A0A077Z9N2_TRITR Loading...

Methylmalonic aciduria type A protein

AlphaFold DB , UniProt , Accession A0A077Z9N2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 410 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	35.9	Very low	39.9	Very low	158 Å²	158	96.5 Å²	96.5	78%	0.778	48%	0.48	S	S	*	.				0	-55.8	0	-96.3	167.6	-166.2	0	0	111.9	C3 K4 H5 L57	M1-C3 VanDerWaalsContact C-N 3.34Å; M1-C3 PolarHBondContact O-N 2.75Å; M1-K4 PolarHBondContact O-N 3.4Å; M1-H5 PolarHBondContact O-CD2 2.65Å; M1-H5 VanDerWaalsContact O-CD2 3.3Å; M1-H5 PolarHBondContact O-N 3.46Å; M1-L57 HydrophobicContact CE-CD2 4.21Å; M1-L57 HydrophobicContact SD-CD2 4.43Å
2	L	34.3	Very low	40.3	Very low	109 Å²	109	91.6 Å²	91.6	57%	0.571	46%	0.46	S	S	*	.	H	α-helix	trans	-49.9	-45.9	179.9	-118.2	89.8	0	0	0	114.2	K4 H5 L6	L2-K4 PolarHBondContact O-N 2.73Å; L2-H5 PolarHBondContact O-N 2.89Å; L2-L6 WeakPolarHBondContact O-CB 3.38Å; L2-L6 WeakPolarHBondContact O-CG 3.28Å; L2-L6 PolarHBondContact O-N 2.97Å
3	C	34.4	Very low	40.8	Very low	104 Å²	104	88.4 Å²	88.4	70%	0.703	44%	0.441	S	S	*	.	H	α-helix	trans	-63.6	-35.4	178.9	-67.5	0	0	0	0	114.2	M1 H5 W7	M1-C3 VanDerWaalsContact C-N 3.34Å; M1-C3 PolarHBondContact O-N 2.75Å; C3-H5 VanDerWaalsContact C-N 3.32Å; C3-W7 VanDerWaalsContact O-CB 3.23Å; C3-W7 WeakPolarHBondContact O-CB 3.37Å; C3-W7 PolarHBondContact O-N 2.97Å
4	K	37.2	Very low	41.1	Very low	165 Å²	165	84.6 Å²	84.6	72%	0.717	42%	0.421	S	S	*	.	H	α-helix	trans	-68.8	-34	176.1	-85.7	-174.7	175.2	-178.6	0	111.3	M1 L2 W7 R8	M1-K4 PolarHBondContact O-N 3.4Å; L2-K4 PolarHBondContact O-N 2.73Å; K4-W7 PolarHBondContact O-N 3.19Å; K4-R8 PolarHBondContact O-N 3.3Å
5	H	46	Very low	41	Very low	34 Å²	34	83.4 Å²	83.4	16%	0.157	44%	0.438	C	S	.	.	H	α-helix	trans	-79.8	-39.7	178.2	-69	-57.4	0	0	0	113	M1 L2 C3 W7 R8 A9 Y60 D66	M1-H5 PolarHBondContact O-CD2 2.65Å; M1-H5 VanDerWaalsContact O-CD2 3.3Å; M1-H5 PolarHBondContact O-N 3.46Å; L2-H5 PolarHBondContact O-N 2.89Å; C3-H5 VanDerWaalsContact C-N 3.32Å; H5-W7 PolarHBondContact O-N 3.48Å; H5-R8 PolarHBondContact O-N 3.07Å; H5-A9 VanDerWaalsContact O-CB 3.25Å; H5-A9 WeakPolarHBondContact O-CB 2.9Å; H5-A9 PolarHBondContact O-N 3.11Å; H5-Y60 AromaticContact CE1-CE2 3.59Å; H5-Y60 AromaticContact NE2-CD2 3.83Å; H5-Y60 AromaticContact NE2-CE2 3.38Å; H5-Y60 WeakPolarHBondContact NE2-CE2 3.38Å; H5-D66 IonicContact CE1-OD1 2.99Å; H5-D66 IonicContact CE1-OD2 2.57Å
6	L	41	Very low	41	Very low	76 Å²	76	83.4 Å²	83.4	40%	0.398	45%	0.454	S	S	.	.	H	α-helix	trans	-56.4	-40.5	167.2	-74.7	168.1	0	0	0	110	L2 A10 V361	L2-L6 WeakPolarHBondContact O-CB 3.38Å; L2-L6 WeakPolarHBondContact O-CG 3.28Å; L2-L6 PolarHBondContact O-N 2.97Å; L6-A10 WeakPolarHBondContact O-CB 3.27Å; L6-A10 PolarHBondContact O-N 2.62Å; L6-V361 HydrophobicContact CD2-CG1 4.4Å; L6-V361 HydrophobicContact CD2-CG2 3.8Å
7	W	44	Very low	41.1	Very low	190 Å²	190	81.6 Å²	81.6	72%	0.72	45%	0.449	S	S	*	.	H	α-helix	trans	-69.9	-35.9	176.4	-160.2	83.7	0	0	0	113.7	C3 K4 H5 A11	C3-W7 VanDerWaalsContact O-CB 3.23Å; C3-W7 WeakPolarHBondContact O-CB 3.37Å; C3-W7 PolarHBondContact O-N 2.97Å; K4-W7 PolarHBondContact O-N 3.19Å; H5-W7 PolarHBondContact O-N 3.48Å; W7-A11 HydrophobicContact CE3-CB 4.28Å; W7-A11 HydrophobicContact CZ3-CB 4.34Å; W7-A11 WeakPolarHBondContact O-CA 3.43Å; W7-A11 WeakPolarHBondContact O-CB 3.28Å; W7-A11 PolarHBondContact O-N 3.03Å
8	R	42.4	Very low	41.1	Very low	141 Å²	141	83.9 Å²	83.9	53%	0.532	46%	0.461	S	S	.	.	H	α-helix	trans	-75.8	-36.1	175.2	-82.5	-175.4	174.8	168	0	113.4	K4 H5 A10 P12 D66	K4-R8 PolarHBondContact O-N 3.3Å; H5-R8 PolarHBondContact O-N 3.07Å; R8-A10 VanDerWaalsContact C-N 3.29Å; R8-P12 WeakPolarHBondContact O-CD 3.35Å; R8-D66 IonicContact CZ-OD2 2.72Å; R8-D66 IonicContact NH1-OD1 2.79Å; R8-D66 PolarHBondContact NH1-OD1 2.94Å; R8-D66 IonicContact NH1-OD2 3.73Å; R8-D66 PolarHBondContact NH1-OD2 3Å
9	A	41.5	Very low	41.2	Very low	39 Å²	39	83.2 Å²	83.2	32%	0.322	47%	0.467	S	S	.	.	H	α-helix	trans	-67.1	-36.5	171.7	0	0	0	0	0	110.3	H5 F13	H5-A9 VanDerWaalsContact O-CB 3.25Å; H5-A9 WeakPolarHBondContact O-CB 2.9Å; H5-A9 PolarHBondContact O-N 3.11Å; A9-F13 WeakPolarHBondContact O-CD2 3.28Å; A9-F13 WeakPolarHBondContact O-CE2 3.36Å
10	A	40	Very low	41.1	Very low	10 Å²	10	82.1 Å²	82.1	8%	0.083	46%	0.46	C	S	.	.	H	α-helix	trans	-70.7	-47	171.9	0	0	0	0	0	112.3	L6 R8 P12 F13 F14 M357	L6-A10 WeakPolarHBondContact O-CB 3.27Å; L6-A10 PolarHBondContact O-N 2.62Å; R8-A10 VanDerWaalsContact C-N 3.29Å; A10-P12 VanDerWaalsContact C-CD 3.43Å; A10-P12 WeakPolarHBondContact O-CD 3.21Å; A10-P12 VanDerWaalsContact O-N 3.08Å; A10-F13 WeakPolarHBondContact O-CA 3.35Å; A10-F13 WeakPolarHBondContact O-CB 3.34Å; A10-F13 WeakPolarHBondContact O-CD2 3.34Å; A10-F13 PolarHBondContact O-N 3.2Å; A10-F14 VanDerWaalsContact C-CD2 3.49Å; A10-F14 HydrophobicContact CB-CD2 3.73Å; A10-F14 HydrophobicContact CB-CE2 3.31Å; A10-F14 HydrophobicContact CB-CZ 4.31Å; A10-F14 WeakPolarHBondContact O-CD2 3.49Å; A10-F14 WeakPolarHBondContact O-CE2 3.33Å; A10-M357 HydrophobicContact CB-SD 3.92Å
11	A	41.8	Very low	41	Very low	36 Å²	36	83.9 Å²	83.9	30%	0.298	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-51.2	-39.8	-162.4	0	0	0	0	0	116.4	W7 F13 F14	W7-A11 HydrophobicContact CE3-CB 4.28Å; W7-A11 HydrophobicContact CZ3-CB 4.34Å; W7-A11 WeakPolarHBondContact O-CA 3.43Å; W7-A11 WeakPolarHBondContact O-CB 3.28Å; W7-A11 PolarHBondContact O-N 3.03Å; A11-F13 PolarHBondContact O-N 2.6Å; A11-F14 PolarHBondContact O-N 3.15Å
12	P	45.2	Very low	41.2	Very low	37 Å²	37	85.7 Å²	85.7	24%	0.24	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-60.6	-24.8	173.9	-21.9	31.2	0	0	0	113.9	R8 A10 Q113 L116	R8-P12 WeakPolarHBondContact O-CD 3.35Å; A10-P12 VanDerWaalsContact C-CD 3.43Å; A10-P12 WeakPolarHBondContact O-CD 3.21Å; A10-P12 VanDerWaalsContact O-N 3.08Å; P12-Q113 HydrophobicContact CB-CG 4.36Å; P12-Q113 HydrophobicContact CG-CG 4.26Å; P12-L116 HydrophobicContact CB-CD1 3.97Å
13	F	46.6	Very low	41.4	Very low	50 Å²	50	83.3 Å²	83.3	22%	0.219	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-89.1	-16.8	-174.4	-57.4	-108.2	0	0	0	113.1	A9 A10 A11 M353 W356 M357	A9-F13 WeakPolarHBondContact O-CD2 3.28Å; A9-F13 WeakPolarHBondContact O-CE2 3.36Å; A10-F13 WeakPolarHBondContact O-CA 3.35Å; A10-F13 WeakPolarHBondContact O-CB 3.34Å; A10-F13 WeakPolarHBondContact O-CD2 3.34Å; A10-F13 PolarHBondContact O-N 3.2Å; A11-F13 PolarHBondContact O-N 2.6Å; F13-M353 HydrophobicContact CD1-CB 4.06Å; F13-M353 HydrophobicContact CD1-CE 3.43Å; F13-M353 VanDerWaalsContact CD1-CE 3.43Å; F13-M353 WeakPolarHBondContact CD1-O 3.43Å; F13-M353 HydrophobicContact CD1-SD 4.34Å; F13-M353 HydrophobicContact CE1-CE 3.64Å; F13-M353 HydrophobicContact CE1-SD 4.35Å; F13-M353 HydrophobicContact CG-CE 4.2Å; F13-W356 HydrophobicContact CD1-CE3 4.48Å; F13-W356 AromaticContact CE1-CD2 3.88Å; F13-W356 HydrophobicContact CE1-CD2 3.88Å; F13-W356 AromaticContact CE1-CE3 3.35Å; F13-W356 HydrophobicContact CE1-CE3 3.35Å; F13-W356 HydrophobicContact CE1-CH2 4.22Å; F13-W356 AromaticContact CE1-CZ3 3.55Å; F13-W356 HydrophobicContact CE1-CZ3 3.55Å; F13-W356 HydrophobicContact CZ-CD2 4.17Å; F13-W356 AromaticContact CZ-CE3 3.84Å; F13-W356 HydrophobicContact CZ-CE3 3.84Å; F13-W356 AromaticContact CZ-CH2 3.89Å; F13-W356 HydrophobicContact CZ-CH2 3.89Å; F13-W356 HydrophobicContact CZ-CZ2 4.24Å; F13-W356 AromaticContact CZ-CZ3 3.69Å; F13-W356 HydrophobicContact CZ-CZ3 3.69Å; F13-M357 HydrophobicContact CD1-CB 4.43Å
14	F	45.7	Very low	41.7	Very low	36 Å²	36	81.9 Å²	81.9	16%	0.158	44%	0.438	C	S	.	.			trans	-99.3	24.9	-174.4	-66.7	-89.2	0	0	0	114.7	A10 A11 A16 L20 I24 M357	A10-F14 VanDerWaalsContact C-CD2 3.49Å; A10-F14 HydrophobicContact CB-CD2 3.73Å; A10-F14 HydrophobicContact CB-CE2 3.31Å; A10-F14 HydrophobicContact CB-CZ 4.31Å; A10-F14 WeakPolarHBondContact O-CD2 3.49Å; A10-F14 WeakPolarHBondContact O-CE2 3.33Å; A11-F14 PolarHBondContact O-N 3.15Å; F14-A16 PolarHBondContact O-N 2.78Å; F14-L20 HydrophobicContact CD1-CB 4.03Å; F14-L20 HydrophobicContact CD1-CD2 4.16Å; F14-L20 HydrophobicContact CE1-CB 3.79Å; F14-L20 HydrophobicContact CE1-CD2 3.41Å; F14-L20 VanDerWaalsContact CE1-CD2 3.41Å; F14-L20 HydrophobicContact CE1-CG 3.94Å; F14-L20 HydrophobicContact CZ-CD2 4.02Å; F14-I24 HydrophobicContact CE1-CD1 3.43Å; F14-I24 VanDerWaalsContact CE1-CD1 3.43Å; F14-I24 HydrophobicContact CE2-CD1 4.25Å; F14-I24 HydrophobicContact CZ-CD1 3.23Å; F14-M357 HydrophobicContact CE2-SD 3.98Å; F14-M357 HydrophobicContact CZ-SD 4.15Å
15	G	39	Very low	41.8	Very low	66 Å²	66	78.1 Å²	78.1	68%	0.68	43%	0.431	S	S	*	.	S	Bend	trans	-65.6	102.3	169.3	0	0	0	0	0	111.3
16	A	41.3	Very low	41.4	Very low	83 Å²	83	79.4 Å²	79.4	69%	0.686	44%	0.444	S	S	*	.	S	Bend	trans	96.1	1.3	163.6	0	0	0	0	0	121.1	F14	F14-A16 PolarHBondContact O-N 2.78Å
17	S	42.7	Very low	41.2	Very low	53 Å²	53	79.4 Å²	79.4	37%	0.371	45%	0.447	S	S	.	.			trans	-111.5	106.8	173.2	-179.4	0	0	0	0	113.8	A19	S17-A19 PolarHBondContact O-N 3.2Å; S17-A19 PolarHBondContact OG-N 3.08Å
18	N	41.8	Very low	40.8	Very low	124 Å²	124	73.5 Å²	73.5	66%	0.663	44%	0.439	S	S	*	.	H	α-helix	trans	-66.4	-17.1	170.8	-85.2	-24.8	0	0	0	113.2
19	A	42.3	Very low	40.6	Very low	70 Å²	70	73.2 Å²	73.2	58%	0.579	44%	0.439	S	S	*	.	H	α-helix	trans	-75.2	-37.5	-179.4	0	0	0	0	0	112.3	S17 R22 S23	S17-A19 PolarHBondContact O-N 3.2Å; S17-A19 PolarHBondContact OG-N 3.08Å; A19-R22 PolarHBondContact O-N 2.85Å; A19-S23 PolarHBondContact O-N 3.39Å
20	L	39.5	Very low	40.4	Very low	61 Å²	61	74.3 Å²	74.3	32%	0.319	44%	0.444	S	S	.	.	H	α-helix	trans	-76.6	-31.6	-180	-129.3	77.7	0	0	0	112.6	F14 R22 S23 I24	F14-L20 HydrophobicContact CD1-CB 4.03Å; F14-L20 HydrophobicContact CD1-CD2 4.16Å; F14-L20 HydrophobicContact CE1-CB 3.79Å; F14-L20 HydrophobicContact CE1-CD2 3.41Å; F14-L20 VanDerWaalsContact CE1-CD2 3.41Å; F14-L20 HydrophobicContact CE1-CG 3.94Å; F14-L20 HydrophobicContact CZ-CD2 4.02Å; L20-R22 PolarHBondContact O-N 3.01Å; L20-S23 PolarHBondContact O-N 3.33Å; L20-S23 VanDerWaalsContact O-N 3.16Å; L20-I24 PolarHBondContact O-N 2.85Å
21	K	39.2	Very low	40.4	Very low	119 Å²	119	80.1 Å²	80.1	52%	0.517	47%	0.474	S	S	.	.	H	α-helix	trans	-56.9	-38.2	168.4	-75.7	-177.6	179.4	176.1	0	111.7	C25	K21-C25 VanDerWaalsContact O-CB 3.27Å; K21-C25 WeakPolarHBondContact O-CB 3.39Å; K21-C25 PolarHBondContact O-N 3.36Å; K21-C25 VanDerWaalsContact O-N 3.14Å
22	R	40.1	Very low	40.1	Very low	197 Å²	197	82.5 Å²	82.5	74%	0.743	49%	0.488	S	S	*	.	H	α-helix	trans	-72.6	-34.8	176.5	-72	-176.1	-174	-164.7	2	112.5	A19 L20 S26	A19-R22 PolarHBondContact O-N 2.85Å; L20-R22 PolarHBondContact O-N 3.01Å; R22-S26 WeakPolarHBondContact O-CA 3.46Å; R22-S26 WeakPolarHBondContact O-CB 3.5Å; R22-S26 PolarHBondContact O-N 2.88Å; R22-S26 PolarHBondContact O-OG 2.9Å; R22-S26 VanDerWaalsContact O-OG 3.13Å
23	S	38.1	Very low	39.7	Very low	59 Å²	59	87.5 Å²	87.5	41%	0.413	51%	0.506	S	S	.	.	H	α-helix	trans	-70.1	-43.7	178.7	178.6	0	0	0	0	112.6	A19 L20 S26 T27	A19-S23 PolarHBondContact O-N 3.39Å; L20-S23 PolarHBondContact O-N 3.33Å; L20-S23 VanDerWaalsContact O-N 3.16Å; S23-S26 WeakPolarHBondContact CA-OG 3.49Å; S23-S26 PolarHBondContact O-N 2.76Å; S23-S26 PolarHBondContact O-OG 3.09Å; S23-T27 PolarHBondContact O-N 3.27Å; S23-T27 PolarHBondContact O-OG1 3.19Å
24	I	40.6	Very low	39.3	Very low	73 Å²	73	88.5 Å²	88.5	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-71.7	-40.2	178.5	-63.9	175.1	0	0	0	111	F14 L20 S26 A28	F14-I24 HydrophobicContact CE1-CD1 3.43Å; F14-I24 VanDerWaalsContact CE1-CD1 3.43Å; F14-I24 HydrophobicContact CE2-CD1 4.25Å; F14-I24 HydrophobicContact CZ-CD1 3.23Å; L20-I24 PolarHBondContact O-N 2.85Å; I24-S26 VanDerWaalsContact C-N 3.34Å; I24-A28 WeakPolarHBondContact O-CB 3.34Å; I24-A28 PolarHBondContact O-N 3.24Å; I24-A28 VanDerWaalsContact O-N 3.08Å
25	C	38.3	Very low	38.7	Very low	86 Å²	86	90.2 Å²	90.2	58%	0.581	55%	0.551	S	S	*	*	H	α-helix	trans	-65.9	-36	169.6	-80.9	0	0	0	0	111.7	K21 Y29	K21-C25 VanDerWaalsContact O-CB 3.27Å; K21-C25 WeakPolarHBondContact O-CB 3.39Å; K21-C25 PolarHBondContact O-N 3.36Å; K21-C25 VanDerWaalsContact O-N 3.14Å; C25-Y29 WeakPolarHBondContact O-CA 3.17Å; C25-Y29 WeakPolarHBondContact O-CB 3.11Å; C25-Y29 PolarHBondContact O-N 3.26Å
