Å²	21	68.6 Å²	68.6	13%	0.127	39%	0.394	C	S	.	.	H	α-helix	trans	-60.3	-46.2	176.7	175	0	0	0	0	111.5	F42 F344 L345 A350 I351 I352	F42-V348 HydrophobicContact CD2-CG1 4.25Å; F42-V348 HydrophobicContact CD2-CG2 3.92Å; F42-V348 HydrophobicContact CE2-CG1 4.36Å; F42-V348 HydrophobicContact CE2-CG2 3.91Å; F344-V348 HydrophobicContact CD1-CG2 4.47Å; F344-V348 HydrophobicContact CD2-CG2 4.2Å; F344-V348 HydrophobicContact CE1-CG2 4.03Å; F344-V348 HydrophobicContact CE2-CG2 3.7Å; F344-V348 HydrophobicContact CZ-CG2 3.61Å; F344-V348 WeakPolarHBondContact O-CG2 3.37Å; F344-V348 PolarHBondContact O-N 2.83Å; L345-V348 PolarHBondContact O-N 2.93Å; V348-A350 VanDerWaalsContact C-N 3.33Å; V348-A350 PolarHBondContact O-N 2.85Å; V348-I351 PolarHBondContact O-N 3.42Å; V348-I352 HydrophobicContact CG1-CD1 3.88Å; V348-I352 WeakPolarHBondContact O-CG1 3.31Å; V348-I352 PolarHBondContact O-N 2.94Å
349	C	95.2	Very high	92.9	Very high	78 Å²	78	64.2 Å²	64.2	53%	0.527	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-41	176.3	-71.4	0	0	0	0	112.3	L345 T346 G347 I352 G353	L345-C349 PolarHBondContact O-N 2.97Å; L345-C349 PolarHBondContact O-SG 3.28Å; L345-C349 VanDerWaalsContact O-SG 3.36Å; T346-C349 PolarHBondContact O-N 3.39Å; G347-C349 PolarHBondContact O-N 2.84Å; C349-I352 PolarHBondContact O-N 3.27Å; C349-G353 PolarHBondContact O-N 3.38Å
350	A	95.9	Very high	93.2	Very high	65 Å²	65	64.3 Å²	64.3	54%	0.537	39%	0.389	S	S	.	.	H	α-helix	trans	-65.9	-40.9	177.5	0	0	0	0	0	112.2	T346 G347 V348 G354	T346-A350 WeakPolarHBondContact O-CB 3.47Å; T346-A350 PolarHBondContact O-N 2.94Å; G347-A350 PolarHBondContact O-N 3.24Å; V348-A350 VanDerWaalsContact C-N 3.33Å; V348-A350 PolarHBondContact O-N 2.85Å; A350-G354 WeakPolarHBondContact O-CA 3.19Å; A350-G354 PolarHBondContact O-N 3.42Å
351	I	95.6	Very high	93.4	Very high	27 Å²	27	66.6 Å²	66.6	14%	0.138	40%	0.396	C	S	.	.	H	α-helix	trans	-61.2	-50.5	175.5	-69.2	161.8	0	0	0	110	M38 L41 E45 G347 V348 M355	M38-I351 HydrophobicContact CG-CG2 4.03Å; L41-I351 HydrophobicContact CB-CD1 4.03Å; L41-I351 HydrophobicContact CB-CG1 4.2Å; L41-I351 HydrophobicContact CB-CG2 3.76Å; L41-I351 HydrophobicContact CD1-CG2 4.11Å; E45-I351 HydrophobicContact CB-CD1 3.91Å; E45-I351 HydrophobicContact CG-CD1 4.25Å; G347-I351 VanDerWaalsContact O-CG1 3.28Å; G347-I351 WeakPolarHBondContact O-CG1 3.46Å; G347-I351 PolarHBondContact O-N 3.04Å; V348-I351 PolarHBondContact O-N 3.42Å; I351-M355 HydrophobicContact CG2-CG 4.42Å; I351-M355 WeakPolarHBondContact O-CB 3.34Å; I351-M355 WeakPolarHBondContact O-CG 3.48Å; I351-M355 PolarHBondContact O-N 3.23Å