26	S	37.7	Very low	38.6	Very low	61 Å²	61	95.2 Å²	95.2	43%	0.427	56%	0.557	S	S	.	*	H	α-helix	trans	-72.3	-31.3	179.9	71.7	0	0	0	0	112.4	R22 S23 I24 S30	R22-S26 WeakPolarHBondContact O-CA 3.46Å; R22-S26 WeakPolarHBondContact O-CB 3.5Å; R22-S26 PolarHBondContact O-N 2.88Å; R22-S26 PolarHBondContact O-OG 2.9Å; R22-S26 VanDerWaalsContact O-OG 3.13Å; S23-S26 WeakPolarHBondContact CA-OG 3.49Å; S23-S26 PolarHBondContact O-N 2.76Å; S23-S26 PolarHBondContact O-OG 3.09Å; I24-S26 VanDerWaalsContact C-N 3.34Å; S26-S30 WeakPolarHBondContact O-CA 3.44Å; S26-S30 WeakPolarHBondContact O-CB 3.41Å; S26-S30 PolarHBondContact O-N 3.48Å; S26-S30 PolarHBondContact O-OG 3.38Å
27	T	36.9	Very low	38.2	Very low	76 Å²	76	98.8 Å²	98.8	47%	0.466	56%	0.557	S	S	.	*	H	α-helix	trans	-76.3	-37.1	175.5	-52.4	0	0	0	0	111	S23 S30 L31	S23-T27 PolarHBondContact O-N 3.27Å; S23-T27 PolarHBondContact O-OG1 3.19Å; T27-S30 WeakPolarHBondContact CA-OG 3.49Å; T27-S30 PolarHBondContact O-OG 2.95Å; T27-L31 HydrophobicContact CG2-CD1 4.46Å; T27-L31 WeakPolarHBondContact O-CB 3.48Å; T27-L31 VanDerWaalsContact O-CD1 3.31Å; T27-L31 WeakPolarHBondContact O-CD1 3.21Å; T27-L31 WeakPolarHBondContact O-CG 3.29Å; T27-L31 PolarHBondContact O-N 3.44Å
28	A	36.3	Very low	37.6	Very low	67 Å²	67	101.8 Å²	101.8	55%	0.554	58%	0.575	S	S	*	*	H	α-helix	trans	-70.1	-31.3	171.5	0	0	0	0	0	113	I24 S32	I24-A28 WeakPolarHBondContact O-CB 3.34Å; I24-A28 PolarHBondContact O-N 3.24Å; I24-A28 VanDerWaalsContact O-N 3.08Å; A28-S32 PolarHBondContact O-N 2.94Å
29	Y	37.5	Very low	37.1	Very low	134 Å²	134	99.9 Å²	99.9	53%	0.525	58%	0.577	S	S	.	*	H	α-helix	trans	-88.9	-28.1	179.9	-166.8	-107	0	0	0	112.9	C25 S32 K33	C25-Y29 WeakPolarHBondContact O-CA 3.17Å; C25-Y29 WeakPolarHBondContact O-CB 3.11Å; C25-Y29 PolarHBondContact O-N 3.26Å; Y29-S32 CarbonylContact O-C 3.54Å; Y29-S32 PolarHBondContact O-N 3.49Å; Y29-S32 PolarHBondContact O-OG 2.9Å; Y29-K33 HydrophobicContact CD1-CD 4.19Å; Y29-K33 HydrophobicContact CD1-CG 4.49Å; Y29-K33 HydrophobicContact CE1-CD 3.58Å; Y29-K33 HydrophobicContact CE1-CG 4.21Å; Y29-K33 WeakPolarHBondContact O-CB 3.46Å; Y29-K33 PolarHBondContact O-N 3.4Å; Y29-K33 WeakPolarHBondContact OH-CE 3.41Å; Y29-K33 PolarHBondContact OH-NZ 3.14Å
30	S	37.5	Very low	36.6	Very low	62 Å²	62	103.4 Å²	103.4	43%	0.434	58%	0.579	S	S	.	*	H	α-helix	trans	-73	-36.2	172.8	64.9	0	0	0	0	111.1	S26 T27 S32 K33 A34	S26-S30 WeakPolarHBondContact O-CA 3.44Å; S26-S30 WeakPolarHBondContact O-CB 3.41Å; S26-S30 PolarHBondContact O-N 3.48Å; S26-S30 PolarHBondContact O-OG 3.38Å; T27-S30 WeakPolarHBondContact CA-OG 3.49Å; T27-S30 PolarHBondContact O-OG 2.95Å; S30-S32 PolarHBondContact O-N 3.05Å; S30-K33 PolarHBondContact O-N 3.43Å; S30-A34 VanDerWaalsContact O-CB 3.31Å; S30-A34 WeakPolarHBondContact O-CB 3.03Å; S30-A34 PolarHBondContact O-N 3.36Å
31	L	39.6	Very low	36.1	Very low	133 Å²	133	107.7 Å²	107.7	70%	0.696	60%	0.603	S	S	*	*	H	α-helix	trans	-64	-25.3	167.9	-71.7	169.6	0	0	0	112.4	T27	T27-L31 HydrophobicContact CG2-CD1 4.46Å; T27-L31 WeakPolarHBondContact O-CB 3.48Å; T27-L31 VanDerWaalsContact O-CD1 3.31Å; T27-L31 WeakPolarHBondContact O-CD1 3.21Å; T27-L31 WeakPolarHBondContact O-CG 3.29Å; T27-L31 PolarHBondContact O-N 3.44Å
32	S	35.9	Very low	35.7	Very low	85 Å²	85	109.3 Å²	109.3	59%	0.594	62%	0.617	S	S	*	*	H	α-helix	trans	-91.5	-18.7	176.2	107.2	0	0	0	0	114.4	A28 Y29 S30	A28-S32 PolarHBondContact O-N 2.94Å; Y29-S32 CarbonylContact O-C 3.54Å; Y29-S32 PolarHBondContact O-N 3.49Å; Y29-S32 PolarHBondContact O-OG 2.9Å; S30-S32 PolarHBondContact O-N 3.05Å
33	K	37.2	Very low	35.1	Very low	143 Å²	143	111.6 Å²	111.6	62%	0.622	63%	0.625	S	S	*	*	H	α-helix	trans	-108.3	-6.9	-177.2	-92.1	-160.2	173.1	-173.4	0	115.5	Y29 S30 G35	Y29-K33 HydrophobicContact CD1-CD 4.19Å; Y29-K33 HydrophobicContact CD1-CG 4.49Å; Y29-K33 HydrophobicContact CE1-CD 3.58Å; Y29-K33 HydrophobicContact CE1-CG 4.21Å; Y29-K33 WeakPolarHBondContact O-CB 3.46Å; Y29-K33 PolarHBondContact O-N 3.4Å; Y29-K33 WeakPolarHBondContact OH-CE 3.41Å; Y29-K33 PolarHBondContact OH-NZ 3.14Å; S30-K33 PolarHBondContact O-N 3.43Å; K33-G35 PolarHBondContact O-N 3.27Å; K33-G35 VanDerWaalsContact O-N 3.16Å
34	A	38.9	Very low	34.7	Very low	71 Å²	71	112.2 Å²	112.2	59%	0.587	63%	0.629	S	S	*	*	S	Bend	trans	-76	11.6	179	0	0	0	0	0	115.2	S30 Q36	S30-A34 VanDerWaalsContact O-CB 3.31Å; S30-A34 WeakPolarHBondContact O-CB 3.03Å; S30-A34 PolarHBondContact O-N 3.36Å; A34-Q36 PolarHBondContact O-N 3.31Å
35	G	31.7	Very low	34	Very low	71 Å²	71	112 Å²	112	73%	0.732	65%	0.645	S	S	*	*	S	Bend	trans	63.9	8.8	164.8	0	0	0	0	0	116.9	K33	K33-G35 PolarHBondContact O-N 3.27Å; K33-G35 VanDerWaalsContact O-N 3.16Å
36	Q	37.5	Very low	33.8	Very low	172 Å²	172	114.8 Å²	114.8	80%	0.804	65%	0.653	S	S	*	*			trans	-94.6	5.8	179	-80.7	-175.7	-17.1	0	0	114.4	A34	A34-Q36 PolarHBondContact O-N 3.31Å
37	F	34.1	Very low	33.5	Very low	157 Å²	157	120.9 Å²	120.9	69%	0.689	68%	0.675	S	S	*	*			trans	-126.3	83.9	169.7	-79.4	-81.5	0	0	0	110.4	A39 F40	F37-A39 PolarHBondContact O-N 3.12Å; F37-F40 AromaticContact CD1-CD2 3.95Å; F37-F40 HydrophobicContact CD1-CD2 3.95Å; F37-F40 HydrophobicContact CD1-CE2 4.44Å; F37-F40 HydrophobicContact CE1-CD2 4.26Å; F37-F40 HydrophobicContact CE1-CE2 4.29Å
38	P	29.4	Very low	33.6	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	69%	0.687	S	S	*	*	S	Bend	trans	-71.5	125	162.8	25.7	-19.1	0	0	0	108.2
39	A	30.8	Very low	33.7	Very low	85 Å²	85	128.5 Å²	128.5	70%	0.702	69%	0.694	S	S	*	*			trans	60.9	65.1	167.1	0	0	0	0	0	117	F37 N41	F37-A39 PolarHBondContact O-N 3.12Å; A39-N41 PolarHBondContact O-N 3.31Å
40	F	32	Very low	34.1	Very low	144 Å²	144	129.9 Å²	129.9	63%	0.632	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	58.6	159.3	-141.3	-84.8	0	0	0	110	F37	F37-F40 AromaticContact CD1-CD2 3.95Å; F37-F40 HydrophobicContact CD1-CD2 3.95Å; F37-F40 HydrophobicContact CD1-CE2 4.44Å; F37-F40 HydrophobicContact CE1-CD2 4.26Å; F37-F40 HydrophobicContact CE1-CE2 4.29Å
41	N	29.9	Very low	34.6	Very low	151 Å²	151	133.7 Å²	133.7	81%	0.807	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.7	-2.3	171	-124.3	16.5	0	0	0	116.1	A39	A39-N41 PolarHBondContact O-N 3.31Å
42	D	29.2	Very low	34.9	Very low	153 Å²	153	129.8 Å²	129.8	82%	0.818	70%	0.696	S	S	*	*	S	Bend	trans	-137.8	15.9	-178.8	-77.7	-43	0	0	0	115.6
43	R	28.9	Very low	35.8	Very low	245 Å²	245	133.3 Å²	133.3	93%	0.925	70%	0.7	S	S	*	*	S	Bend	trans	-142	17.9	174.3	-68.4	-167.9	-165	-173.6	4.9	115.6
44	C	28.8	Very low	36.7	Very low	71 Å²	71	130.8 Å²	130.8	48%	0.48	69%	0.694	S	S	.	*			trans	-93.6	105	165.8	-138.3	0	0	0	0	106.6	L46	C44-L46 HydrophobicContact CB-CD1 3.94Å; C44-L46 HydrophobicContact CB-CG 3.97Å; C44-L46 PolarHBondContact O-N 2.9Å; C44-L46 WeakPolarHBondContact SG-CD1 3.46Å; C44-L46 WeakPolarHBondContact SG-CG 3.15Å
45	G	27.1	Very low	37.6	Very low	69 Å²	69	130.6 Å²	130.6	71%	0.711	68%	0.683	S	S	*	*			trans	-65.4	43.7	170.7	0	0	0	0	0	112.9	E47	G45-E47 PolarHBondContact O-N 2.82Å; G45-E47 VanDerWaalsContact O-N 3.1Å
46	L	34	Very low	39.3	Very low	144 Å²	144	132 Å²	132	75%	0.754	67%	0.673	S	S	*	*			trans	-80.5	33.2	174.6	-66.5	173.6	0	0	0	111.3	C44	C44-L46 HydrophobicContact CB-CD1 3.94Å; C44-L46 HydrophobicContact CB-CG 3.97Å; C44-L46 PolarHBondContact O-N 2.9Å; C44-L46 WeakPolarHBondContact SG-CD1 3.46Å; C44-L46 WeakPolarHBondContact SG-CG 3.15Å
47	E	31.3	Very low	40.6	Very low	190 Å²	190	126 Å²	126	89%	0.888	65%	0.646	S	S	*	*			trans	-103.9	43.5	160.1	-69.8	-167	158	0	0	109.3	G45	G45-E47 PolarHBondContact O-N 2.82Å; G45-E47 VanDerWaalsContact O-N 3.1Å
48	Q	37.4	Very low	42.2	Very low	153 Å²	153	121.3 Å²	121.3	72%	0.715	63%	0.628	S	S	*	*			trans	-140.2	107.9	171.7	-73.5	-167.1	-23.8	0	0	112.7
49	E	39.2	Very low	44	Very low	149 Å²	149	116.7 Å²	116.7	70%	0.696	60%	0.596	S	S	*	*			trans	83.3	118	136.8	-61.8	-179.1	170.5	0	0	120.6	Q51	E49-Q51 PolarHBondContact O-N 2.59Å
50	E	46.5	Very low	45.8	Very low	163 Å²	163	114.9 Å²	114.9	76%	0.762	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46	-28.8	-178.9	-71.8	172.2	138.7	0	0	115.2	N52 K53 D54	E50-N52 VanDerWaalsContact C-N 3.25Å; E50-N52 PolarHBondContact O-N 3.3Å; E50-K53 PolarHBondContact O-N 2.94Å; E50-K53 VanDerWaalsContact O-N 3.13Å; E50-D54 PolarHBondContact O-N 3.43Å
51	Q	47.5	Very low	47.6	Very low	142 Å²	142	116.7 Å²	116.7	66%	0.664	57%	0.574	S	S	*	*	H	α-helix	trans	-57.9	-27.8	-173.8	-76.3	-178	-9.5	0	0	115.2	E49 N55	E49-Q51 PolarHBondContact O-N 2.59Å; Q51-N55 PolarHBondContact O-N 2.84Å
52	N	46.8	Very low	49.4	Very low	51 Å²	51	116.8 Å²	116.8	27%	0.273	56%	0.563	S	S	.	*	H	α-helix	trans	-88.4	-25.9	-179	-144.9	26.5	0	0	0	113.5	E50 L56 R406	E50-N52 VanDerWaalsContact C-N 3.25Å; E50-N52 PolarHBondContact O-N 3.3Å; N52-L56 PolarHBondContact O-N 3.29Å; N52-R406 VanDerWaalsContact CG-CZ 3.43Å; N52-R406 PolarHBondContact ND2-NH2 2.94Å; N52-R406 PolarHBondContact OD1-NH2 2.93Å
53	K	52.8	Low	51.3	Low	160 Å²	160	113.1 Å²	113.1	70%	0.696	54%	0.54	S	S	*	.	H	α-helix	trans	-61.7	-41.1	165.3	-81	178.1	178.9	170.1	0	108.7	E50 N55 L56 L57	E50-K53 PolarHBondContact O-N 2.94Å; E50-K53 VanDerWaalsContact O-N 3.13Å; K53-N55 PolarHBondContact O-N 3.07Å; K53-L56 PolarHBondContact O-N 2.91Å; K53-L57 HydrophobicContact CB-CD1 4.15Å; K53-L57 WeakPolarHBondContact O-CB 3.32Å; K53-L57 WeakPolarHBondContact O-CD1 3.07Å; K53-L57 WeakPolarHBondContact O-CG 3.48Å; K53-L57 PolarHBondContact O-N 2.92Å
54	D	57.8	Low	53.7	Low	90 Å²	90	105.3 Å²	105.3	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-41.6	-178.2	-64.2	-25.4	0	0	0	113.4	E50 L57 D58	E50-D54 PolarHBondContact O-N 3.43Å; D54-L57 PolarHBondContact O-N 3.39Å; D54-D58 WeakPolarHBondContact O-CB 3.49Å; D54-D58 PolarHBondContact O-N 3.48Å
55	N	57.8	Low	56.3	Low	66 Å²	66	102.6 Å²	102.6	35%	0.353	49%	0.492	S	S	.	.	H	α-helix	trans	-67.7	-42.4	179.7	-70.9	-30.4	0	0	0	113.3	Q51 K53 Y59	Q51-N55 PolarHBondContact O-N 2.84Å; K53-N55 PolarHBondContact O-N 3.07Å; N55-Y59 PolarHBondContact O-N 3.44Å
56	L	66.5	Low	59	Low	101 Å²	101	102.7 Å²	102.7	53%	0.529	48%	0.476	S	S	.	.	H	α-helix	trans	-71.1	-34.7	175.6	-73.2	173.8	0	0	0	111.6	N52 K53 Y60	N52-L56 PolarHBondContact O-N 3.29Å; K53-L56 PolarHBondContact O-N 2.91Å; L56-Y60 WeakPolarHBondContact O-CB 3.46Å; L56-Y60 PolarHBondContact O-N 2.76Å
57	L	65.5	Low	61.5	Low	47 Å²	47	105.1 Å²	105.1	25%	0.246	48%	0.475	C	S	.	.	H	α-helix	trans	-68.2	-37.5	174.6	-74.4	169.2	0	0	0	111.9	M1 K53 D54 Y60 R61	M1-L57 HydrophobicContact CE-CD2 4.21Å; M1-L57 HydrophobicContact SD-CD2 4.43Å; K53-L57 HydrophobicContact CB-CD1 4.15Å; K53-L57 WeakPolarHBondContact O-CB 3.32Å; K53-L57 WeakPolarHBondContact O-CD1 3.07Å; K53-L57 WeakPolarHBondContact O-CG 3.48Å; K53-L57 PolarHBondContact O-N 2.92Å; D54-L57 PolarHBondContact O-N 3.39Å; L57-Y60 WeakPolarHBondContact O-CB 3.46Å; L57-Y60 PolarHBondContact O-N 3.32Å; L57-R61 WeakPolarHBondContact O-CB 3.32Å; L57-R61 VanDerWaalsContact O-CG 3.25Å; L57-R61 WeakPolarHBondContact O-CG 3.38Å; L57-R61 PolarHBondContact O-N 3.48Å
58	D	67.3	Low	64.3	Low	57 Å²	57	96.5 Å²	96.5	31%	0.305	44%	0.436	S	S	.	.	H	α-helix	trans	-69	-46.6	176.1	175.2	62.8	0	0	0	111.1	D54 Y60 R61 R62	D54-D58 WeakPolarHBondContact O-CB 3.49Å; D54-D58 PolarHBondContact O-N 3.48Å; D58-Y60 PolarHBondContact O-N 3.48Å; D58-R61 PolarHBondContact O-N 2.8Å; D58-R62 VanDerWaalsContact CG-CZ 3.42Å; D58-R62 VanDerWaalsContact CG-NE 3.25Å; D58-R62 VanDerWaalsContact CG-NH2 3.29Å; D58-R62 WeakPolarHBondContact O-CB 3.27Å; D58-R62 VanDerWaalsContact O-CG 3.22Å; D58-R62 WeakPolarHBondContact O-CG 3.1Å; D58-R62 PolarHBondContact O-N 3.48Å; D58-R62 IonicContact OD1-CZ 3.37Å; D58-R62 VanDerWaalsContact OD1-CZ 3.29Å; D58-R62 IonicContact OD1-NE 2.68Å; D58-R62 PolarHBondContact OD1-NE 2.86Å; D58-R62 IonicContact OD1-NH2 3.79Å; D58-R62 PolarHBondContact OD1-NH2 3.05Å; D58-R62 IonicContact OD2-CZ 3.91Å; D58-R62 IonicContact OD2-NE 3.42Å; D58-R62 PolarHBondContact OD2-NE 3.3Å; D58-R62 IonicContact OD2-NH1 3.85Å; D58-R62 PolarHBondContact OD2-NH1 3.41Å; D58-R62 IonicContact OD2-NH2 3.7Å; D58-R62 PolarHBondContact OD2-NH2 2.92Å
59	Y	67.3	Low	66.9	Low	19 Å²	19	92.8 Å²	92.8	8%	0.075	42%	0.421	C	S	.	.	H	α-helix	trans	-55.1	-45.8	168.6	-174.6	-82.5	0	0	0	110.3	N55 R61 R62 H63 W64 L368	N55-Y59 PolarHBondContact O-N 3.44Å; Y59-R61 PolarHBondContact O-N 3.42Å; Y59-R62 PolarHBondContact O-N 3.35Å; Y59-R62 VanDerWaalsContact O-N 3.15Å; Y59-H63 HydrophobicContact CD1-CB 4.31Å; Y59-H63 AromaticContact CD1-CD2 3.57Å; Y59-H63 AromaticContact CD2-CD2 3.35Å; Y59-H63 WeakPolarHBondContact CD2-CD2 3.41Å; Y59-H63 AromaticContact CD2-NE2 3.6Å; Y59-H63 HydrophobicContact CE1-CB 3.95Å; Y59-H63 AromaticContact CE1-CD2 3.45Å; Y59-H63 VanDerWaalsContact CE1-CD2 3.45Å; Y59-H63 WeakPolarHBondContact CE1-CD2 3.38Å; Y59-H63 AromaticContact CE1-CG 3.81Å; Y59-H63 AromaticContact CE2-CD2 3.24Å; Y59-H63 WeakPolarHBondContact CE2-CD2 3.5Å; Y59-H63 AromaticContact CE2-NE2 3.32Å; Y59-H63 VanDerWaalsContact CE2-NE2 3.32Å; Y59-H63 WeakPolarHBondContact CE2-NE2 3.23Å; Y59-H63 AromaticContact CG-CD2 3.53Å; Y59-H63 AromaticContact CZ-CD2 3.29Å; Y59-H63 AromaticContact CZ-CG 3.78Å; Y59-H63 AromaticContact CZ-NE2 3.73Å; Y59-H63 WeakPolarHBondContact O-CB 3.5Å; Y59-H63 PolarHBondContact O-CD2 2.74Å; Y59-H63 PolarHBondContact O-N 2.93Å; Y59-W64 AromaticContact CD1-CH2 3.92Å; Y59-W64 HydrophobicContact CD1-CH2 3.92Å; Y59-W64 AromaticContact CD1-CZ3 3.67Å; Y59-W64 HydrophobicContact CD1-CZ3 3.67Å; Y59-W64 AromaticContact CE1-CH2 3.54Å; Y59-W64 HydrophobicContact CE1-CH2 3.54Å; Y59-W64 HydrophobicContact CE1-CZ2 4.26Å; Y59-W64 AromaticContact CE1-CZ3 3.76Å; Y59-W64 HydrophobicContact CE1-CZ3 3.76Å; Y59-L368 HydrophobicContact CD1-CD2 3.36Å; Y59-L368 HydrophobicContact CD1-CG 4.2Å; Y59-L368 HydrophobicContact CD2-CD2 3.5Å; Y59-L368 HydrophobicContact CD2-CG 4.31Å; Y59-L368 HydrophobicContact CE1-CD1 4.36Å; Y59-L368 HydrophobicContact CE1-CD2 3.45Å; Y59-L368 VanDerWaalsContact CE1-CD2 3.45Å; Y59-L368 HydrophobicContact CE1-CG 3.75Å; Y59-L368 HydrophobicContact CE2-CD2 3.57Å; Y59-L368 HydrophobicContact CE2-CG 3.85Å; Y59-L368 HydrophobicContact CG-CD2 3.39Å; Y59-L368 HydrophobicContact CG-CG 4.46Å
60	Y	69.5	Low	69.3	Low	48 Å²	48	91.2 Å²	91.2	19%	0.188	41%	0.413	C	S	.	.	H	α-helix	trans	-58.4	-47.5	180	167	-88	0	0	0	112.3	H5 L56 L57 D58 R62 H63 W64 D66	H5-Y60 AromaticContact CE1-CE2 3.59Å; H5-Y60 AromaticContact NE2-CD2 3.83Å; H5-Y60 AromaticContact NE2-CE2 3.38Å; H5-Y60 WeakPolarHBondContact NE2-CE2 3.38Å; L56-Y60 WeakPolarHBondContact O-CB 3.46Å; L56-Y60 PolarHBondContact O-N 2.76Å; L57-Y60 WeakPolarHBondContact O-CB 3.46Å; L57-Y60 PolarHBondContact O-N 3.32Å; D58-Y60 PolarHBondContact O-N 3.48Å; Y60-R62 VanDerWaalsContact C-N 3.3Å; Y60-R62 PolarHBondContact O-N 2.97Å; Y60-H63 PolarHBondContact O-N 2.98Å; Y60-W64 HydrophobicContact CD2-CB 4.31Å; Y60-W64 HydrophobicContact CD2-CD2 4.33Å; Y60-W64 AromaticContact CD2-CE3 3.49Å; Y60-W64 HydrophobicContact CD2-CE3 3.49Å; Y60-W64 VanDerWaalsContact CD2-CE3 3.49Å; Y60-W64 HydrophobicContact CD2-CZ3 4.19Å; Y60-W64 HydrophobicContact CE2-CB 4.2Å; Y60-W64 HydrophobicContact CE2-CE3 4.33Å; Y60-W64 HydrophobicContact CG-CE3 4.06Å; Y60-W64 WeakPolarHBondContact O-CA 3.38Å; Y60-W64 PolarHBondContact O-N 3.45Å; Y60-W64 VanDerWaalsContact O-O 3.13Å; Y60-D66 WeakPolarHBondContact OH-CB 3.06Å; Y60-D66 PolarHBondContact OH-OD2 2.78Å
61	R	69.2	Low	71.5	Confident	182 Å²	182	87.9 Å²	87.9	69%	0.687	40%	0.401	S	S	*	.	H	α-helix	trans	-65.1	-32.8	177.2	-72	171.1	-172.5	176.9	4.9	112.8	L57 D58 Y59 H63	L57-R61 WeakPolarHBondContact O-CB 3.32Å; L57-R61 VanDerWaalsContact O-CG 3.25Å; L57-R61 WeakPolarHBondContact O-CG 3.38Å; L57-R61 PolarHBondContact O-N 3.48Å; D58-R61 PolarHBondContact O-N 2.8Å; Y59-R61 PolarHBondContact O-N 3.42Å; R61-H63 VanDerWaalsContact C-N 3.35Å
62	R	67.6	Low	73.8	Confident	153 Å²	153	82.5 Å²	82.5	58%	0.577	38%	0.376	S	S	*	.	H	α-helix	trans	-79.3	-15.2	180	-73.1	176.9	-169.2	-174.6	5	114.1	D58 Y59 Y60 P102	D58-R62 VanDerWaalsContact CG-CZ 3.42Å; D58-R62 VanDerWaalsContact CG-NE 3.25Å; D58-R62 VanDerWaalsContact CG-NH2 3.29Å; D58-R62 WeakPolarHBondContact O-CB 3.27Å; D58-R62 VanDerWaalsContact O-CG 3.22Å; D58-R62 WeakPolarHBondContact O-CG 3.1Å; D58-R62 PolarHBondContact O-N 3.48Å; D58-R62 IonicContact OD1-CZ 3.37Å; D58-R62 VanDerWaalsContact OD1-CZ 3.29Å; D58-R62 IonicContact OD1-NE 2.68Å; D58-R62 PolarHBondContact OD1-NE 2.86Å; D58-R62 IonicContact OD1-NH2 3.79Å; D58-R62 PolarHBondContact OD1-NH2 3.05Å; D58-R62 IonicContact OD2-CZ 3.91Å; D58-R62 IonicContact OD2-NE 3.42Å; D58-R62 PolarHBondContact OD2-NE 3.3Å; D58-R62 IonicContact OD2-NH1 3.85Å; D58-R62 PolarHBondContact OD2-NH1 3.41Å; D58-R62 IonicContact OD2-NH2 3.7Å; D58-R62 PolarHBondContact OD2-NH2 2.92Å; Y59-R62 PolarHBondContact O-N 3.35Å; Y59-R62 VanDerWaalsContact O-N 3.15Å; Y60-R62 VanDerWaalsContact C-N 3.3Å; Y60-R62 PolarHBondContact O-N 2.97Å; R62-P102 WeakPolarHBondContact O-CG 3.5Å
63	H	69.1	Low	76.1	Confident	75 Å²	75	84.9 Å²	84.9	35%	0.347	39%	0.394	S	S	.	.	H	α-helix	trans	-125.5	-23.6	-173.5	-68.2	-66.9	0	0	0	114.3	Y59 Y60 R61	Y59-H63 HydrophobicContact CD1-CB 4.31Å; Y59-H63 AromaticContact CD1-CD2 3.57Å; Y59-H63 AromaticContact CD2-CD2 3.35Å; Y59-H63 WeakPolarHBondContact CD2-CD2 3.41Å; Y59-H63 AromaticContact CD2-NE2 3.6Å; Y59-H63 HydrophobicContact CE1-CB 3.95Å; Y59-H63 AromaticContact CE1-CD2 3.45Å; Y59-H63 VanDerWaalsContact CE1-CD2 3.45Å; Y59-H63 WeakPolarHBondContact CE1-CD2 3.38Å; Y59-H63 AromaticContact CE1-CG 3.81Å; Y59-H63 AromaticContact CE2-CD2 3.24Å; Y59-H63 WeakPolarHBondContact CE2-CD2 3.5Å; Y59-H63 AromaticContact CE2-NE2 3.32Å; Y59-H63 VanDerWaalsContact CE2-NE2 3.32Å; Y59-H63 WeakPolarHBondContact CE2-NE2 3.23Å; Y59-H63 AromaticContact CG-CD2 3.53Å; Y59-H63 AromaticContact CZ-CD2 3.29Å; Y59-H63 AromaticContact CZ-CG 3.78Å; Y59-H63 AromaticContact CZ-NE2 3.73Å; Y59-H63 WeakPolarHBondContact O-CB 3.5Å; Y59-H63 PolarHBondContact O-CD2 2.74Å; Y59-H63 PolarHBondContact O-N 2.93Å; Y60-H63 PolarHBondContact O-N 2.98Å; R61-H63 VanDerWaalsContact C-N 3.35Å
64	W	78.2	Confident	78.1	Confident	82 Å²	82	79.5 Å²	79.5	31%	0.311	38%	0.375	S	S	.	.			trans	-128.3	141.9	179.5	-60.3	-66.4	0	0	0	111.6	Y59 Y60 V364	Y59-W64 AromaticContact CD1-CH2 3.92Å; Y59-W64 HydrophobicContact CD1-CH2 3.92Å; Y59-W64 AromaticContact CD1-CZ3 3.67Å; Y59-W64 HydrophobicContact CD1-CZ3 3.67Å; Y59-W64 AromaticContact CE1-CH2 3.54Å; Y59-W64 HydrophobicContact CE1-CH2 3.54Å; Y59-W64 HydrophobicContact CE1-CZ2 4.26Å; Y59-W64 AromaticContact CE1-CZ3 3.76Å; Y59-W64 HydrophobicContact CE1-CZ3 3.76Å; Y60-W64 HydrophobicContact CD2-CB 4.31Å; Y60-W64 HydrophobicContact CD2-CD2 4.33Å; Y60-W64 AromaticContact CD2-CE3 3.49Å; Y60-W64 HydrophobicContact CD2-CE3 3.49Å; Y60-W64 VanDerWaalsContact CD2-CE3 3.49Å; Y60-W64 HydrophobicContact CD2-CZ3 4.19Å; Y60-W64 HydrophobicContact CE2-CB 4.2Å; Y60-W64 HydrophobicContact CE2-CE3 4.33Å; Y60-W64 HydrophobicContact CG-CE3 4.06Å; Y60-W64 WeakPolarHBondContact O-CA 3.38Å; Y60-W64 PolarHBondContact O-N 3.45Å; Y60-W64 VanDerWaalsContact O-O 3.13Å; W64-V364 HydrophobicContact CH2-CG1 4.36Å; W64-V364 HydrophobicContact CZ2-CG1 4.13Å
65	D	84.3	Confident	79.9	Confident	13 Å²	13	75.2 Å²	75.2	7%	0.07	35%	0.352	C	S	.	.			trans	-125.3	87.2	171.8	-167.2	-8.6	0	0	0	110	R67 V68 P102 T103 A106	D65-R67 PolarHBondContact O-N 2.94Å; D65-R67 VanDerWaalsContact O-N 3.15Å; D65-R67 VanDerWaalsContact OD1-CB 3.28Å; D65-R67 WeakPolarHBondContact OD1-CB 3.46Å; D65-R67 WeakPolarHBondContact OD1-CG 3.37Å; D65-R67 IonicContact OD1-CZ 3.65Å; D65-R67 PolarHBondContact OD1-N 3.05Å; D65-R67 IonicContact OD1-NE 3.61Å; D65-R67 PolarHBondContact OD1-NE 3.29Å; D65-R67 IonicContact OD1-NH2 3.72Å; D65-R67 PolarHBondContact OD1-NH2 3.45Å; D65-R67 IonicContact OD2-CZ 2.75Å; D65-R67 IonicContact OD2-NE 3.46Å; D65-R67 IonicContact OD2-NH2 3.33Å; D65-R67 PolarHBondContact OD2-NH2 3.4Å; D65-V68 HydrophobicContact CB-CG2 4.32Å; D65-V68 PolarHBondContact O-N 3.36Å; D65-P102 HydrophobicContact CB-CB 4.1Å; D65-T103 WeakPolarHBondContact OD2-CB 3.21Å; D65-T103 WeakPolarHBondContact OD2-CG2 3.45Å; D65-T103 PolarHBondContact OD2-OG1 3.11Å; D65-A106 HydrophobicContact CB-CB 4.23Å
66	D	83	Confident	81.8	Confident	71 Å²	71	76.9 Å²	76.9	38%	0.38	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-2.6	179.1	-87.8	16.3	0	0	0	113.8	H5 R8 Y60 V68	H5-D66 IonicContact CE1-OD1 2.99Å; H5-D66 IonicContact CE1-OD2 2.57Å; R8-D66 IonicContact CZ-OD2 2.72Å; R8-D66 IonicContact NH1-OD1 2.79Å; R8-D66 PolarHBondContact NH1-OD1 2.94Å; R8-D66 IonicContact NH1-OD2 3.73Å; R8-D66 PolarHBondContact NH1-OD2 3Å; Y60-D66 WeakPolarHBondContact OH-CB 3.06Å; Y60-D66 PolarHBondContact OH-OD2 2.78Å; D66-V68 VanDerWaalsContact C-N 3.35Å
67	R	88.1	Confident	83.2	Confident	196 Å²	196	77.1 Å²	77.1	74%	0.74	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-26.6	174.6	-57.2	171	-64.8	174.8	5.3	111.4	D65	D65-R67 PolarHBondContact O-N 2.94Å; D65-R67 VanDerWaalsContact O-N 3.15Å; D65-R67 VanDerWaalsContact OD1-CB 3.28Å; D65-R67 WeakPolarHBondContact OD1-CB 3.46Å; D65-R67 WeakPolarHBondContact OD1-CG 3.37Å; D65-R67 IonicContact OD1-CZ 3.65Å; D65-R67 PolarHBondContact OD1-N 3.05Å; D65-R67 IonicContact OD1-NE 3.61Å; D65-R67 PolarHBondContact OD1-NE 3.29Å; D65-R67 IonicContact OD1-NH2 3.72Å; D65-R67 PolarHBondContact OD1-NH2 3.45Å; D65-R67 IonicContact OD2-CZ 2.75Å; D65-R67 IonicContact OD2-NE 3.46Å; D65-R67 IonicContact OD2-NH2 3.33Å; D65-R67 PolarHBondContact OD2-NH2 3.4Å
68	V	90.1	Very high	84.7	Confident	9 Å²	9	74.9 Å²	74.9	6%	0.055	34%	0.343	C	S	.	.			trans	-69.4	137	173.5	-173.9	0	0	0	0	108.2	D65 D66 D72 V75 T103 A106 Q107 H110	D65-V68 HydrophobicContact CB-CG2 4.32Å; D65-V68 PolarHBondContact O-N 3.36Å; D66-V68 VanDerWaalsContact C-N 3.35Å; V68-D72 HydrophobicContact CG1-CB 3.98Å; V68-V75 HydrophobicContact CG1-CG2 4.2Å; V68-T103 HydrophobicContact CG2-CG2 3.75Å; V68-A106 HydrophobicContact CB-CB 3.89Å; V68-A106 HydrophobicContact CG1-CB 4.37Å; V68-A106 HydrophobicContact CG2-CB 3.92Å; V68-Q107 HydrophobicContact CG1-CB 4.38Å; V68-Q107 HydrophobicContact CG1-CG 3.63Å; V68-Q107 HydrophobicContact CG2-CG 4.17Å; V68-H110 PolarHBondContact O-NE2 2.97Å
69	N	91.4	Very high	86	Confident	75 Å²	75	72.6 Å²	72.6	40%	0.401	33%	0.331	S	S	.	.			trans	-145.4	-175.1	176.4	60.2	47	0	0	0	109.5	D71 D72	N69-D71 PolarHBondContact O-N 3.44Å; N69-D71 VanDerWaalsContact O-N 3.14Å; N69-D71 WeakPolarHBondContact OD1-CA 3.28Å; N69-D71 VanDerWaalsContact OD1-CB 3.29Å; N69-D71 WeakPolarHBondContact OD1-CB 3.29Å; N69-D71 PolarHBondContact OD1-N 2.93Å; N69-D72 WeakPolarHBondContact O-CB 3.41Å; N69-D72 PolarHBondContact O-N 3.21Å; N69-D72 VanDerWaalsContact O-N 3.15Å; N69-D72 PolarHBondContact OD1-N 2.8Å
70	E	88.6	Confident	87.4	Confident	116 Å²	116	74.8 Å²	74.8	54%	0.542	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16	-178.6	64.3	-177.9	167.4	0	0	115	K114	E70-K114 PolarHBondContact O-NZ 3.37Å
71	D	92.6	Very high	88.7	Confident	93 Å²	93	74.4 Å²	74.4	50%	0.497	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-5.9	178.2	-66.3	-48.6	0	0	0	114.2	N69 K76	N69-D71 PolarHBondContact O-N 3.44Å; N69-D71 VanDerWaalsContact O-N 3.14Å; N69-D71 WeakPolarHBondContact OD1-CA 3.28Å; N69-D71 VanDerWaalsContact OD1-CB 3.29Å; N69-D71 WeakPolarHBondContact OD1-CB 3.29Å; N69-D71 PolarHBondContact OD1-N 2.93Å; D71-K76 VanDerWaalsContact OD1-CE 3.24Å; D71-K76 WeakPolarHBondContact OD1-CE 3.48Å; D71-K76 IonicContact OD1-NZ 2.85Å; D71-K76 PolarHBondContact OD1-NZ 2.93Å
72	D	95.9	Very high	89.9	Confident	28 Å²	28	65.8 Å²	65.8	15%	0.15	31%	0.31	C	S	.	.			trans	-52.7	128.8	175	-179.4	-67.9	0	0	0	110.1	V68 N69 T74 V75 K76 Q107	V68-D72 HydrophobicContact CG1-CB 3.98Å; N69-D72 WeakPolarHBondContact O-CB 3.41Å; N69-D72 PolarHBondContact O-N 3.21Å; N69-D72 VanDerWaalsContact O-N 3.15Å; N69-D72 PolarHBondContact OD1-N 2.8Å; D72-T74 PolarHBondContact O-N 3.49Å; D72-T74 WeakPolarHBondContact OD1-CA 3.36Å; D72-T74 WeakPolarHBondContact OD1-CB 3.27Å; D72-T74 PolarHBondContact OD1-N 3.34Å; D72-T74 PolarHBondContact OD1-OG1 2.89Å; D72-V75 HydrophobicContact CB-CB 4.08Å; D72-V75 HydrophobicContact CB-CG2 3.79Å; D72-V75 WeakPolarHBondContact O-CB 3.48Å; D72-V75 PolarHBondContact O-N 3.3Å; D72-V75 VanDerWaalsContact O-N 3.1Å; D72-V75 PolarHBondContact OD1-N 3.41Å; D72-K76 PolarHBondContact O-N 3.42Å; D72-Q107 PolarHBondContact OD1-NE2 3.24Å; D72-Q107 PolarHBondContact OD2-NE2 3.31Å; D72-Q107 VanDerWaalsContact OD2-NE2 3.14Å
73	P	95.6	Very high	91.1	Very high	101 Å²	101	62.3 Å²	62.3	66%	0.656	30%	0.303	S	S	*	.	H	α-helix	trans	-56	-37.4	-176.5	-27.2	34.7	0	0	0	113.4	H77	P73-H77 WeakPolarHBondContact O-CB 3.24Å; P73-H77 PolarHBondContact O-N 3.04Å