352	I	93.2	Very high	93.6	Very high	87 Å²	87	64.3 Å²	64.3	45%	0.446	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-49.7	-178.6	-64.5	169	0	0	0	110.9	M38 V348 C349 F356	M38-I352 HydrophobicContact CG-CG1 4.48Å; M38-I352 HydrophobicContact SD-CG1 3.95Å; V348-I352 HydrophobicContact CG1-CD1 3.88Å; V348-I352 WeakPolarHBondContact O-CG1 3.31Å; V348-I352 PolarHBondContact O-N 2.94Å; C349-I352 PolarHBondContact O-N 3.27Å; I352-F356 WeakPolarHBondContact O-CB 3.37Å; I352-F356 PolarHBondContact O-N 3.23Å
353	G	93.7	Very high	93.5	Very high	38 Å²	38	62.5 Å²	62.5	39%	0.392	38%	0.375	S	S	.	.	H	α-helix	trans	-66.6	-42.2	-178.7	0	0	0	0	0	113.3	C349 T357	C349-G353 PolarHBondContact O-N 3.38Å; G353-T357 PolarHBondContact O-N 3.23Å; G353-T357 VanDerWaalsContact O-N 3.09Å; G353-T357 PolarHBondContact O-OG1 3.16Å
354	G	95.3	Very high	93.5	Very high	35 Å²	35	60.6 Å²	60.6	36%	0.361	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-47.1	177.5	0	0	0	0	0	112	A350 F356 T357 V358	A350-G354 WeakPolarHBondContact O-CA 3.19Å; A350-G354 PolarHBondContact O-N 3.42Å; G354-F356 PolarHBondContact O-N 3.07Å; G354-T357 PolarHBondContact O-N 3.48Å; G354-V358 WeakPolarHBondContact O-CG2 3.31Å; G354-V358 PolarHBondContact O-N 3.48Å
355	M	94	Very high	93.4	Very high	29 Å²	29	65.2 Å²	65.2	14%	0.143	40%	0.398	C	S	.	.	H	α-helix	trans	-65.2	-39.7	178.2	-72.1	-54.5	-58	0	0	112.5	L37 M38 L41 I351 T357 V358 A359	L37-M355 HydrophobicContact CB-CE 3.74Å; L37-M355 HydrophobicContact CD1-CE 3.92Å; M38-M355 HydrophobicContact CE-CB 3.82Å; L41-M355 HydrophobicContact CD1-CG 4.32Å; L41-M355 HydrophobicContact CD1-SD 4.12Å; I351-M355 HydrophobicContact CG2-CG 4.42Å; I351-M355 WeakPolarHBondContact O-CB 3.34Å; I351-M355 WeakPolarHBondContact O-CG 3.48Å; I351-M355 PolarHBondContact O-N 3.23Å; M355-T357 VanDerWaalsContact C-N 3.34Å; M355-T357 PolarHBondContact O-N 2.96Å; M355-V358 PolarHBondContact O-N 2.96Å; M355-A359 WeakPolarHBondContact O-CB 3.44Å; M355-A359 PolarHBondContact O-N 3.35Å
356	F	91.4	Very high	93.3	Very high	164 Å²	164	64.2 Å²	64.2	72%	0.719	39%	0.392	S	S	*	.	H	α-helix	trans	-63.4	-41.4	176.4	-167.7	-96.6	0	0	0	111.8	I352 G354 G360	I352-F356 WeakPolarHBondContact O-CB 3.37Å; I352-F356 PolarHBondContact O-N 3.23Å; G354-F356 PolarHBondContact O-N 3.07Å; F356-G360 PolarHBondContact O-N 2.94Å
357	T	93.7	Very high	93	Very high	89 Å²	89	62.9 Å²	62.9	55%	0.546	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-47.8	177.1	-55	0	0	0	0	111.5	G353 G354 M355 G360 L361	G353-T357 PolarHBondContact O-N 3.23Å; G353-T357 VanDerWaalsContact O-N 3.09Å; G353-T357 PolarHBondContact O-OG1 3.16Å; G354-T357 PolarHBondContact O-N 3.48Å; M355-T357 VanDerWaalsContact C-N 3.34Å; M355-T357 PolarHBondContact O-N 2.96Å; T357-G360 PolarHBondContact O-N 3.05Å; T357-L361 WeakPolarHBondContact O-CG 3.24Å; T357-L361 PolarHBondContact O-N 3.09Å
358	V	94.3	Very high	92.7	Very high	73 Å²	73	67.8 Å²	67.8	44%	0.442	40%	0.396	S	S	.	.	H	α-helix	trans	-66.7	-44.5	179.6	173.4	0	0	0	0	111.4	G354 M355 G360 L361 I362	G354-V358 WeakPolarHBondContact O-CG2 3.31Å; G354-V358 PolarHBondContact O-N 3.48Å; M355-V358 PolarHBondContact O-N 2.96Å; V358-G360 VanDerWaalsContact C-N 3.3Å; V358-G360 PolarHBondContact O-N 3.26Å; V358-L361 PolarHBondContact O-N 3.42Å; V358-I362 HydrophobicContact CG1-CD1 3.76Å; V358-I362 HydrophobicContact CG1-CG1 4.4Å; V358-I362 WeakPolarHBondContact O-CG1 3.48Å; V358-I362 PolarHBondContact O-N 2.88Å
359	A	92.8	Very high	92.5	Very high	14 Å²	14	69.6 Å²	69.6	12%	0.116	41%	0.409	C	S	.	.	H	α-helix	trans	-60.9	-40.4	176.5	0	0	0	0	0	111.5	V30 M355 I362 D363	V30-A359 HydrophobicContact CG1-CB 3.97Å; M355-A359 WeakPolarHBondContact O-CB 3.44Å; M355-A359 PolarHBondContact O-N 3.35Å; A359-I362 PolarHBondContact O-N 3.27Å; A359-D363 VanDerWaalsContact O-CB 3.31Å; A359-D363 WeakPolarHBondContact O-CB 3.15Å; A359-D363 PolarHBondContact O-N 3.39Å
360	G	90.8	Very high	92.1	Very high	41 Å²	41	68.5 Å²	68.5	42%	0.423	41%	0.406	S	S	.	.	H	α-helix	trans	-64.1	-39.8	175.4	0	0	0	0	0	113.3	F356 T357 V358 S364	F356-G360 PolarHBondContact O-N 2.94Å; T357-G360 PolarHBondContact O-N 3.05Å; V358-G360 VanDerWaalsContact C-N 3.3Å; V358-G360 PolarHBondContact O-N 3.26Å; G360-S364 VanDerWaalsContact O-CB 3.24Å; G360-S364 WeakPolarHBondContact O-CB 3.39Å; G360-S364 PolarHBondContact O-N 3.37Å
361	L	92.8	Very high	91.7	Very high	110 Å²	110	72.8 Å²	72.8	58%	0.576	41%	0.408	S	S	*	.	H	α-helix	trans	-64.7	-45.3	174	-73.1	171.3	0	0	0	111.6	T357 V358 S364 L365	T357-L361 WeakPolarHBondContact O-CG 3.24Å; T357-L361 PolarHBondContact O-N 3.09Å; V358-L361 PolarHBondContact O-N 3.42Å; L361-S364 PolarHBondContact O-N 3.49Å; L361-L365 WeakPolarHBondContact O-CB 3.29Å; L361-L365 VanDerWaalsContact O-CG 3.27Å; L361-L365 WeakPolarHBondContact O-CG 3.48Å; L361-L365 PolarHBondContact O-N 2.98Å
362	I	92.9	Very high	91.4	Very high	77 Å²	77	74 Å²	74	40%	0.395	42%	0.422	S	S	.	.	H	α-helix	trans	-64.6	-45.6	178.8	-67.8	171	0	0	0	110.8	V30 V358 A359 S364 L365 I366	V30-I362 HydrophobicContact CG1-CG2 4.42Å; V30-I362 HydrophobicContact CG2-CG2 3.88Å; V358-I362 HydrophobicContact CG1-CD1 3.76Å; V358-I362 HydrophobicContact CG1-CG1 4.4Å; V358-I362 WeakPolarHBondContact O-CG1 3.48Å; V358-I362 PolarHBondContact O-N 2.88Å; A359-I362 PolarHBondContact O-N 3.27Å; I362-S364 VanDerWaalsContact C-N 3.35Å; I362-S364 PolarHBondContact O-N 3.04Å; I362-L365 PolarHBondContact O-N 3.2Å; I362-I366 HydrophobicContact CG2-CD1 3.65Å; I362-I366 HydrophobicContact CG2-CG1 4.34Å; I362-I366 WeakPolarHBondContact O-CB 3.27Å; I362-I366 VanDerWaalsContact O-CG1 3.29Å; I362-I366 WeakPolarHBondContact O-CG1 3.48Å; I362-I366 PolarHBondContact O-N 3.46Å