74	T	95.5	Very high	92.3	Very high	48 Å²	48	66.8 Å²	66.8	29%	0.294	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-45.2	178.9	-44.9	0	0	0	0	110.2	D72 H77 L78 L96 Q107	D72-T74 PolarHBondContact O-N 3.49Å; D72-T74 WeakPolarHBondContact OD1-CA 3.36Å; D72-T74 WeakPolarHBondContact OD1-CB 3.27Å; D72-T74 PolarHBondContact OD1-N 3.34Å; D72-T74 PolarHBondContact OD1-OG1 2.89Å; T74-H77 PolarHBondContact O-N 3.36Å; T74-L78 HydrophobicContact CG2-CD1 3.94Å; T74-L78 HydrophobicContact CG2-CG 4.45Å; T74-L78 WeakPolarHBondContact O-CB 3.18Å; T74-L78 WeakPolarHBondContact O-CG 3.13Å; T74-L78 PolarHBondContact O-N 3.43Å; T74-L96 HydrophobicContact CG2-CD1 4.22Å; T74-Q107 PolarHBondContact OG1-NE2 3.18Å
75	V	95.8	Very high	92.9	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-49.5	177.6	174.3	0	0	0	0	110.3	V68 D72 T79 Q107 H110 I111	V68-V75 HydrophobicContact CG1-CG2 4.2Å; D72-V75 HydrophobicContact CB-CB 4.08Å; D72-V75 HydrophobicContact CB-CG2 3.79Å; D72-V75 WeakPolarHBondContact O-CB 3.48Å; D72-V75 PolarHBondContact O-N 3.3Å; D72-V75 VanDerWaalsContact O-N 3.1Å; D72-V75 PolarHBondContact OD1-N 3.41Å; V75-T79 VanDerWaalsContact O-CB 3.27Å; V75-T79 WeakPolarHBondContact O-CB 3.32Å; V75-T79 PolarHBondContact O-N 2.79Å; V75-T79 PolarHBondContact O-OG1 2.93Å; V75-Q107 HydrophobicContact CG2-CB 3.98Å; V75-Q107 HydrophobicContact CG2-CG 4.1Å; V75-H110 HydrophobicContact CG1-CB 3.97Å; V75-H110 HydrophobicContact CG2-CB 4.03Å; V75-I111 HydrophobicContact CB-CG1 4.32Å; V75-I111 HydrophobicContact CG1-CG1 3.98Å; V75-I111 HydrophobicContact CG2-CG1 4.4Å
76	K	96	Very high	93.4	Very high	100 Å²	100	67.3 Å²	67.3	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-61.6	-49.7	178.2	-78.6	178.3	167.1	159.5	0	111.9	D71 D72 T79 D80	D71-K76 VanDerWaalsContact OD1-CE 3.24Å; D71-K76 WeakPolarHBondContact OD1-CE 3.48Å; D71-K76 IonicContact OD1-NZ 2.85Å; D71-K76 PolarHBondContact OD1-NZ 2.93Å; D72-K76 PolarHBondContact O-N 3.42Å; K76-T79 PolarHBondContact O-N 3.41Å; K76-D80 WeakPolarHBondContact O-CB 3.46Å; K76-D80 PolarHBondContact O-N 3.34Å; K76-D80 VanDerWaalsContact O-N 3.07Å
77	H	96.6	Very high	93.8	Very high	106 Å²	106	67.4 Å²	67.4	49%	0.491	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-48.6	-176.6	-178.5	65.1	0	0	0	112.3	P73 T74 R81	P73-H77 WeakPolarHBondContact O-CB 3.24Å; P73-H77 PolarHBondContact O-N 3.04Å; T74-H77 PolarHBondContact O-N 3.36Å; H77-R81 VanDerWaalsContact CE1-CD 3.49Å; H77-R81 WeakPolarHBondContact CE1-CD 3.44Å; H77-R81 VanDerWaalsContact NE2-CD 3.28Å; H77-R81 WeakPolarHBondContact NE2-CD 3.35Å; H77-R81 WeakPolarHBondContact O-CG 3.37Å; H77-R81 PolarHBondContact O-N 3.38Å; H77-R81 VanDerWaalsContact O-N 3.14Å
78	L	96.7	Very high	94.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.7	-36.9	179.2	-70.1	178	0	0	0	112.5	T74 D80 R81 I82 A89 E92 L96 I111	T74-L78 HydrophobicContact CG2-CD1 3.94Å; T74-L78 HydrophobicContact CG2-CG 4.45Å; T74-L78 WeakPolarHBondContact O-CB 3.18Å; T74-L78 WeakPolarHBondContact O-CG 3.13Å; T74-L78 PolarHBondContact O-N 3.43Å; L78-D80 PolarHBondContact O-N 2.91Å; L78-R81 PolarHBondContact O-N 2.97Å; L78-I82 WeakPolarHBondContact O-CB 3.48Å; L78-I82 WeakPolarHBondContact O-CD1 3.34Å; L78-I82 VanDerWaalsContact O-CG1 3.23Å; L78-I82 WeakPolarHBondContact O-CG1 3.43Å; L78-I82 PolarHBondContact O-N 2.59Å; L78-A89 HydrophobicContact CD2-CB 4.18Å; L78-E92 HydrophobicContact CD1-CG 4.07Å; L78-E92 HydrophobicContact CD2-CB 4.28Å; L78-E92 HydrophobicContact CD2-CG 4.17Å; L78-E92 WeakPolarHBondContact CD2-OE2 3.44Å; L78-L96 HydrophobicContact CD1-CD1 3.41Å; L78-L96 VanDerWaalsContact CD1-CD1 3.41Å; L78-I111 HydrophobicContact CB-CD1 3.81Å; L78-I111 HydrophobicContact CD1-CD1 3.97Å
79	T	95.5	Very high	94.4	Very high	9 Å²	9	61 Å²	61	6%	0.055	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-46.3	176.6	-55.7	0	0	0	0	111.2	V75 K76 R81 I82 D83 K114	V75-T79 VanDerWaalsContact O-CB 3.27Å; V75-T79 WeakPolarHBondContact O-CB 3.32Å; V75-T79 PolarHBondContact O-N 2.79Å; V75-T79 PolarHBondContact O-OG1 2.93Å; K76-T79 PolarHBondContact O-N 3.41Å; T79-R81 PolarHBondContact O-N 3.07Å; T79-I82 PolarHBondContact O-N 3.26Å; T79-D83 PolarHBondContact O-N 3.34Å; T79-K114 HydrophobicContact CG2-CB 4.45Å; T79-K114 HydrophobicContact CG2-CD 4.14Å
80	D	95.5	Very high	94.5	Very high	65 Å²	65	57.5 Å²	57.5	35%	0.348	30%	0.295	S	S	.	.	H	α-helix	trans	-63.1	-40.3	178.2	169.5	52.9	0	0	0	112.2	K76 L78 D83 R84	K76-D80 WeakPolarHBondContact O-CB 3.46Å; K76-D80 PolarHBondContact O-N 3.34Å; K76-D80 VanDerWaalsContact O-N 3.07Å; L78-D80 PolarHBondContact O-N 2.91Å; D80-D83 WeakPolarHBondContact O-CB 3.43Å; D80-D83 PolarHBondContact O-N 3.38Å; D80-R84 WeakPolarHBondContact O-CG 3.19Å; D80-R84 PolarHBondContact O-N 2.65Å; D80-R84 VanDerWaalsContact O-N 3.12Å; D80-R84 IonicContact OD1-CZ 3.07Å; D80-R84 IonicContact OD1-NE 3.48Å; D80-R84 PolarHBondContact OD1-NE 3.5Å; D80-R84 IonicContact OD1-NH2 2.65Å; D80-R84 PolarHBondContact OD1-NH2 3.19Å; D80-R84 IonicContact OD2-CZ 3.4Å; D80-R84 IonicContact OD2-NE 3.72Å; D80-R84 PolarHBondContact OD2-NE 2.87Å; D80-R84 IonicContact OD2-NH1 3.36Å; D80-R84 IonicContact OD2-NH2 3.07Å; D80-R84 PolarHBondContact OD2-NH2 3.38Å
81	R	97	Very high	94.7	Very high	40 Å²	40	53.3 Å²	53.3	15%	0.151	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-38.4	175.2	-68.5	176.6	63.1	-149.2	-8.3	112.9	H77 L78 T79 D83 R84 G85 E86 S88 A89 E92	H77-R81 VanDerWaalsContact CE1-CD 3.49Å; H77-R81 WeakPolarHBondContact CE1-CD 3.44Å; H77-R81 VanDerWaalsContact NE2-CD 3.28Å; H77-R81 WeakPolarHBondContact NE2-CD 3.35Å; H77-R81 WeakPolarHBondContact O-CG 3.37Å; H77-R81 PolarHBondContact O-N 3.38Å; H77-R81 VanDerWaalsContact O-N 3.14Å; L78-R81 PolarHBondContact O-N 2.97Å; T79-R81 PolarHBondContact O-N 3.07Å; R81-D83 VanDerWaalsContact C-N 3.32Å; R81-R84 PolarHBondContact O-N 2.86Å; R81-G85 PolarHBondContact O-N 3.13Å; R81-E86 HydrophobicContact CB-CB 4.33Å; R81-E86 HydrophobicContact CB-CG 4.44Å; R81-E86 IonicContact CZ-OE2 3.42Å; R81-E86 VanDerWaalsContact CZ-OE2 3.26Å; R81-E86 IonicContact NE-OE1 3.48Å; R81-E86 IonicContact NE-OE2 3.62Å; R81-E86 PolarHBondContact NE-OE2 3.35Å; R81-E86 IonicContact NH2-OE2 2.79Å; R81-E86 PolarHBondContact NH2-OE2 2.84Å; R81-E86 WeakPolarHBondContact O-CB 3.46Å; R81-E86 PolarHBondContact O-N 3.44Å; R81-S88 PolarHBondContact NH2-OG 2.64Å; R81-S88 VanDerWaalsContact NH2-OG 3.09Å; R81-A89 HydrophobicContact CB-CB 3.46Å; R81-A89 VanDerWaalsContact CB-CB 3.46Å; R81-E92 IonicContact NH1-OE2 2.97Å
82	I	95.8	Very high	94.8	Very high	1 Å²	1	53 Å²	53	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-41.5	173	-70.3	165.4	0	0	0	110.4	L78 T79 R84 G85 A89 A93 I111 L115 A224	L78-I82 WeakPolarHBondContact O-CB 3.48Å; L78-I82 WeakPolarHBondContact O-CD1 3.34Å; L78-I82 VanDerWaalsContact O-CG1 3.23Å; L78-I82 WeakPolarHBondContact O-CG1 3.43Å; L78-I82 PolarHBondContact O-N 2.59Å; T79-I82 PolarHBondContact O-N 3.26Å; I82-R84 PolarHBondContact O-N 3.36Å; I82-G85 WeakPolarHBondContact O-CA 3.35Å; I82-G85 PolarHBondContact O-N 3.08Å; I82-A89 HydrophobicContact CG1-CB 3.95Å; I82-A93 HydrophobicContact CD1-CB 3.66Å; I82-I111 HydrophobicContact CD1-CG2 3.89Å; I82-L115 HydrophobicContact CG2-CD2 4.25Å; I82-A224 HydrophobicContact CG2-CB 3.83Å
83	D	92.6	Very high	94.8	Very high	81 Å²	81	51.7 Å²	51.7	43%	0.433	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-29.8	177.6	-70.3	-28	0	0	0	113	T79 D80 R81 G85 K118	T79-D83 PolarHBondContact O-N 3.34Å; D80-D83 WeakPolarHBondContact O-CB 3.43Å; D80-D83 PolarHBondContact O-N 3.38Å; R81-D83 VanDerWaalsContact C-N 3.32Å; D83-G85 PolarHBondContact O-N 2.8Å; D83-K118 IonicContact OD1-NZ 3.35Å; D83-K118 PolarHBondContact OD1-NZ 3.18Å; D83-K118 IonicContact OD2-NZ 3.69Å; D83-K118 PolarHBondContact OD2-NZ 2.78Å
84	R	93.3	Very high	94.6	Very high	169 Å²	169	46.9 Å²	46.9	64%	0.638	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.3	172.4	-65.8	169.2	-166.2	-173.5	-0.4	113.5	D80 R81 I82	D80-R84 WeakPolarHBondContact O-CG 3.19Å; D80-R84 PolarHBondContact O-N 2.65Å; D80-R84 VanDerWaalsContact O-N 3.12Å; D80-R84 IonicContact OD1-CZ 3.07Å; D80-R84 IonicContact OD1-NE 3.48Å; D80-R84 PolarHBondContact OD1-NE 3.5Å; D80-R84 IonicContact OD1-NH2 2.65Å; D80-R84 PolarHBondContact OD1-NH2 3.19Å; D80-R84 IonicContact OD2-CZ 3.4Å; D80-R84 IonicContact OD2-NE 3.72Å; D80-R84 PolarHBondContact OD2-NE 2.87Å; D80-R84 IonicContact OD2-NH1 3.36Å; D80-R84 IonicContact OD2-NH2 3.07Å; D80-R84 PolarHBondContact OD2-NH2 3.38Å; R81-R84 PolarHBondContact O-N 2.86Å; I82-R84 PolarHBondContact O-N 3.36Å
85	G	92.1	Very high	94.4	Very high	39 Å²	39	47.9 Å²	47.9	40%	0.402	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	19.8	-179.4	0	0	0	0	0	114.3	R81 I82 D83 R87	R81-G85 PolarHBondContact O-N 3.13Å; I82-G85 WeakPolarHBondContact O-CA 3.35Å; I82-G85 PolarHBondContact O-N 3.08Å; D83-G85 PolarHBondContact O-N 2.8Å; G85-R87 PolarHBondContact O-N 3.5Å
86	E	94.2	Very high	94.2	Very high	67 Å²	67	48.7 Å²	48.7	31%	0.313	25%	0.247	S	C	.	.			trans	-72.7	113.7	178.4	-66.4	-177	-139.7	0	0	111.8	R81 S88 A89 L90	R81-E86 HydrophobicContact CB-CB 4.33Å; R81-E86 HydrophobicContact CB-CG 4.44Å; R81-E86 IonicContact CZ-OE2 3.42Å; R81-E86 VanDerWaalsContact CZ-OE2 3.26Å; R81-E86 IonicContact NE-OE1 3.48Å; R81-E86 IonicContact NE-OE2 3.62Å; R81-E86 PolarHBondContact NE-OE2 3.35Å; R81-E86 IonicContact NH2-OE2 2.79Å; R81-E86 PolarHBondContact NH2-OE2 2.84Å; R81-E86 WeakPolarHBondContact O-CB 3.46Å; R81-E86 PolarHBondContact O-N 3.44Å; E86-S88 VanDerWaalsContact C-N 3.31Å; E86-S88 PolarHBondContact O-N 3.23Å; E86-A89 HydrophobicContact CB-CB 4.08Å; E86-A89 PolarHBondContact O-N 2.74Å; E86-L90 PolarHBondContact O-N 3.35Å
87	R	92.2	Very high	93.9	Very high	73 Å²	73	44 Å²	44	28%	0.275	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-35.1	179.8	-64.8	172.2	174.7	173	-30.2	114	G85 A89 L90 A91 E193 D194 C196	G85-R87 PolarHBondContact O-N 3.5Å; R87-A89 VanDerWaalsContact C-N 3.32Å; R87-L90 WeakPolarHBondContact O-CB 3.3Å; R87-L90 PolarHBondContact O-N 3.18Å; R87-A91 PolarHBondContact O-N 3.4Å; R87-E193 PolarHBondContact NH2-O 2.88Å; R87-D194 VanDerWaalsContact CZ-C 3.47Å; R87-D194 IonicContact NH1-OD1 3.63Å; R87-D194 PolarHBondContact NH1-OD1 3.04Å; R87-D194 PolarHBondContact NH2-O 3.38Å; R87-C196 VanDerWaalsContact CZ-O 3.28Å; R87-C196 PolarHBondContact NE-O 2.85Å; R87-C196 VanDerWaalsContact NH2-N 3.11Å; R87-C196 PolarHBondContact NH2-O 2.99Å
88	S	93.3	Very high	93.4	Very high	71 Å²	71	40.9 Å²	40.9	50%	0.497	21%	0.213	S	C	.	.	H	α-helix	trans	-64.7	-39.7	178.6	52.7	0	0	0	0	111	R81 E86 A91 E92	R81-S88 PolarHBondContact NH2-OG 2.64Å; R81-S88 VanDerWaalsContact NH2-OG 3.09Å; E86-S88 VanDerWaalsContact C-N 3.31Å; E86-S88 PolarHBondContact O-N 3.23Å; S88-A91 PolarHBondContact O-N 3.12Å; S88-E92 WeakPolarHBondContact O-CB 3.03Å; S88-E92 PolarHBondContact O-N 2.66Å
89	A	95.6	Very high	92.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-38.5	175	0	0	0	0	0	112.1	L78 R81 I82 E86 R87 E92 A93	L78-A89 HydrophobicContact CD2-CB 4.18Å; R81-A89 HydrophobicContact CB-CB 3.46Å; R81-A89 VanDerWaalsContact CB-CB 3.46Å; I82-A89 HydrophobicContact CG1-CB 3.95Å; E86-A89 HydrophobicContact CB-CB 4.08Å; E86-A89 PolarHBondContact O-N 2.74Å; R87-A89 VanDerWaalsContact C-N 3.32Å; A89-E92 PolarHBondContact O-N 3.2Å; A89-A93 WeakPolarHBondContact O-CB 3.41Å; A89-A93 PolarHBondContact O-N 2.92Å
90	L	95.1	Very high	92.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-48	172.8	176.8	61.1	0	0	0	111.8	E86 R87 E92 A93 I94 Y197 F220 A224 Y226	E86-L90 PolarHBondContact O-N 3.35Å; R87-L90 WeakPolarHBondContact O-CB 3.3Å; R87-L90 PolarHBondContact O-N 3.18Å; L90-E92 VanDerWaalsContact C-N 3.33Å; L90-E92 PolarHBondContact O-N 3.47Å; L90-A93 PolarHBondContact O-N 3.24Å; L90-I94 HydrophobicContact CD1-CD1 3.93Å; L90-I94 HydrophobicContact CD1-CG1 4.35Å; L90-I94 HydrophobicContact CG-CD1 4.06Å; L90-I94 WeakPolarHBondContact O-CG1 3.45Å; L90-I94 PolarHBondContact O-N 3.48Å; L90-Y197 HydrophobicContact CD2-CD1 3.75Å; L90-Y197 HydrophobicContact CD2-CD2 4.36Å; L90-Y197 HydrophobicContact CD2-CE1 3.81Å; L90-Y197 HydrophobicContact CD2-CE2 4.43Å; L90-Y197 HydrophobicContact CD2-CG 4.04Å; L90-Y197 HydrophobicContact CG-CE1 4.15Å; L90-F220 HydrophobicContact CD1-CB 3.71Å; L90-F220 HydrophobicContact CD1-CD1 4.49Å; L90-F220 HydrophobicContact CD1-CG 4.47Å; L90-A224 HydrophobicContact CD1-CB 4.07Å; L90-A224 HydrophobicContact CD2-CB 4.03Å; L90-Y226 HydrophobicContact CD2-CE2 3.62Å
91	A	92.9	Very high	91.7	Very high	27 Å²	27	53.3 Å²	53.3	22%	0.223	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-39.2	178	0	0	0	0	0	112.5	R87 S88 T95 Y197	R87-A91 PolarHBondContact O-N 3.4Å; S88-A91 PolarHBondContact O-N 3.12Å; A91-T95 WeakPolarHBondContact O-CB 3.37Å; A91-T95 PolarHBondContact O-N 3.21Å; A91-T95 PolarHBondContact O-OG1 3.46Å; A91-Y197 WeakPolarHBondContact CA-OH 3.46Å; A91-Y197 HydrophobicContact CB-CE2 4.17Å
92	E	94.1	Very high	91.2	Very high	88 Å²	88	52.4 Å²	52.4	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-46.6	176.6	-170.6	175.6	167.3	0	0	111.4	L78 R81 S88 A89 L90 I94 T95 L96	L78-E92 HydrophobicContact CD1-CG 4.07Å; L78-E92 HydrophobicContact CD2-CB 4.28Å; L78-E92 HydrophobicContact CD2-CG 4.17Å; L78-E92 WeakPolarHBondContact CD2-OE2 3.44Å; R81-E92 IonicContact NH1-OE2 2.97Å; S88-E92 WeakPolarHBondContact O-CB 3.03Å; S88-E92 PolarHBondContact O-N 2.66Å; A89-E92 PolarHBondContact O-N 3.2Å; L90-E92 VanDerWaalsContact C-N 3.33Å; L90-E92 PolarHBondContact O-N 3.47Å; E92-I94 PolarHBondContact O-N 3.14Å; E92-T95 CarbonylContact O-C 3.09Å; E92-T95 WeakPolarHBondContact O-CA 3.32Å; E92-T95 WeakPolarHBondContact O-CB 3.43Å; E92-T95 PolarHBondContact O-N 2.49Å; E92-T95 VanDerWaalsContact O-N 3.11Å; E92-L96 WeakPolarHBondContact O-CG 3.11Å; E92-L96 PolarHBondContact O-N 3.16Å
93	A	94.8	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-39.4	178.9	0	0	0	0	0	113.1	I82 A89 L90 T95 L96 V97 I111 F220	I82-A93 HydrophobicContact CD1-CB 3.66Å; A89-A93 WeakPolarHBondContact O-CB 3.41Å; A89-A93 PolarHBondContact O-N 2.92Å; L90-A93 PolarHBondContact O-N 3.24Å; A93-T95 VanDerWaalsContact C-N 3.3Å; A93-T95 PolarHBondContact O-N 3.32Å; A93-L96 WeakPolarHBondContact O-CB 3.38Å; A93-L96 PolarHBondContact O-N 3.33Å; A93-V97 PolarHBondContact O-N 2.81Å; A93-I111 HydrophobicContact CB-CD1 4.09Å; A93-I111 HydrophobicContact CB-CG2 4.4Å; A93-F220 HydrophobicContact CB-CD1 4.18Å; A93-F220 HydrophobicContact CB-CE1 3.69Å; A93-F220 HydrophobicContact CB-CZ 4.22Å
94	I	92.4	Very high	91	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-42.6	171.9	-69.8	168	0	0	0	110.1	L90 E92 L96 V97 E98 Y197 S217 F220	L90-I94 HydrophobicContact CD1-CD1 3.93Å; L90-I94 HydrophobicContact CD1-CG1 4.35Å; L90-I94 HydrophobicContact CG-CD1 4.06Å; L90-I94 WeakPolarHBondContact O-CG1 3.45Å; L90-I94 PolarHBondContact O-N 3.48Å; E92-I94 PolarHBondContact O-N 3.14Å; I94-L96 VanDerWaalsContact C-N 3.28Å; I94-L96 PolarHBondContact O-N 3.43Å; I94-V97 VanDerWaalsContact O-CG1 3.26Å; I94-V97 WeakPolarHBondContact O-CG1 3.25Å; I94-V97 PolarHBondContact O-N 2.92Å; I94-E98 HydrophobicContact CG2-CG 4.34Å; I94-E98 VanDerWaalsContact CG2-OE1 3.26Å; I94-E98 WeakPolarHBondContact CG2-OE1 3.41Å; I94-E98 WeakPolarHBondContact O-CB 3.31Å; I94-E98 VanDerWaalsContact O-CG 3.3Å; I94-E98 WeakPolarHBondContact O-CG 3.46Å; I94-E98 PolarHBondContact O-N 3.32Å; I94-E98 VanDerWaalsContact O-N 3.08Å; I94-Y197 HydrophobicContact CD1-CE1 4.01Å; I94-S217 WeakPolarHBondContact CG2-OG 3.5Å; I94-F220 HydrophobicContact CD1-CB 4.11Å; I94-F220 HydrophobicContact CG1-CB 3.8Å; I94-F220 HydrophobicContact CG1-CD2 3.72Å; I94-F220 HydrophobicContact CG1-CE2 4.5Å; I94-F220 HydrophobicContact CG1-CG 3.81Å
95	T	90.7	Very high	90.9	Very high	69 Å²	69	50 Å²	50	42%	0.423	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-32.5	177.3	-55.6	0	0	0	0	112.3	A91 E92 A93 S99 R199	A91-T95 WeakPolarHBondContact O-CB 3.37Å; A91-T95 PolarHBondContact O-N 3.21Å; A91-T95 PolarHBondContact O-OG1 3.46Å; E92-T95 CarbonylContact O-C 3.09Å; E92-T95 WeakPolarHBondContact O-CA 3.32Å; E92-T95 WeakPolarHBondContact O-CB 3.43Å; E92-T95 PolarHBondContact O-N 2.49Å; E92-T95 VanDerWaalsContact O-N 3.11Å; A93-T95 VanDerWaalsContact C-N 3.3Å; A93-T95 PolarHBondContact O-N 3.32Å; T95-S99 PolarHBondContact O-N 2.93Å; T95-S99 VanDerWaalsContact O-N 3.16Å; T95-R199 PolarHBondContact OG1-NH2 3.33Å
96	L	92.5	Very high	90.8	Very high	17 Å²	17	49 Å²	49	9%	0.089	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-46.2	174.4	-72.4	-179.2	0	0	0	111.9	T74 L78 E92 A93 I94 S99 K104 R105 Q107 I111	T74-L96 HydrophobicContact CG2-CD1 4.22Å; L78-L96 HydrophobicContact CD1-CD1 3.41Å; L78-L96 VanDerWaalsContact CD1-CD1 3.41Å; E92-L96 WeakPolarHBondContact O-CG 3.11Å; E92-L96 PolarHBondContact O-N 3.16Å; A93-L96 WeakPolarHBondContact O-CB 3.38Å; A93-L96 PolarHBondContact O-N 3.33Å; I94-L96 VanDerWaalsContact C-N 3.28Å; I94-L96 PolarHBondContact O-N 3.43Å; L96-S99 VanDerWaalsContact O-CB 3.27Å; L96-S99 WeakPolarHBondContact O-CB 3.43Å; L96-S99 PolarHBondContact O-N 2.83Å; L96-K104 CarbonylContact C-O 3.56Å; L96-K104 WeakPolarHBondContact CB-O 3.31Å; L96-K104 HydrophobicContact CD2-CB 3.77Å; L96-K104 HydrophobicContact CD2-CD 4.21Å; L96-K104 HydrophobicContact CD2-CG 3.94Å; L96-K104 CarbonylContact O-C 3.58Å; L96-K104 VanDerWaalsContact O-C 3.32Å; L96-R105 WeakPolarHBondContact O-CA 3.37Å; L96-R105 PolarHBondContact O-N 3.13Å; L96-Q107 HydrophobicContact CD1-CB 4.24Å; L96-I111 HydrophobicContact CD1-CD1 4.19Å
97	V	89.3	Confident	90.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.8	-34.4	-179.7	80.1	0	0	0	0	112.3	A93 I94 S99 R105 E109 E216 F220	A93-V97 PolarHBondContact O-N 2.81Å; I94-V97 VanDerWaalsContact O-CG1 3.26Å; I94-V97 WeakPolarHBondContact O-CG1 3.25Å; I94-V97 PolarHBondContact O-N 2.92Å; V97-S99 PolarHBondContact O-N 3.01Å; V97-R105 PolarHBondContact O-NH1 2.98Å; V97-E109 HydrophobicContact CG2-CG 4.29Å; V97-E216 HydrophobicContact CG1-CB 3.99Å; V97-E216 WeakPolarHBondContact CG1-OE2 3.34Å; V97-E216 HydrophobicContact CG2-CG 4.26Å; V97-E216 WeakPolarHBondContact CG2-OE2 3.49Å; V97-F220 HydrophobicContact CB-CE2 3.96Å; V97-F220 HydrophobicContact CB-CZ 4.42Å; V97-F220 HydrophobicContact CG1-CD2 4.36Å; V97-F220 HydrophobicContact CG1-CE2 3.6Å; V97-F220 HydrophobicContact CG1-CZ 4.47Å
98	E	85.5	Confident	90.9	Very high	42 Å²	42	43.2 Å²	43.2	20%	0.196	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-19	177.1	-72.1	173.8	176.6	0	0	112.8	I94 R199 A202	I94-E98 HydrophobicContact CG2-CG 4.34Å; I94-E98 VanDerWaalsContact CG2-OE1 3.26Å; I94-E98 WeakPolarHBondContact CG2-OE1 3.41Å; I94-E98 WeakPolarHBondContact O-CB 3.31Å; I94-E98 VanDerWaalsContact O-CG 3.3Å; I94-E98 WeakPolarHBondContact O-CG 3.46Å; I94-E98 PolarHBondContact O-N 3.32Å; I94-E98 VanDerWaalsContact O-N 3.08Å; E98-R199 IonicContact OE1-NE 2.59Å; E98-R199 IonicContact OE1-NH2 3.77Å; E98-R199 IonicContact OE2-CZ 2.76Å; E98-R199 IonicContact OE2-NH2 3.8Å; E98-R199 PolarHBondContact OE2-NH2 3.13Å; E98-A202 HydrophobicContact CG-CB 4.14Å; E98-A202 WeakPolarHBondContact OE1-CB 3Å
99	S	85	Confident	90.9	Very high	28 Å²	28	42.9 Å²	42.9	20%	0.196	21%	0.207	C	C	.	.			trans	-64.1	142.6	-177.7	171.6	0	0	0	0	112.5	T95 L96 V97 H101	T95-S99 PolarHBondContact O-N 2.93Å; T95-S99 VanDerWaalsContact O-N 3.16Å; L96-S99 VanDerWaalsContact O-CB 3.27Å; L96-S99 WeakPolarHBondContact O-CB 3.43Å; L96-S99 PolarHBondContact O-N 2.83Å; V97-S99 PolarHBondContact O-N 3.01Å; S99-H101 VanDerWaalsContact C-N 3.32Å; S99-H101 WeakPolarHBondContact OG-CB 3.37Å; S99-H101 PolarHBondContact OG-N 2.87Å
100	R	80	Confident	90.8	Very high	208 Å²	208	45.1 Å²	45.1	79%	0.785	22%	0.217	S	C	*	.	S	Bend	trans	-80.3	-12.6	170.3	-64	-178.2	-176.5	160.8	2.4	113.4
101	H	86.7	Confident	90.8	Very high	98 Å²	98	45 Å²	45	45%	0.454	22%	0.217	S	C	.	.	S	Bend	trans	-73.2	124.1	177.3	-173.7	-68	0	0	0	110.5	S99 T103 K104 R105	S99-H101 VanDerWaalsContact C-N 3.32Å; S99-H101 WeakPolarHBondContact OG-CB 3.37Å; S99-H101 PolarHBondContact OG-N 2.87Å; H101-T103 PolarHBondContact CE1-OG1 2.87Å; H101-T103 VanDerWaalsContact CE1-OG1 3.28Å; H101-T103 PolarHBondContact ND1-N 2.87Å; H101-T103 PolarHBondContact O-N 3Å; H101-K104 HydrophobicContact CB-CB 4.21Å; H101-K104 HydrophobicContact CB-CD 4.21Å; H101-K104 HydrophobicContact CB-CG 4.18Å; H101-K104 PolarHBondContact O-N 3.21Å; H101-R105 PolarHBondContact O-N 2.75Å
102	P	87.2	Confident	90.8	Very high	21 Å²	21	43.9 Å²	43.9	14%	0.136	21%	0.207	C	C	.	.	H	α-helix	trans	-53.9	-49.3	-173.4	-32.2	39.6	0	0	0	114.6	R62 D65 R105 A106	R62-P102 WeakPolarHBondContact O-CG 3.5Å; D65-P102 HydrophobicContact CB-CB 4.1Å; P102-R105 PolarHBondContact O-N 3.03Å; P102-A106 WeakPolarHBondContact O-CB 3.42Å; P102-A106 PolarHBondContact O-N 3.45Å
103	T	92.2	Very high	90.8	Very high	36 Å²	36	42.5 Å²	42.5	22%	0.221	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-48.6	179.6	-44.9	0	0	0	0	112.2	D65 V68 H101 R105 A106 Q107	D65-T103 WeakPolarHBondContact OD2-CB 3.21Å; D65-T103 WeakPolarHBondContact OD2-CG2 3.45Å; D65-T103 PolarHBondContact OD2-OG1 3.11Å; V68-T103 HydrophobicContact CG2-CG2 3.75Å; H101-T103 PolarHBondContact CE1-OG1 2.87Å; H101-T103 VanDerWaalsContact CE1-OG1 3.28Å; H101-T103 PolarHBondContact ND1-N 2.87Å; H101-T103 PolarHBondContact O-N 3Å; T103-R105 VanDerWaalsContact C-N 3.35Å; T103-R105 PolarHBondContact O-N 3.38Å; T103-A106 PolarHBondContact O-N 2.89Å; T103-Q107 VanDerWaalsContact O-CG 3.28Å; T103-Q107 WeakPolarHBondContact O-CG 3.45Å; T103-Q107 PolarHBondContact O-N 3.2Å
104	K	92.5	Very high	90.7	Very high	105 Å²	105	44.4 Å²	44.4	46%	0.457	21%	0.209	S	C	.	.	H	α-helix	trans	-61	-44.6	178.2	-66.2	-172	177.6	-174	0	111.3	L96 H101 Q107 G108	L96-K104 CarbonylContact C-O 3.56Å; L96-K104 WeakPolarHBondContact CB-O 3.31Å; L96-K104 HydrophobicContact CD2-CB 3.77Å; L96-K104 HydrophobicContact CD2-CD 4.21Å; L96-K104 HydrophobicContact CD2-CG 3.94Å; L96-K104 CarbonylContact O-C 3.58Å; L96-K104 VanDerWaalsContact O-C 3.32Å; H101-K104 HydrophobicContact CB-CB 4.21Å; H101-K104 HydrophobicContact CB-CD 4.21Å; H101-K104 HydrophobicContact CB-CG 4.18Å; H101-K104 PolarHBondContact O-N 3.21Å; K104-Q107 WeakPolarHBondContact O-CB 3.49Å; K104-Q107 PolarHBondContact O-N 2.82Å; K104-G108 PolarHBondContact O-N 3.47Å
105	R	90	Very high	90.7	Very high	61 Å²	61	44.4 Å²	44.4	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-49	176.3	-172.9	175.5	176.5	83.5	14.3	110.8	L96 V97 H101 P102 T103 Q107 G108 E109 E216	L96-R105 WeakPolarHBondContact O-CA 3.37Å; L96-R105 PolarHBondContact O-N 3.13Å; V97-R105 PolarHBondContact O-NH1 2.98Å; H101-R105 PolarHBondContact O-N 2.75Å; P102-R105 PolarHBondContact O-N 3.03Å; T103-R105 VanDerWaalsContact C-N 3.35Å; T103-R105 PolarHBondContact O-N 3.38Å; R105-Q107 VanDerWaalsContact C-N 3.3Å; R105-Q107 PolarHBondContact O-N 2.77Å; R105-G108 PolarHBondContact O-N 3.1Å; R105-G108 VanDerWaalsContact O-N 3.12Å; R105-E109 HydrophobicContact CG-CG 4.31Å; R105-E109 IonicContact CZ-OE1 3.12Å; R105-E109 IonicContact NE-OE1 3.59Å; R105-E109 IonicContact NH2-OE1 3.29Å; R105-E109 PolarHBondContact NH2-OE1 3.37Å; R105-E109 VanDerWaalsContact O-CG 3.3Å; R105-E109 WeakPolarHBondContact O-CG 3.37Å; R105-E109 PolarHBondContact O-N 3.31Å; R105-E216 IonicContact NH2-OE1 3.71Å; R105-E216 PolarHBondContact NH2-OE1 2.84Å
106	A	90.9	Very high	90.7	Very high	16 Å²	16	42.4 Å²	42.4	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-38.9	178.2	0	0	0	0	0	112.6	D65 V68 P102 T103 E109 H110	D65-A106 HydrophobicContact CB-CB 4.23Å; V68-A106 HydrophobicContact CB-CB 3.89Å; V68-A106 HydrophobicContact CG1-CB 4.37Å; V68-A106 HydrophobicContact CG2-CB 3.92Å; P102-A106 WeakPolarHBondContact O-CB 3.42Å; P102-A106 PolarHBondContact O-N 3.45Å; T103-A106 PolarHBondContact O-N 2.89Å; A106-E109 PolarHBondContact O-N 2.93Å; A106-H110 PolarHBondContact O-CD2 3.28Å; A106-H110 VanDerWaalsContact O-CD2 3.26Å; A106-H110 PolarHBondContact O-N 3.04Å
107	Q	95.2	Very high	90.7	Very high	20 Å²	20	46.2 Å²	46.2	9%	0.093	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-47.9	172.8	-71.2	169.5	-29.5	0	0	111.2	V68 D72 T74 V75 L96 T103 K104 R105 E109 H110 I111	V68-Q107 HydrophobicContact CG1-CB 4.38Å; V68-Q107 HydrophobicContact CG1-CG 3.63Å; V68-Q107 HydrophobicContact CG2-CG 4.17Å; D72-Q107 PolarHBondContact OD1-NE2 3.24Å; D72-Q107 PolarHBondContact OD2-NE2 3.31Å; D72-Q107 VanDerWaalsContact OD2-NE2 3.14Å; T74-Q107 PolarHBondContact OG1-NE2 3.18Å; V75-Q107 HydrophobicContact CG2-CB 3.98Å; V75-Q107 HydrophobicContact CG2-CG 4.1Å; L96-Q107 HydrophobicContact CD1-CB 4.24Å; T103-Q107 VanDerWaalsContact O-CG 3.28Å; T103-Q107 WeakPolarHBondContact O-CG 3.45Å; T103-Q107 PolarHBondContact O-N 3.2Å; K104-Q107 WeakPolarHBondContact O-CB 3.49Å; K104-Q107 PolarHBondContact O-N 2.82Å; R105-Q107 VanDerWaalsContact C-N 3.3Å; R105-Q107 PolarHBondContact O-N 2.77Å; Q107-E109 PolarHBondContact O-N 3.42Å; Q107-H110 PolarHBondContact O-N 3.14Å; Q107-I111 WeakPolarHBondContact O-CG1 3.27Å; Q107-I111 PolarHBondContact O-N 3.25Å; Q107-I111 VanDerWaalsContact O-N 3.1Å