363	D	90.7	Very high	91.1	Very high	56 Å²	56	74.5 Å²	74.5	30%	0.299	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-43.5	177.3	-175	58.4	0	0	0	111.3	G27 V30 A359 L365 I366 Y367	G27-D363 WeakPolarHBondContact CA-OD1 3.48Å; V30-D363 HydrophobicContact CG1-CB 4.49Å; A359-D363 VanDerWaalsContact O-CB 3.31Å; A359-D363 WeakPolarHBondContact O-CB 3.15Å; A359-D363 PolarHBondContact O-N 3.39Å; D363-L365 PolarHBondContact O-N 3.25Å; D363-I366 PolarHBondContact O-N 2.9Å; D363-Y367 VanDerWaalsContact O-CB 3.24Å; D363-Y367 WeakPolarHBondContact O-CB 3.38Å; D363-Y367 PolarHBondContact O-N 3.47Å
364	S	89	Confident	90.7	Very high	52 Å²	52	77.3 Å²	77.3	36%	0.364	43%	0.428	S	S	.	.	H	α-helix	trans	-59.7	-45.6	174.7	-177.8	0	0	0	0	112.1	G360 L361 I362 Y367 H368	G360-S364 VanDerWaalsContact O-CB 3.24Å; G360-S364 WeakPolarHBondContact O-CB 3.39Å; G360-S364 PolarHBondContact O-N 3.37Å; L361-S364 PolarHBondContact O-N 3.49Å; I362-S364 VanDerWaalsContact C-N 3.35Å; I362-S364 PolarHBondContact O-N 3.04Å; S364-Y367 PolarHBondContact O-N 3.14Å; S364-H368 WeakPolarHBondContact O-CB 3.2Å; S364-H368 PolarHBondContact O-CD2 3.04Å; S364-H368 PolarHBondContact O-N 2.9Å; S364-H368 PolarHBondContact OG-CD2 2.8Å
365	L	91.7	Very high	90.4	Very high	122 Å²	122	82.5 Å²	82.5	64%	0.639	44%	0.44	S	S	*	.	H	α-helix	trans	-62.7	-44.5	176.2	-72.6	172	0	0	0	112	L361 I362 D363 S369	L361-L365 WeakPolarHBondContact O-CB 3.29Å; L361-L365 VanDerWaalsContact O-CG 3.27Å; L361-L365 WeakPolarHBondContact O-CG 3.48Å; L361-L365 PolarHBondContact O-N 2.98Å; I362-L365 PolarHBondContact O-N 3.2Å; D363-L365 PolarHBondContact O-N 3.25Å; L365-S369 WeakPolarHBondContact O-CB 3.24Å; L365-S369 PolarHBondContact O-N 3.39Å; L365-S369 PolarHBondContact O-OG 3.45Å
366	I	90.8	Very high	90	Very high	67 Å²	67	87.3 Å²	87.3	34%	0.344	46%	0.46	S	S	.	.	H	α-helix	trans	-64.2	-43.7	177.1	-69.4	169.6	0	0	0	110.5	V30 I362 D363 S369 A370	V30-I366 HydrophobicContact CG2-CD1 3.58Å; I362-I366 HydrophobicContact CG2-CD1 3.65Å; I362-I366 HydrophobicContact CG2-CG1 4.34Å; I362-I366 WeakPolarHBondContact O-CB 3.27Å; I362-I366 VanDerWaalsContact O-CG1 3.29Å; I362-I366 WeakPolarHBondContact O-CG1 3.48Å; I362-I366 PolarHBondContact O-N 3.46Å; D363-I366 PolarHBondContact O-N 2.9Å; I366-S369 WeakPolarHBondContact CA-OG 3.19Å; I366-S369 PolarHBondContact O-OG 2.98Å; I366-A370 WeakPolarHBondContact O-CB 3.4Å; I366-A370 PolarHBondContact O-N 3.3Å