108	G	93.7	Very high	90.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-47.1	175.4	0	0	0	0	0	112.9	K104 R105 H110 I111 L112	K104-G108 PolarHBondContact O-N 3.47Å; R105-G108 PolarHBondContact O-N 3.1Å; R105-G108 VanDerWaalsContact O-N 3.12Å; G108-H110 VanDerWaalsContact C-N 3.34Å; G108-H110 PolarHBondContact O-N 3.06Å; G108-I111 PolarHBondContact O-N 3.47Å; G108-L112 WeakPolarHBondContact O-CB 3.48Å; G108-L112 PolarHBondContact O-N 3.04Å
109	E	91.9	Very high	91	Very high	63 Å²	63	49.1 Å²	49.1	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-60.8	-39.7	178	-67.7	-71.4	176.4	0	0	112.3	V97 R105 A106 Q107 L112 Q113	V97-E109 HydrophobicContact CG2-CG 4.29Å; R105-E109 HydrophobicContact CG-CG 4.31Å; R105-E109 IonicContact CZ-OE1 3.12Å; R105-E109 IonicContact NE-OE1 3.59Å; R105-E109 IonicContact NH2-OE1 3.29Å; R105-E109 PolarHBondContact NH2-OE1 3.37Å; R105-E109 VanDerWaalsContact O-CG 3.3Å; R105-E109 WeakPolarHBondContact O-CG 3.37Å; R105-E109 PolarHBondContact O-N 3.31Å; A106-E109 PolarHBondContact O-N 2.93Å; Q107-E109 PolarHBondContact O-N 3.42Å; E109-L112 PolarHBondContact O-N 3.19Å; E109-Q113 WeakPolarHBondContact O-CB 3.45Å; E109-Q113 PolarHBondContact O-N 2.93Å
110	H	94	Very high	91.3	Very high	47 Å²	47	49.1 Å²	49.1	22%	0.218	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-37.4	175.6	-84.5	-60	0	0	0	113.1	V68 V75 A106 Q107 G108 Q113 K114	V68-H110 PolarHBondContact O-NE2 2.97Å; V75-H110 HydrophobicContact CG1-CB 3.97Å; V75-H110 HydrophobicContact CG2-CB 4.03Å; A106-H110 PolarHBondContact O-CD2 3.28Å; A106-H110 VanDerWaalsContact O-CD2 3.26Å; A106-H110 PolarHBondContact O-N 3.04Å; Q107-H110 PolarHBondContact O-N 3.14Å; G108-H110 VanDerWaalsContact C-N 3.34Å; G108-H110 PolarHBondContact O-N 3.06Å; H110-Q113 PolarHBondContact ND1-OE1 2.87Å; H110-K114 PolarHBondContact O-N 2.9Å; H110-K114 VanDerWaalsContact O-N 3.15Å
111	I	95.4	Very high	91.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-47.9	172.6	-59.8	163.9	0	0	0	109.2	V75 L78 I82 A93 L96 Q107 G108 Q113 K114 L115 F220	V75-I111 HydrophobicContact CB-CG1 4.32Å; V75-I111 HydrophobicContact CG1-CG1 3.98Å; V75-I111 HydrophobicContact CG2-CG1 4.4Å; L78-I111 HydrophobicContact CB-CD1 3.81Å; L78-I111 HydrophobicContact CD1-CD1 3.97Å; I82-I111 HydrophobicContact CD1-CG2 3.89Å; A93-I111 HydrophobicContact CB-CD1 4.09Å; A93-I111 HydrophobicContact CB-CG2 4.4Å; L96-I111 HydrophobicContact CD1-CD1 4.19Å; Q107-I111 WeakPolarHBondContact O-CG1 3.27Å; Q107-I111 PolarHBondContact O-N 3.25Å; Q107-I111 VanDerWaalsContact O-N 3.1Å; G108-I111 PolarHBondContact O-N 3.47Å; I111-Q113 VanDerWaalsContact C-N 3.31Å; I111-Q113 PolarHBondContact O-N 2.85Å; I111-K114 WeakPolarHBondContact O-CB 3.49Å; I111-K114 PolarHBondContact O-N 2.91Å; I111-K114 VanDerWaalsContact O-N 3.11Å; I111-L115 HydrophobicContact CG2-CD1 4.38Å; I111-L115 WeakPolarHBondContact O-CG 3.35Å; I111-L115 PolarHBondContact O-N 3.32Å; I111-F220 HydrophobicContact CB-CE1 4.13Å; I111-F220 HydrophobicContact CG2-CE1 3.73Å
112	L	93.5	Very high	92.2	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-43.7	178.7	-170.9	63.1	0	0	0	111.9	G108 E109 K114 L115 L116 E216 V219 F220 W356	G108-L112 WeakPolarHBondContact O-CB 3.48Å; G108-L112 PolarHBondContact O-N 3.04Å; E109-L112 PolarHBondContact O-N 3.19Å; L112-K114 PolarHBondContact O-N 2.96Å; L112-L115 PolarHBondContact O-N 3.42Å; L112-L116 WeakPolarHBondContact O-CG 3.43Å; L112-L116 PolarHBondContact O-N 3.15Å; L112-E216 HydrophobicContact CD2-CB 4.11Å; L112-E216 HydrophobicContact CD2-CG 3.91Å; L112-V219 HydrophobicContact CD1-CB 3.73Å; L112-V219 HydrophobicContact CD1-CG1 3.41Å; L112-V219 VanDerWaalsContact CD1-CG1 3.41Å; L112-V219 HydrophobicContact CG-CG1 4.28Å; L112-F220 HydrophobicContact CB-CE1 4.37Å; L112-F220 HydrophobicContact CB-CE2 4.16Å; L112-F220 HydrophobicContact CB-CZ 3.83Å; L112-F220 HydrophobicContact CD1-CD1 4.38Å; L112-F220 HydrophobicContact CD1-CD2 3.77Å; L112-F220 HydrophobicContact CD1-CE1 4.36Å; L112-F220 HydrophobicContact CD1-CE2 3.73Å; L112-F220 HydrophobicContact CD1-CG 4.07Å; L112-F220 HydrophobicContact CD1-CZ 4.04Å; L112-F220 HydrophobicContact CD2-CE2 4.46Å; L112-F220 HydrophobicContact CG-CE2 4.35Å; L112-F220 HydrophobicContact CG-CZ 4.47Å; L112-W356 HydrophobicContact CD2-CH2 4.13Å
113	Q	92.9	Very high	92.5	Very high	58 Å²	58	45.3 Å²	45.3	27%	0.271	22%	0.217	S	C	.	.	H	α-helix	trans	-59.1	-44.1	175.4	-174.1	-177.4	22.4	0	0	112	P12 E109 H110 I111 L115 L116 Q117	P12-Q113 HydrophobicContact CB-CG 4.36Å; P12-Q113 HydrophobicContact CG-CG 4.26Å; E109-Q113 WeakPolarHBondContact O-CB 3.45Å; E109-Q113 PolarHBondContact O-N 2.93Å; H110-Q113 PolarHBondContact ND1-OE1 2.87Å; I111-Q113 VanDerWaalsContact C-N 3.31Å; I111-Q113 PolarHBondContact O-N 2.85Å; Q113-L115 VanDerWaalsContact C-N 3.34Å; Q113-L115 PolarHBondContact O-N 3.36Å; Q113-L116 PolarHBondContact O-N 3.14Å; Q113-Q117 WeakPolarHBondContact O-CG 3.29Å; Q113-Q117 PolarHBondContact O-N 3.11Å
114	K	93	Very high	92.5	Very high	40 Å²	40	50.1 Å²	50.1	17%	0.174	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-41.3	176.1	-74.9	-176.4	179.3	178.3	0	111.5	E70 T79 H110 I111 L112 Q117 K118	E70-K114 PolarHBondContact O-NZ 3.37Å; T79-K114 HydrophobicContact CG2-CB 4.45Å; T79-K114 HydrophobicContact CG2-CD 4.14Å; H110-K114 PolarHBondContact O-N 2.9Å; H110-K114 VanDerWaalsContact O-N 3.15Å; I111-K114 WeakPolarHBondContact O-CB 3.49Å; I111-K114 PolarHBondContact O-N 2.91Å; I111-K114 VanDerWaalsContact O-N 3.11Å; L112-K114 PolarHBondContact O-N 2.96Å; K114-Q117 PolarHBondContact O-N 2.92Å; K114-K118 WeakPolarHBondContact O-CG 3.27Å; K114-K118 PolarHBondContact O-N 3.15Å; K114-K118 VanDerWaalsContact O-N 3.1Å
115	L	92.4	Very high	92.6	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-41	177	-64	-178.9	0	0	0	112.2	I82 I111 L112 Q113 K118 S119 F220	I82-L115 HydrophobicContact CG2-CD2 4.25Å; I111-L115 HydrophobicContact CG2-CD1 4.38Å; I111-L115 WeakPolarHBondContact O-CG 3.35Å; I111-L115 PolarHBondContact O-N 3.32Å; L112-L115 PolarHBondContact O-N 3.42Å; Q113-L115 VanDerWaalsContact C-N 3.34Å; Q113-L115 PolarHBondContact O-N 3.36Å; L115-K118 WeakPolarHBondContact O-CB 3.34Å; L115-K118 PolarHBondContact O-N 2.75Å; L115-S119 PolarHBondContact O-N 2.83Å; L115-F220 HydrophobicContact CD1-CD1 3.47Å; L115-F220 VanDerWaalsContact CD1-CD1 3.47Å; L115-F220 HydrophobicContact CD1-CE1 3.97Å; L115-F220 HydrophobicContact CD1-CG 4.37Å
116	L	91.4	Very high	92.8	Very high	26 Å²	26	54.6 Å²	54.6	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-44.4	173.6	-77.9	172	0	0	0	112	P12 L112 Q113 K118 S119 G120 V219 M353	P12-L116 HydrophobicContact CB-CD1 3.97Å; L112-L116 WeakPolarHBondContact O-CG 3.43Å; L112-L116 PolarHBondContact O-N 3.15Å; Q113-L116 PolarHBondContact O-N 3.14Å; L116-K118 VanDerWaalsContact C-N 3.29Å; L116-K118 PolarHBondContact O-N 3.12Å; L116-S119 PolarHBondContact O-N 2.64Å; L116-G120 PolarHBondContact O-N 3.04Å; L116-V219 HydrophobicContact CD1-CG1 4.47Å; L116-V219 HydrophobicContact CD2-CB 4.48Å; L116-V219 HydrophobicContact CD2-CG1 3.4Å; L116-V219 HydrophobicContact CD2-CG2 4.2Å; L116-V219 HydrophobicContact CG-CG1 3.62Å; L116-M353 HydrophobicContact CD1-CE 4.46Å; L116-M353 HydrophobicContact CD2-CE 4.03Å
117	Q	91.7	Very high	93	Very high	98 Å²	98	54.9 Å²	54.9	46%	0.458	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-40.2	175.8	-72.4	174.6	5.3	0	0	111.9	Q113 K114 G120 K121	Q113-Q117 WeakPolarHBondContact O-CG 3.29Å; Q113-Q117 PolarHBondContact O-N 3.11Å; K114-Q117 PolarHBondContact O-N 2.92Å; Q117-G120 PolarHBondContact O-N 3.13Å; Q117-K121 WeakPolarHBondContact O-CB 3.16Å; Q117-K121 WeakPolarHBondContact O-CG 3.32Å; Q117-K121 PolarHBondContact O-N 2.92Å
118	K	90.8	Very high	92.9	Very high	87 Å²	87	56.4 Å²	56.4	38%	0.378	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-44.8	174.6	-71.6	-179.4	-177.1	-166.5	0	112	D83 K114 L115 L116 G120 K121 R122	D83-K118 IonicContact OD1-NZ 3.35Å; D83-K118 PolarHBondContact OD1-NZ 3.18Å; D83-K118 IonicContact OD2-NZ 3.69Å; D83-K118 PolarHBondContact OD2-NZ 2.78Å; K114-K118 WeakPolarHBondContact O-CG 3.27Å; K114-K118 PolarHBondContact O-N 3.15Å; K114-K118 VanDerWaalsContact O-N 3.1Å; L115-K118 WeakPolarHBondContact O-CB 3.34Å; L115-K118 PolarHBondContact O-N 2.75Å; L116-K118 VanDerWaalsContact C-N 3.29Å; L116-K118 PolarHBondContact O-N 3.12Å; K118-G120 VanDerWaalsContact C-N 3.35Å; K118-G120 PolarHBondContact O-N 2.83Å; K118-K121 PolarHBondContact O-N 2.73Å; K118-R122 WeakPolarHBondContact O-CB 3.49Å; K118-R122 PolarHBondContact O-N 3.38Å
119	S	90.5	Very high	92.8	Very high	15 Å²	15	60 Å²	60	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-42.6	176.5	-164.6	0	0	0	0	111.5	L115 L116 R122 L123	L115-S119 PolarHBondContact O-N 2.83Å; L116-S119 PolarHBondContact O-N 2.64Å; S119-R122 WeakPolarHBondContact O-CB 3.34Å; S119-R122 PolarHBondContact O-N 2.71Å; S119-R122 PolarHBondContact OG-NH2 3.48Å; S119-L123 WeakPolarHBondContact O-CB 3.36Å; S119-L123 PolarHBondContact O-N 3.14Å
120	G	91.3	Very high	92.9	Very high	28 Å²	28	57.9 Å²	57.9	29%	0.289	30%	0.302	S	S	.	.	H	α-helix	trans	-63.2	-44	175.1	0	0	0	0	0	113.1	L116 Q117 K118 R122 L123 Q124	L116-G120 PolarHBondContact O-N 3.04Å; Q117-G120 PolarHBondContact O-N 3.13Å; K118-G120 VanDerWaalsContact C-N 3.35Å; K118-G120 PolarHBondContact O-N 2.83Å; G120-R122 VanDerWaalsContact C-N 3.34Å; G120-R122 PolarHBondContact O-N 2.95Å; G120-L123 PolarHBondContact O-N 3.1Å; G120-Q124 WeakPolarHBondContact O-CG 3.42Å; G120-Q124 PolarHBondContact O-N 3.21Å
121	K	92.7	Very high	93	Very high	138 Å²	138	56.1 Å²	56.1	60%	0.6	29%	0.293	S	S	*	.	H	α-helix	trans	-61.7	-41.4	172.5	-75.2	176	-179.5	-179.8	0	111.8	Q117 K118 Q124 T125	Q117-K121 WeakPolarHBondContact O-CB 3.16Å; Q117-K121 WeakPolarHBondContact O-CG 3.32Å; Q117-K121 PolarHBondContact O-N 2.92Å; K118-K121 PolarHBondContact O-N 2.73Å; K121-Q124 PolarHBondContact O-N 3.38Å; K121-T125 WeakPolarHBondContact O-CB 3.39Å; K121-T125 WeakPolarHBondContact O-CG2 3.39Å; K121-T125 PolarHBondContact O-N 3.07Å; K121-T125 PolarHBondContact O-OG1 2.91Å
122	R	92.8	Very high	93	Very high	57 Å²	57	56.8 Å²	56.8	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-61.6	-45.4	176	179.8	175.2	62.6	-152.1	-5.8	111.2	K118 S119 G120 T125 K126 S130 E222	K118-R122 WeakPolarHBondContact O-CB 3.49Å; K118-R122 PolarHBondContact O-N 3.38Å; S119-R122 WeakPolarHBondContact O-CB 3.34Å; S119-R122 PolarHBondContact O-N 2.71Å; S119-R122 PolarHBondContact OG-NH2 3.48Å; G120-R122 VanDerWaalsContact C-N 3.34Å; G120-R122 PolarHBondContact O-N 2.95Å; R122-T125 PolarHBondContact O-N 2.84Å; R122-T125 PolarHBondContact O-OG1 3.39Å; R122-K126 HydrophobicContact CG-CD 4.28Å; R122-K126 WeakPolarHBondContact O-CB 3.39Å; R122-K126 PolarHBondContact O-N 2.86Å; R122-S130 PolarHBondContact NE-O 2.98Å; R122-S130 PolarHBondContact O-OG 3.4Å; R122-E222 PolarHBondContact NH1-O 3.29Å; R122-E222 PolarHBondContact NH2-O 3.22Å
123	L	92.9	Very high	93.2	Very high	52 Å²	52	56.8 Å²	56.8	27%	0.272	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-44.7	175.6	176.7	60.8	0	0	0	112.1	S119 G120 T125 G127 P128 L131	S119-L123 WeakPolarHBondContact O-CB 3.36Å; S119-L123 PolarHBondContact O-N 3.14Å; G120-L123 PolarHBondContact O-N 3.1Å; L123-T125 PolarHBondContact O-N 3.36Å; L123-G127 WeakPolarHBondContact O-CA 3.43Å; L123-G127 PolarHBondContact O-N 3.23Å; L123-P128 HydrophobicContact CD1-CB 4.39Å; L123-P128 HydrophobicContact CD1-CG 4.4Å; L123-L131 HydrophobicContact CD1-CD1 4.3Å; L123-L131 HydrophobicContact CD1-CD2 4.05Å; L123-L131 HydrophobicContact CD1-CG 4.08Å; L123-L131 HydrophobicContact CD2-CD2 4.35Å
124	Q	93	Very high	93.4	Very high	138 Å²	138	54.6 Å²	54.6	65%	0.645	29%	0.286	S	S	*	.	H	α-helix	trans	-64.9	-38.2	178.4	-72.2	171.2	21.7	0	0	112.8	G120 K121	G120-Q124 WeakPolarHBondContact O-CG 3.42Å; G120-Q124 PolarHBondContact O-N 3.21Å; K121-Q124 PolarHBondContact O-N 3.38Å