367	Y	88.6	Confident	89.7	Confident	62 Å²	62	83.3 Å²	83.3	24%	0.243	45%	0.446	C	S	.	.	H	α-helix	trans	-64.6	-48.8	179.6	-176.4	-101.7	0	0	0	112.5	V22 T24 D363 S364 R371	V22-Y367 HydrophobicContact CG1-CE2 4.36Å; T24-Y367 HydrophobicContact CG2-CD2 4.02Å; T24-Y367 HydrophobicContact CG2-CE2 4.13Å; D363-Y367 VanDerWaalsContact O-CB 3.24Å; D363-Y367 WeakPolarHBondContact O-CB 3.38Å; D363-Y367 PolarHBondContact O-N 3.47Å; S364-Y367 PolarHBondContact O-N 3.14Å; Y367-R371 HydrophobicContact CE1-CG 4.44Å; Y367-R371 VanDerWaalsContact CZ-NE 3.31Å; Y367-R371 WeakPolarHBondContact O-CB 3.25Å; Y367-R371 PolarHBondContact O-N 2.89Å; Y367-R371 PolarHBondContact OH-NE 3.21Å; Y367-R371 PolarHBondContact OH-NH2 2.87Å
368	H	89.5	Confident	89.3	Confident	117 Å²	117	84.5 Å²	84.5	54%	0.542	45%	0.449	S	S	.	.	H	α-helix	trans	-67.5	-39	179.4	-78	-64.4	0	0	0	112.1	S364 A372	S364-H368 WeakPolarHBondContact O-CB 3.2Å; S364-H368 PolarHBondContact O-CD2 3.04Å; S364-H368 PolarHBondContact O-N 2.9Å; S364-H368 PolarHBondContact OG-CD2 2.8Å; H368-A372 VanDerWaalsContact O-CB 3.25Å; H368-A372 WeakPolarHBondContact O-CB 3.26Å; H368-A372 PolarHBondContact O-N 2.95Å
369	S	89.6	Confident	88.9	Confident	58 Å²	58	86.4 Å²	86.4	41%	0.406	46%	0.456	S	S	.	.	H	α-helix	trans	-67.1	-45.1	175.8	58.3	0	0	0	0	112	L365 I366 R371 A372 I373	L365-S369 WeakPolarHBondContact O-CB 3.24Å; L365-S369 PolarHBondContact O-N 3.39Å; L365-S369 PolarHBondContact O-OG 3.45Å; I366-S369 WeakPolarHBondContact CA-OG 3.19Å; I366-S369 PolarHBondContact O-OG 2.98Å; S369-R371 PolarHBondContact O-N 2.87Å; S369-A372 PolarHBondContact O-N 3.03Å; S369-I373 WeakPolarHBondContact O-CB 3.38Å; S369-I373 VanDerWaalsContact O-CG1 3.26Å; S369-I373 WeakPolarHBondContact O-CG1 3.45Å; S369-I373 PolarHBondContact O-N 2.98Å
370	A	88	Confident	88	Confident	55 Å²	55	88.9 Å²	88.9	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-60.1	-44.3	175.4	0	0	0	0	0	111.8	I366 I373 Q374	I366-A370 WeakPolarHBondContact O-CB 3.4Å; I366-A370 PolarHBondContact O-N 3.3Å; A370-I373 PolarHBondContact O-N 2.69Å; A370-Q374 WeakPolarHBondContact O-CB 3.29Å; A370-Q374 PolarHBondContact O-N 2.92Å
371	R	87	Confident	86.8	Confident	156 Å²	156	94.9 Å²	94.9	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-64.5	-39.5	174.4	-83.5	-168.4	161.6	-156.2	-2.8	112.9	Y367 S369 K375	Y367-R371 HydrophobicContact CE1-CG 4.44Å; Y367-R371 VanDerWaalsContact CZ-NE 3.31Å; Y367-R371 WeakPolarHBondContact O-CB 3.25Å; Y367-R371 PolarHBondContact O-N 2.89Å; Y367-R371 PolarHBondContact OH-NE 3.21Å; Y367-R371 PolarHBondContact OH-NH2 2.87Å; S369-R371 PolarHBondContact O-N 2.87Å; R371-K375 VanDerWaalsContact O-CB 3.29Å; R371-K375 WeakPolarHBondContact O-CB 3.39Å; R371-K375 PolarHBondContact O-N 3.3Å