125	T	95.2	Very high	93.6	Very high	111 Å²	111	52.7 Å²	52.7	68%	0.681	28%	0.278	S	S	*	.	H	α-helix	trans	-87.3	-34.2	-174.5	51	0	0	0	0	113.8	K121 R122 L123	K121-T125 WeakPolarHBondContact O-CB 3.39Å; K121-T125 WeakPolarHBondContact O-CG2 3.39Å; K121-T125 PolarHBondContact O-N 3.07Å; K121-T125 PolarHBondContact O-OG1 2.91Å; R122-T125 PolarHBondContact O-N 2.84Å; R122-T125 PolarHBondContact O-OG1 3.39Å; L123-T125 PolarHBondContact O-N 3.36Å
126	K	94.6	Very high	93.7	Very high	149 Å²	149	52.7 Å²	52.7	65%	0.648	28%	0.278	S	S	*	.	H	α-helix	trans	-112.5	-4.4	-174.5	-61.4	-172.5	-179.8	-175.3	0	114	R122	R122-K126 HydrophobicContact CG-CD 4.28Å; R122-K126 WeakPolarHBondContact O-CB 3.39Å; R122-K126 PolarHBondContact O-N 2.86Å
127	G	93.8	Very high	93.7	Very high	22 Å²	22	51.5 Å²	51.5	23%	0.227	27%	0.271	C	S	.	.			trans	76.8	-179.8	-179.5	0	0	0	0	0	114.4	L123 S129 S130	L123-G127 WeakPolarHBondContact O-CA 3.43Å; L123-G127 PolarHBondContact O-N 3.23Å; G127-S129 PolarHBondContact O-N 2.81Å; G127-S130 WeakPolarHBondContact O-CB 3.3Å; G127-S130 PolarHBondContact O-N 3.25Å; G127-S130 VanDerWaalsContact O-N 3.08Å; G127-S130 PolarHBondContact O-OG 2.66Å
128	P	93.1	Very high	93.6	Very high	51 Å²	51	46.9 Å²	46.9	33%	0.331	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-62	-25.3	-173.4	-25.7	35.9	0	0	0	115.1	L123 S130 L131 T340 V346	L123-P128 HydrophobicContact CD1-CB 4.39Å; L123-P128 HydrophobicContact CD1-CG 4.4Å; P128-S130 PolarHBondContact O-N 3.15Å; P128-S130 VanDerWaalsContact O-N 3.13Å; P128-L131 WeakPolarHBondContact O-CB 3.44Å; P128-L131 VanDerWaalsContact O-CG 3.27Å; P128-L131 WeakPolarHBondContact O-CG 3.29Å; P128-L131 PolarHBondContact O-N 3.3Å; P128-L131 VanDerWaalsContact O-N 3.15Å; P128-T340 HydrophobicContact CB-CG2 4.01Å; P128-V346 HydrophobicContact CB-CG2 3.83Å; P128-V346 HydrophobicContact CG-CG2 3.96Å
129	S	92.7	Very high	93.4	Very high	77 Å²	77	43 Å²	43	54%	0.538	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-61.7	-20.4	175.4	59.3	0	0	0	0	113.1	G127 L131 R336	G127-S129 PolarHBondContact O-N 2.81Å; S129-L131 VanDerWaalsContact C-N 3.29Å; S129-L131 PolarHBondContact O-N 2.87Å; S129-R336 PolarHBondContact O-NH2 2.79Å
130	S	93.9	Very high	92.9	Very high	18 Å²	18	44 Å²	44	13%	0.126	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-79.4	-4.7	178.4	73.6	0	0	0	0	115.1	R122 G127 P128	R122-S130 PolarHBondContact NE-O 2.98Å; R122-S130 PolarHBondContact O-OG 3.4Å; G127-S130 WeakPolarHBondContact O-CB 3.3Å; G127-S130 PolarHBondContact O-N 3.25Å; G127-S130 VanDerWaalsContact O-N 3.08Å; G127-S130 PolarHBondContact O-OG 2.66Å; P128-S130 PolarHBondContact O-N 3.15Å; P128-S130 VanDerWaalsContact O-N 3.13Å
131	L	94.5	Very high	92.4	Very high	9 Å²	9	46.1 Å²	46.1	5%	0.047	25%	0.251	C	S	.	.	S	Bend	trans	-67.3	142.2	175.6	-66.2	173.5	0	0	0	110.7	L123 P128 S129 R336 L345 V346	L123-L131 HydrophobicContact CD1-CD1 4.3Å; L123-L131 HydrophobicContact CD1-CD2 4.05Å; L123-L131 HydrophobicContact CD1-CG 4.08Å; L123-L131 HydrophobicContact CD2-CD2 4.35Å; P128-L131 WeakPolarHBondContact O-CB 3.44Å; P128-L131 VanDerWaalsContact O-CG 3.27Å; P128-L131 WeakPolarHBondContact O-CG 3.29Å; P128-L131 PolarHBondContact O-N 3.3Å; P128-L131 VanDerWaalsContact O-N 3.15Å; S129-L131 VanDerWaalsContact C-N 3.29Å; S129-L131 PolarHBondContact O-N 2.87Å; L131-R336 PolarHBondContact O-NH2 2.97Å; L131-L345 HydrophobicContact CD1-CD2 4.08Å; L131-L345 HydrophobicContact CD1-CG 4.25Å; L131-V346 HydrophobicContact CD1-CG2 4.23Å
132	I	96.2	Very high	91.9	Very high	15 Å²	15	42.2 Å²	42.2	8%	0.077	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-82.9	125.8	-179.6	-59.2	-42.6	0	0	0	108.7	R134 E222 Y226 V229 R349	I132-R134 PolarHBondContact O-N 3.5Å; I132-E222 HydrophobicContact CB-CB 4.08Å; I132-E222 HydrophobicContact CB-CG 3.74Å; I132-E222 HydrophobicContact CG1-CB 3.91Å; I132-E222 HydrophobicContact CG1-CG 4.16Å; I132-E222 HydrophobicContact CG2-CB 4.47Å; I132-E222 HydrophobicContact CG2-CG 4Å; I132-Y226 WeakPolarHBondContact CD1-O 3.25Å; I132-Y226 WeakPolarHBondContact CG1-O 3.47Å; I132-Y226 WeakPolarHBondContact CG2-O 3.33Å; I132-V229 HydrophobicContact CG2-CG2 4.13Å; I132-R349 PolarHBondContact O-NH2 3.27Å
133	F	97.2	Very high	91.6	Very high	3 Å²	3	39.5 Å²	39.5	1%	0.013	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.7	-168.3	-171.7	-152.7	0	0	0	112.3	V135 D227 I228 V229 D248 M249 M332 F335 R336	F133-V135 HydrophobicContact CD1-CG2 3.66Å; F133-V135 HydrophobicContact CD2-CG2 4.17Å; F133-V135 HydrophobicContact CE1-CG2 3.52Å; F133-V135 HydrophobicContact CE2-CG2 4.03Å; F133-V135 HydrophobicContact CG-CG2 3.99Å; F133-V135 HydrophobicContact CZ-CG2 3.72Å; F133-D227 PolarHBondContact N-O 3.11Å; F133-I228 HydrophobicContact CB-CG1 4.33Å; F133-I228 HydrophobicContact CD1-CD1 4.01Å; F133-I228 HydrophobicContact CD1-CG1 4.38Å; F133-I228 CarbonylContact O-C 3.52Å; F133-I228 VanDerWaalsContact O-CA 3.29Å; F133-I228 WeakPolarHBondContact O-CA 3.28Å; F133-I228 WeakPolarHBondContact O-CG1 3.35Å; F133-V229 PolarHBondContact O-N 3.42Å; F133-D248 HydrophobicContact CD2-CB 4.08Å; F133-D248 HydrophobicContact CE2-CB 4.01Å; F133-M249 HydrophobicContact CE2-CB 3.89Å; F133-M249 HydrophobicContact CZ-CB 3.84Å; F133-M249 HydrophobicContact CZ-CG 4.49Å; F133-M249 HydrophobicContact CZ-SD 3.86Å; F133-M332 HydrophobicContact CE1-CB 4.07Å; F133-M332 HydrophobicContact CE1-CE 3.91Å; F133-F335 HydrophobicContact CE2-CD1 4.13Å; F133-F335 HydrophobicContact CE2-CE1 4.29Å; F133-F335 HydrophobicContact CZ-CD1 4.09Å; F133-R336 HydrophobicContact CD2-CG 4.48Å; F133-R336 HydrophobicContact CE2-CB 4.24Å; F133-R336 HydrophobicContact CZ-CB 4.25Å
134	R	97.2	Very high	91.4	Very high	12 Å²	12	38 Å²	38	5%	0.045	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120	-178.9	-55.1	168.2	-175.3	178.9	-2.1	109.5	I132 V218 E222 I246 D248 M249	I132-R134 PolarHBondContact O-N 3.5Å; R134-V218 HydrophobicContact CG-CG1 3.9Å; R134-E222 IonicContact CZ-OE1 2.8Å; R134-E222 IonicContact CZ-OE2 3.93Å; R134-E222 IonicContact NE-OE1 3.89Å; R134-E222 PolarHBondContact NE-OE1 2.96Å; R134-E222 IonicContact NE-OE2 2.62Å; R134-E222 VanDerWaalsContact NH2-CD 3.25Å; R134-E222 IonicContact NH2-OE1 3.68Å; R134-E222 PolarHBondContact NH2-OE1 2.89Å; R134-E222 VanDerWaalsContact NH2-OE1 3.12Å; R134-E222 IonicContact NH2-OE2 3.59Å; R134-E222 PolarHBondContact NH2-OE2 2.7Å; R134-I246 VanDerWaalsContact CD-O 3.3Å; R134-I246 WeakPolarHBondContact CD-O 2.97Å; R134-D248 PolarHBondContact N-OD2 2.9Å; R134-D248 WeakPolarHBondContact O-CB 3.01Å; R134-D248 PolarHBondContact O-N 3.39Å; R134-M249 PolarHBondContact O-N 2.94Å; R134-M249 VanDerWaalsContact O-N 3.11Å
135	V	97	Very high	91.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	116.4	-174.7	-176	0	0	0	0	109.8	F133 I137 I228 V229 L230 I231 M249 V251 M332	F133-V135 HydrophobicContact CD1-CG2 3.66Å; F133-V135 HydrophobicContact CD2-CG2 4.17Å; F133-V135 HydrophobicContact CE1-CG2 3.52Å; F133-V135 HydrophobicContact CE2-CG2 4.03Å; F133-V135 HydrophobicContact CG-CG2 3.99Å; F133-V135 HydrophobicContact CZ-CG2 3.72Å; V135-I137 HydrophobicContact CG1-CG1 4.28Å; V135-I228 HydrophobicContact CG2-CD1 4.05Å; V135-I228 HydrophobicContact CG2-CG1 4.31Å; V135-V229 PolarHBondContact N-O 2.79Å; V135-L230 HydrophobicContact CB-CD2 3.94Å; V135-L230 HydrophobicContact CG1-CD2 4.46Å; V135-L230 HydrophobicContact CG2-CD2 4.45Å; V135-L230 CarbonylContact O-C 3.6Å; V135-L230 WeakPolarHBondContact O-CA 3.36Å; V135-I231 PolarHBondContact O-N 2.85Å; V135-M249 CarbonylContact C-O 3.53Å; V135-M249 WeakPolarHBondContact CA-O 3.18Å; V135-V251 HydrophobicContact CG1-CG2 3.67Å; V135-M332 HydrophobicContact CB-CE 4.13Å; V135-M332 HydrophobicContact CG1-CE 3.64Å; V135-M332 HydrophobicContact CG2-CE 3.55Å
136	A	94.3	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.3	169.4	0	0	0	0	0	110	I231 V243 A247 M249 V250 V251	A136-I231 CarbonylContact C-O 3.56Å; A136-I231 WeakPolarHBondContact CA-O 3.45Å; A136-V243 HydrophobicContact CB-CB 3.81Å; A136-V243 HydrophobicContact CB-CG2 3.77Å; A136-A247 HydrophobicContact CB-CB 3.57Å; A136-M249 PolarHBondContact N-O 2.8Å; A136-V250 HydrophobicContact CB-CG2 4.35Å; A136-V251 PolarHBondContact O-N 3.43Å
137	I	93.3	Very high	90.9	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.4	174.7	-62.7	171.1	0	0	0	107.4	V135 F148 I149 L230 I231 T233 V251 L253	V135-I137 HydrophobicContact CG1-CG1 4.28Å; I137-F148 HydrophobicContact CD1-CD1 4.39Å; I137-F148 HydrophobicContact CD1-CE1 4.13Å; I137-F148 HydrophobicContact CG2-CD1 4.38Å; I137-I149 HydrophobicContact CB-CD1 4.37Å; I137-I149 HydrophobicContact CD1-CD1 4.27Å; I137-I149 HydrophobicContact CD1-CG1 3.65Å; I137-I149 HydrophobicContact CG2-CD1 4.23Å; I137-I149 HydrophobicContact CG2-CG1 4.24Å; I137-L230 HydrophobicContact CD1-CB 4.38Å; I137-L230 HydrophobicContact CD1-CD1 4.4Å; I137-L230 HydrophobicContact CD1-CD2 4.24Å; I137-I231 PolarHBondContact N-O 3.36Å; I137-T233 PolarHBondContact O-N 2.95Å; I137-T233 VanDerWaalsContact O-N 3.09Å; I137-V251 WeakPolarHBondContact CA-O 3.48Å; I137-V251 HydrophobicContact CG1-CB 4.37Å; I137-L253 HydrophobicContact CG2-CD1 3.85Å; I137-L253 HydrophobicContact CG2-CD2 4.47Å; I137-L253 HydrophobicContact CG2-CG 3.94Å
138	T	89.3	Confident	90.9	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	164.8	-177.1	-170	0	0	0	0	111	T233 E240 V250 V251 L252 L253 I269	T138-T233 VanDerWaalsContact CA-OG1 3.3Å; T138-T233 WeakPolarHBondContact CA-OG1 3.28Å; T138-T233 VanDerWaalsContact CB-OG1 3.25Å; T138-T233 WeakPolarHBondContact CB-OG1 3.04Å; T138-T233 PolarHBondContact OG1-OG1 3.17Å; T138-E240 WeakPolarHBondContact OG1-CG 3.33Å; T138-V250 HydrophobicContact CG2-CG1 4.22Å; T138-V251 PolarHBondContact N-O 2.99Å; T138-L252 HydrophobicContact CG2-CD1 3.98Å; T138-L252 CarbonylContact O-C 3.57Å; T138-L253 PolarHBondContact O-N 3.02Å; T138-I269 HydrophobicContact CG2-CG2 4.45Å
139	G	86.4	Confident	91	Very high	6 Å²	6	20.9 Å²	20.9	6%	0.062	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.8	162.7	-178.4	0	0	0	0	0	111.7	K145 L253	G139-K145 PolarHBondContact O-NZ 3.02Å; G139-L253 WeakPolarHBondContact CA-O 3.23Å
140	S	79.8	Confident	91.1	Very high	34 Å²	34	18.8 Å²	18.8	24%	0.238	13%	0.129	C	C	.	.			trans	-57.7	154.9	179.2	54.8	0	0	0	0	112	G142 A143 K145 E261	S140-G142 PolarHBondContact O-N 2.98Å; S140-A143 WeakPolarHBondContact O-CB 3.41Å; S140-A143 PolarHBondContact O-N 3.36Å; S140-A143 VanDerWaalsContact O-N 3.12Å; S140-K145 PolarHBondContact O-NZ 2.86Å; S140-E261 WeakPolarHBondContact CB-OE1 3.41Å; S140-E261 PolarHBondContact OG-OE1 2.93Å
141	P	79.7	Confident	91.2	Very high	74 Å²	74	18.6 Å²	18.6	48%	0.481	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	136.5	166.9	-24.3	34.3	0	0	0	110.5	A143 V236	P141-A143 VanDerWaalsContact C-N 3.28Å; P141-A143 PolarHBondContact O-N 3.49Å; P141-V236 VanDerWaalsContact CD-CG1 3.45Å; P141-V236 HydrophobicContact CG-CG1 3.65Å
142	G	83.1	Confident	91.4	Very high	56 Å²	56	18.2 Å²	18.2	58%	0.577	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.4	-5.9	-176.7	0	0	0	0	0	115.2	S140 G144 K280	S140-G142 PolarHBondContact O-N 2.98Å; G142-G144 PolarHBondContact O-N 3.35Å; G142-K280 WeakPolarHBondContact O-CE 3.44Å; G142-K280 PolarHBondContact O-NZ 3.49Å
143	A	87.5	Confident	91.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-65.4	-0.7	171.8	0	0	0	0	0	114.2	S140 P141 L253 T279	S140-A143 WeakPolarHBondContact O-CB 3.41Å; S140-A143 PolarHBondContact O-N 3.36Å; S140-A143 VanDerWaalsContact O-N 3.12Å; P141-A143 VanDerWaalsContact C-N 3.28Å; P141-A143 PolarHBondContact O-N 3.49Å; A143-L253 HydrophobicContact CB-CB 4.28Å; A143-T279 WeakPolarHBondContact O-CG2 3.31Å; A143-T279 PolarHBondContact O-OG1 3.42Å
144	G	88.5	Confident	91.4	Very high	21 Å²	21	18.6 Å²	18.6	22%	0.216	13%	0.129	C	C	.	.			trans	80.3	22.6	177.2	0	0	0	0	0	115	G142 T147 F148	G142-G144 PolarHBondContact O-N 3.35Å; G144-T147 PolarHBondContact O-N 3.34Å; G144-F148 VanDerWaalsContact O-CB 3.29Å; G144-F148 WeakPolarHBondContact O-CB 3.06Å; G144-F148 PolarHBondContact O-N 2.88Å