372	A	88.8	Confident	85.1	Confident	51 Å²	51	93.1 Å²	93.1	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-38.5	177.6	0	0	0	0	0	111.9	H368 S369 K376	H368-A372 VanDerWaalsContact O-CB 3.25Å; H368-A372 WeakPolarHBondContact O-CB 3.26Å; H368-A372 PolarHBondContact O-N 2.95Å; S369-A372 PolarHBondContact O-N 3.03Å; A372-K376 WeakPolarHBondContact O-CG 3.4Å; A372-K376 PolarHBondContact O-N 3.39Å; A372-K376 VanDerWaalsContact O-N 3.11Å
373	I	87.8	Confident	83	Confident	99 Å²	99	99.7 Å²	99.7	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-67.6	-48.7	174.8	-68	165.3	0	0	0	110.2	S369 A370 K375 K376 I377	S369-I373 WeakPolarHBondContact O-CB 3.38Å; S369-I373 VanDerWaalsContact O-CG1 3.26Å; S369-I373 WeakPolarHBondContact O-CG1 3.45Å; S369-I373 PolarHBondContact O-N 2.98Å; A370-I373 PolarHBondContact O-N 2.69Å; I373-K375 VanDerWaalsContact C-N 3.31Å; I373-K375 PolarHBondContact O-N 2.92Å; I373-K376 WeakPolarHBondContact O-CA 3.43Å; I373-K376 WeakPolarHBondContact O-CB 3.48Å; I373-K376 PolarHBondContact O-N 3Å; I373-I377 HydrophobicContact CG2-CD1 3.78Å; I373-I377 HydrophobicContact CG2-CG1 4.37Å; I373-I377 WeakPolarHBondContact O-CG1 3.47Å; I373-I377 PolarHBondContact O-N 3.35Å
374	Q	86.2	Confident	82.6	Confident	97 Å²	97	101.9 Å²	101.9	45%	0.453	55%	0.547	S	S	.	.	H	α-helix	trans	-57.7	-45	177.2	-171.1	62.8	42.3	0	0	111.3	A370 K376 I377 D378	A370-Q374 WeakPolarHBondContact O-CB 3.29Å; A370-Q374 PolarHBondContact O-N 2.92Å; Q374-K376 VanDerWaalsContact C-N 3.27Å; Q374-K376 PolarHBondContact O-N 3.11Å; Q374-I377 PolarHBondContact O-N 2.86Å; Q374-I377 VanDerWaalsContact O-N 3.12Å; Q374-D378 PolarHBondContact NE2-OD1 2.84Å; Q374-D378 PolarHBondContact O-N 2.92Å
375	K	87.5	Confident	82.3	Confident	144 Å²	144	104.5 Å²	104.5	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-60.7	-34.5	175.5	-172	176.7	-177.8	179.1	0	112.6	R371 I373 L379	R371-K375 VanDerWaalsContact O-CB 3.29Å; R371-K375 WeakPolarHBondContact O-CB 3.39Å; R371-K375 PolarHBondContact O-N 3.3Å; I373-K375 VanDerWaalsContact C-N 3.31Å; I373-K375 PolarHBondContact O-N 2.92Å; K375-L379 HydrophobicContact CG-CD1 4.19Å; K375-L379 WeakPolarHBondContact O-CB 3.35Å; K375-L379 WeakPolarHBondContact O-CD1 3.41Å; K375-L379 WeakPolarHBondContact O-CG 3.18Å; K375-L379 PolarHBondContact O-N 3.12Å
376	K	86	Confident	81.8	Confident	130 Å²	130	103.5 Å²	103.5	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-71.7	-37.3	175	-77.2	-178	179.1	-175.1	0	112.3	A372 I373 Q374 L379 G380 K381 T382	A372-K376 WeakPolarHBondContact O-CG 3.4Å; A372-K376 PolarHBondContact O-N 3.39Å; A372-K376 VanDerWaalsContact O-N 3.11Å; I373-K376 WeakPolarHBondContact O-CA 3.43Å; I373-K376 WeakPolarHBondContact O-CB 3.48Å; I373-K376 PolarHBondContact O-N 3Å; Q374-K376 VanDerWaalsContact C-N 3.27Å; Q374-K376 PolarHBondContact O-N 3.11Å; K376-L379 PolarHBondContact O-N 3.22Å; K376-G380 PolarHBondContact O-N 3.09Å; K376-K381 PolarHBondContact O-N 3.45Å; K376-K381 VanDerWaalsContact O-N 3.09Å; K376-T382 HydrophobicContact CB-CG2 4.16Å
377	I	85.3	Confident	81.2	Confident	79 Å²	79	105.6 Å²	105.6	41%	0.405	56%	0.564	S	S	.	*	H	α-helix	trans	-65.3	-48.1	175	-66	168.1	0	0	0	110	I373 Q374 L379 G380 T382	I373-I377 HydrophobicContact CG2-CD1 3.78Å; I373-I377 HydrophobicContact CG2-CG1 4.37Å; I373-I377 WeakPolarHBondContact O-CG1 3.47Å; I373-I377 PolarHBondContact O-N 3.35Å; Q374-I377 PolarHBondContact O-N 2.86Å; Q374-I377 VanDerWaalsContact O-N 3.12Å; I377-L379 PolarHBondContact O-N 3.5Å; I377-G380 PolarHBondContact O-N 3.5Å; I377-T382 HydrophobicContact CG1-CG2 3.95Å
378	D	84.7	Confident	80.8	Confident	115 Å²	115	108.4 Å²	108.4	62%	0.615	58%	0.584	S	S	*	*	H	α-helix	trans	-62.8	-29.3	179.6	-62.6	-17.2	0	0	0	112.4	Q374 G380	Q374-D378 PolarHBondContact NE2-OD1 2.84Å; Q374-D378 PolarHBondContact O-N 2.92Å; D378-G380 VanDerWaalsContact C-N 3.28Å; D378-G380 PolarHBondContact O-N 3.25Å
379	L	85.4	Confident	80.2	Confident	112 Å²	112	107.8 Å²	107.8	59%	0.586	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	2.1	174.4	-70.8	170.3	0	0	0	113.6	K375 K376 I377 K381	K375-L379 HydrophobicContact CG-CD1 4.19Å; K375-L379 WeakPolarHBondContact O-CB 3.35Å; K375-L379 WeakPolarHBondContact O-CD1 3.41Å; K375-L379 WeakPolarHBondContact O-CG 3.18Å; K375-L379 PolarHBondContact O-N 3.12Å; K376-L379 PolarHBondContact O-N 3.22Å; I377-L379 PolarHBondContact O-N 3.5Å; L379-K381 VanDerWaalsContact C-N 3.25Å; L379-K381 PolarHBondContact O-N 3.3Å
380	G	74.1	Confident	79.5	Confident	66 Å²	66	111.4 Å²	111.4	68%	0.68	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.2	22.3	179.2	0	0	0	0	0	114.4	K376 I377 D378	K376-G380 PolarHBondContact O-N 3.09Å; I377-G380 PolarHBondContact O-N 3.5Å; D378-G380 VanDerWaalsContact C-N 3.28Å; D378-G380 PolarHBondContact O-N 3.25Å
381	K	66.7	Low	78.9	Confident	168 Å²	168	115.7 Å²	115.7	73%	0.73	61%	0.611	S	S	*	*			trans	-96.8	9.8	-176	-74.9	-172.2	177.2	-177	0	114.3	K376 L379	K376-K381 PolarHBondContact O-N 3.45Å; K376-K381 VanDerWaalsContact O-N 3.09Å; L379-K381 VanDerWaalsContact C-N 3.25Å; L379-K381 PolarHBondContact O-N 3.3Å
382	T	55.9	Low	78.2	Confident	73 Å²	73	112.3 Å²	112.3	45%	0.448	61%	0.613	S	S	.	*			trans	-109.1	96.9	176	48	0	0	0	0	109	K376 I377	K376-T382 HydrophobicContact CB-CG2 4.16Å; I377-T382 HydrophobicContact CG1-CG2 3.95Å
383	T	49.8	Very low	77.2	Confident	214 Å²	214	117.9 Å²	117.9	100%	1.313	63%	0.63	S	S	*	*			trans	-73.3	0	155.4	48.3	0	0	0	0	110.4

Retrieved 383 of 383 residues in 457.8 ms (Link to these results)

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