145	K	89.6	Confident	91.5	Very high	16 Å²	16	20.5 Å²	20.5	7%	0.07	14%	0.136	C	C	.	.	H	α-helix	trans	-48.5	-61.9	-179.7	-66.5	-173.6	-65.2	-74.5	0	114.2	G139 S140 T147 F148 I149 E232 T233 L253	G139-K145 PolarHBondContact O-NZ 3.02Å; S140-K145 PolarHBondContact O-NZ 2.86Å; K145-T147 VanDerWaalsContact C-N 3.31Å; K145-T147 PolarHBondContact O-N 2.74Å; K145-F148 WeakPolarHBondContact O-CB 3.31Å; K145-F148 PolarHBondContact O-N 3.01Å; K145-F148 VanDerWaalsContact O-N 3.13Å; K145-I149 VanDerWaalsContact O-CG1 3.32Å; K145-I149 WeakPolarHBondContact O-CG1 3.36Å; K145-I149 PolarHBondContact O-N 2.77Å; K145-E232 WeakPolarHBondContact CB-OE1 3.47Å; K145-T233 WeakPolarHBondContact CE-O 3.43Å; K145-L253 HydrophobicContact CB-CD1 4.25Å; K145-L253 HydrophobicContact CG-CD1 3.92Å
146	S	89.9	Confident	91.5	Very high	11 Å²	11	20.5 Å²	20.5	8%	0.077	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-36	-176	-36.7	0	0	0	0	112.2	I149 E150 E232	S146-I149 PolarHBondContact O-N 3.22Å; S146-E150 PolarHBondContact O-N 3.45Å; S146-E232 PolarHBondContact N-OE1 2.93Å; S146-E232 PolarHBondContact OG-OE1 2.82Å
147	T	91.6	Very high	91.7	Very high	79 Å²	79	20.9 Å²	20.9	49%	0.485	14%	0.138	S	C	.	.	H	α-helix	trans	-66.5	-40.6	174.4	-46.2	0	0	0	0	111.9	G144 K145 A151 A319	G144-T147 PolarHBondContact O-N 3.34Å; K145-T147 VanDerWaalsContact C-N 3.31Å; K145-T147 PolarHBondContact O-N 2.74Å; T147-A151 PolarHBondContact O-N 2.83Å; T147-A319 HydrophobicContact CG2-CB 3.77Å
148	F	94.8	Very high	91.9	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.018	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-46.3	174.2	173.6	-96.4	0	0	0	111.2	I137 G144 K145 E150 A151 F152 L253 V277 A317 I325 I328	I137-F148 HydrophobicContact CD1-CD1 4.39Å; I137-F148 HydrophobicContact CD1-CE1 4.13Å; I137-F148 HydrophobicContact CG2-CD1 4.38Å; G144-F148 VanDerWaalsContact O-CB 3.29Å; G144-F148 WeakPolarHBondContact O-CB 3.06Å; G144-F148 PolarHBondContact O-N 2.88Å; K145-F148 WeakPolarHBondContact O-CB 3.31Å; K145-F148 PolarHBondContact O-N 3.01Å; K145-F148 VanDerWaalsContact O-N 3.13Å; F148-E150 VanDerWaalsContact C-N 3.34Å; F148-E150 PolarHBondContact O-N 2.9Å; F148-A151 PolarHBondContact O-N 3.34Å; F148-F152 HydrophobicContact CE1-CB 4.26Å; F148-F152 HydrophobicContact CE1-CG 4.38Å; F148-F152 HydrophobicContact CZ-CB 4.25Å; F148-F152 HydrophobicContact CZ-CD2 4.33Å; F148-F152 HydrophobicContact CZ-CG 4.26Å; F148-F152 WeakPolarHBondContact O-CB 3.44Å; F148-F152 PolarHBondContact O-N 3.35Å; F148-L253 HydrophobicContact CB-CD1 3.78Å; F148-L253 HydrophobicContact CD1-CD1 3.75Å; F148-L253 HydrophobicContact CD1-CD2 4.05Å; F148-L253 HydrophobicContact CE1-CD2 4.13Å; F148-L253 HydrophobicContact CG-CD1 3.83Å; F148-L253 HydrophobicContact CG-CD2 4.32Å; F148-L253 HydrophobicContact CZ-CD2 4.46Å; F148-V277 HydrophobicContact CE2-CG1 4.31Å; F148-A317 HydrophobicContact CE2-CB 4.42Å; F148-I325 HydrophobicContact CD2-CD1 4.01Å; F148-I325 HydrophobicContact CE2-CD1 3.65Å; F148-I328 HydrophobicContact CE2-CD1 3.76Å; F148-I328 HydrophobicContact CZ-CD1 4.13Å; F148-I328 HydrophobicContact CZ-CG2 4.21Å
149	I	95.3	Very high	92.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-42.4	177.9	-67.4	164.4	0	0	0	110.9	I137 K145 S146 G153 V166 M187 L190 L230 E232	I137-I149 HydrophobicContact CB-CD1 4.37Å; I137-I149 HydrophobicContact CD1-CD1 4.27Å; I137-I149 HydrophobicContact CD1-CG1 3.65Å; I137-I149 HydrophobicContact CG2-CD1 4.23Å; I137-I149 HydrophobicContact CG2-CG1 4.24Å; K145-I149 VanDerWaalsContact O-CG1 3.32Å; K145-I149 WeakPolarHBondContact O-CG1 3.36Å; K145-I149 PolarHBondContact O-N 2.77Å; S146-I149 PolarHBondContact O-N 3.22Å; I149-G153 WeakPolarHBondContact O-CA 3.27Å; I149-G153 PolarHBondContact O-N 3.06Å; I149-V166 HydrophobicContact CG2-CG1 3.94Å; I149-V166 HydrophobicContact CG2-CG2 4.04Å; I149-M187 HydrophobicContact CB-SD 3.94Å; I149-M187 HydrophobicContact CG2-SD 3.46Å; I149-M187 WeakPolarHBondContact CG2-SD 3.37Å; I149-L190 HydrophobicContact CG2-CD2 4.18Å; I149-L230 HydrophobicContact CG2-CD1 4.17Å; I149-E232 HydrophobicContact CD1-CB 3.6Å; I149-E232 VanDerWaalsContact CD1-CD 3.48Å; I149-E232 HydrophobicContact CD1-CG 3.57Å
150	E	94.8	Very high	92.8	Very high	34 Å²	34	33.3 Å²	33.3	16%	0.159	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-52.4	174.7	178.4	167.2	-86.6	0	0	111.2	S146 F148 F152 L154 M187 T188 N189 L190	S146-E150 PolarHBondContact O-N 3.45Å; F148-E150 VanDerWaalsContact C-N 3.34Å; F148-E150 PolarHBondContact O-N 2.9Å; E150-F152 PolarHBondContact O-N 2.81Å; E150-L154 HydrophobicContact CG-CD1 3.91Å; E150-L154 WeakPolarHBondContact O-CB 3.5Å; E150-L154 WeakPolarHBondContact O-CG 3.43Å; E150-L154 PolarHBondContact O-N 3.3Å; E150-M187 HydrophobicContact CB-CG 4.25Å; E150-M187 WeakPolarHBondContact OE1-CA 3.35Å; E150-T188 PolarHBondContact OE1-N 3.1Å; E150-N189 HydrophobicContact CG-CB 4.31Å; E150-N189 PolarHBondContact OE1-N 3.46Å; E150-N189 PolarHBondContact OE2-ND2 3.41Å; E150-L190 HydrophobicContact CG-CB 4.12Å
151	A	96.1	Very high	93.7	Very high	14 Å²	14	39.3 Å²	39.3	12%	0.116	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-43.9	-178.9	0	0	0	0	0	112.4	T147 F148 Y155 A319	T147-A151 PolarHBondContact O-N 2.83Å; F148-A151 PolarHBondContact O-N 3.34Å; A151-Y155 PolarHBondContact O-N 3.11Å; A151-Y155 VanDerWaalsContact O-N 3.08Å; A151-A319 HydrophobicContact CB-CB 3.99Å
152	F	97.6	Very high	94.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.5	-45.8	179.8	-175.7	-110.5	0	0	0	111.8	F148 E150 L154 Y155 L156 L230 I325 I328 W329 M332	F148-F152 HydrophobicContact CE1-CB 4.26Å; F148-F152 HydrophobicContact CE1-CG 4.38Å; F148-F152 HydrophobicContact CZ-CB 4.25Å; F148-F152 HydrophobicContact CZ-CD2 4.33Å; F148-F152 HydrophobicContact CZ-CG 4.26Å; F148-F152 WeakPolarHBondContact O-CB 3.44Å; F148-F152 PolarHBondContact O-N 3.35Å; E150-F152 PolarHBondContact O-N 2.81Å; F152-L154 VanDerWaalsContact C-N 3.35Å; F152-L154 PolarHBondContact O-N 3.03Å; F152-Y155 WeakPolarHBondContact O-CB 3.26Å; F152-Y155 PolarHBondContact O-N 3.26Å; F152-L156 HydrophobicContact CD1-CD1 3.79Å; F152-L156 HydrophobicContact CD1-CG 4.4Å; F152-L156 HydrophobicContact CE1-CD1 3.43Å; F152-L156 VanDerWaalsContact CE1-CD1 3.43Å; F152-L156 HydrophobicContact CE1-CG 4.11Å; F152-L156 HydrophobicContact CZ-CD1 3.93Å; F152-L156 HydrophobicContact CZ-CD2 4.17Å; F152-L156 HydrophobicContact CZ-CG 4.17Å; F152-L156 WeakPolarHBondContact O-CG 3.3Å; F152-L156 PolarHBondContact O-N 3.04Å; F152-L230 HydrophobicContact CD1-CD1 4.03Å; F152-L230 HydrophobicContact CD1-CD2 4.47Å; F152-L230 HydrophobicContact CE1-CD1 4.46Å; F152-L230 HydrophobicContact CE1-CD2 4.16Å; F152-I325 HydrophobicContact CD2-CG2 4.07Å; F152-I328 HydrophobicContact CE2-CG2 4.06Å; F152-W329 HydrophobicContact CE2-CB 4.13Å; F152-W329 AromaticContact CZ-CE3 4Å; F152-W329 HydrophobicContact CZ-CE3 4Å; F152-M332 HydrophobicContact CE1-CE 3.95Å; F152-M332 HydrophobicContact CE1-SD 4.03Å; F152-M332 HydrophobicContact CE2-SD 4Å; F152-M332 HydrophobicContact CZ-CE 3.75Å; F152-M332 HydrophobicContact CZ-SD 3.37Å; F152-M332 WeakPolarHBondContact CZ-SD 3.44Å
153	G	97.4	Very high	95.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-41.8	176.5	0	0	0	0	0	112.3	I149 L156 I157	I149-G153 WeakPolarHBondContact O-CA 3.27Å; I149-G153 PolarHBondContact O-N 3.06Å; G153-L156 PolarHBondContact O-N 3.48Å; G153-I157 WeakPolarHBondContact O-CG1 3.33Å; G153-I157 PolarHBondContact O-N 3.45Å
154	L	97.3	Very high	95.6	Very high	27 Å²	27	40.4 Å²	40.4	14%	0.141	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-41.1	174.4	-73.8	171.1	0	0	0	112.2	E150 F152 I157 K158 N189 L190 E193	E150-L154 HydrophobicContact CG-CD1 3.91Å; E150-L154 WeakPolarHBondContact O-CB 3.5Å; E150-L154 WeakPolarHBondContact O-CG 3.43Å; E150-L154 PolarHBondContact O-N 3.3Å; F152-L154 VanDerWaalsContact C-N 3.35Å; F152-L154 PolarHBondContact O-N 3.03Å; L154-I157 PolarHBondContact O-N 2.72Å; L154-K158 VanDerWaalsContact O-CB 3.27Å; L154-K158 WeakPolarHBondContact O-CB 3.26Å; L154-K158 WeakPolarHBondContact O-CG 3.29Å; L154-K158 PolarHBondContact O-N 3.41Å; L154-N189 HydrophobicContact CD1-CB 3.93Å; L154-L190 HydrophobicContact CG-CD1 4.46Å; L154-E193 HydrophobicContact CD2-CG 3.66Å
155	Y	98	Very high	96	Very high	52 Å²	52	39.4 Å²	39.4	20%	0.204	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-46.1	174.5	174.1	-99.4	0	0	0	111.6	A151 F152 I157 K158 E159 I160 I325 P326 W329	A151-Y155 PolarHBondContact O-N 3.11Å; A151-Y155 VanDerWaalsContact O-N 3.08Å; F152-Y155 WeakPolarHBondContact O-CB 3.26Å; F152-Y155 PolarHBondContact O-N 3.26Å; Y155-I157 VanDerWaalsContact C-N 3.32Å; Y155-I157 PolarHBondContact O-N 2.84Å; Y155-K158 PolarHBondContact O-N 3.01Å; Y155-E159 HydrophobicContact CD2-CB 3.82Å; Y155-E159 HydrophobicContact CD2-CG 3.52Å; Y155-E159 HydrophobicContact CE2-CB 3.72Å; Y155-E159 HydrophobicContact CE2-CG 3.73Å; Y155-E159 HydrophobicContact CG-CB 4.48Å; Y155-E159 HydrophobicContact CG-CG 4.41Å; Y155-E159 WeakPolarHBondContact O-CA 3.36Å; Y155-E159 WeakPolarHBondContact O-CB 3.5Å; Y155-E159 PolarHBondContact O-N 2.9Å; Y155-I160 HydrophobicContact CD1-CG1 4.07Å; Y155-I160 HydrophobicContact CE1-CD1 3.82Å; Y155-I160 HydrophobicContact CE1-CG1 3.6Å; Y155-I160 PolarHBondContact O-N 3.29Å; Y155-I325 HydrophobicContact CD1-CG2 3.72Å; Y155-I325 HydrophobicContact CD2-CG2 4.09Å; Y155-I325 HydrophobicContact CE1-CG2 4.39Å; Y155-I325 HydrophobicContact CG-CG2 3.54Å; Y155-P326 HydrophobicContact CE2-CB 4.45Å; Y155-P326 HydrophobicContact CE2-CG 3.92Å; Y155-P326 WeakPolarHBondContact OH-CB 3.17Å; Y155-W329 HydrophobicContact CE1-CB 3.87Å; Y155-W329 HydrophobicContact CE1-CG 4.12Å
156	L	98.1	Very high	96.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-41.5	177.3	-71.1	174.3	0	0	0	112.6	F152 G153 I160 K161 K162 V164 I228 W329	F152-L156 HydrophobicContact CD1-CD1 3.79Å; F152-L156 HydrophobicContact CD1-CG 4.4Å; F152-L156 HydrophobicContact CE1-CD1 3.43Å; F152-L156 VanDerWaalsContact CE1-CD1 3.43Å; F152-L156 HydrophobicContact CE1-CG 4.11Å; F152-L156 HydrophobicContact CZ-CD1 3.93Å; F152-L156 HydrophobicContact CZ-CD2 4.17Å; F152-L156 HydrophobicContact CZ-CG 4.17Å; F152-L156 WeakPolarHBondContact O-CG 3.3Å; F152-L156 PolarHBondContact O-N 3.04Å; G153-L156 PolarHBondContact O-N 3.48Å; L156-I160 HydrophobicContact CD2-CG1 4.38Å; L156-I160 CarbonylContact O-C 3.35Å; L156-I160 WeakPolarHBondContact O-CB 3.41Å; L156-I160 PolarHBondContact O-N 3.29Å; L156-K161 PolarHBondContact O-N 2.65Å; L156-K162 HydrophobicContact CB-CB 4.4Å; L156-K162 PolarHBondContact O-N 2.84Å; L156-V164 HydrophobicContact CB-CG2 3.76Å; L156-V164 HydrophobicContact CD1-CG2 3.99Å; L156-I228 HydrophobicContact CD1-CD1 4.02Å; L156-I228 HydrophobicContact CD1-CG2 4.04Å; L156-W329 HydrophobicContact CD2-CD2 3.79Å; L156-W329 HydrophobicContact CD2-CE3 3.56Å; L156-W329 HydrophobicContact CD2-CG 4.45Å; L156-W329 HydrophobicContact CD2-CH2 4.17Å; L156-W329 HydrophobicContact CD2-CZ2 4.4Å; L156-W329 HydrophobicContact CD2-CZ3 3.76Å
157	I	97.9	Very high	96.3	Very high	8 Å²	8	38.3 Å²	38.3	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-73.8	-48.4	179.9	-68.1	167.5	0	0	0	111.2	G153 L154 Y155 K161 K162 V164 L190 E193 N195 C196	G153-I157 WeakPolarHBondContact O-CG1 3.33Å; G153-I157 PolarHBondContact O-N 3.45Å; L154-I157 PolarHBondContact O-N 2.72Å; Y155-I157 VanDerWaalsContact C-N 3.32Å; Y155-I157 PolarHBondContact O-N 2.84Å; I157-K161 WeakPolarHBondContact O-CA 3.47Å; I157-K161 PolarHBondContact O-N 2.88Å; I157-K162 WeakPolarHBondContact CG1-O 3.31Å; I157-V164 HydrophobicContact CD1-CB 4.42Å; I157-V164 HydrophobicContact CD1-CG2 4.32Å; I157-V164 HydrophobicContact CG1-CB 4.43Å; I157-V164 HydrophobicContact CG1-CG2 3.84Å; I157-L190 HydrophobicContact CD1-CD1 3.66Å; I157-E193 HydrophobicContact CD1-CB 3.85Å; I157-E193 HydrophobicContact CD1-CG 4.2Å; I157-N195 HydrophobicContact CD1-CB 4.49Å; I157-N195 HydrophobicContact CG1-CB 4.27Å; I157-N195 HydrophobicContact CG2-CB 4.05Å; I157-C196 HydrophobicContact CD1-CB 3.75Å
158	K	97.4	Very high	96.1	Very high	91 Å²	91	34.7 Å²	34.7	40%	0.396	16%	0.159	S	C	.	.	H	α-helix	trans	-83.3	-41.3	-169.1	-65.8	-176.7	179.2	179.2	0	113	L154 Y155 K161 E193	L154-K158 VanDerWaalsContact O-CB 3.27Å; L154-K158 WeakPolarHBondContact O-CB 3.26Å; L154-K158 WeakPolarHBondContact O-CG 3.29Å; L154-K158 PolarHBondContact O-N 3.41Å; Y155-K158 PolarHBondContact O-N 3.01Å; K158-K161 VanDerWaalsContact O-CE 3.28Å; K158-K161 WeakPolarHBondContact O-CE 3.31Å; K158-K161 PolarHBondContact O-NZ 3.18Å; K158-E193 VanDerWaalsContact CE-CD 3.46Å; K158-E193 WeakPolarHBondContact CE-OE1 3.3Å; K158-E193 IonicContact NZ-OE1 2.75Å; K158-E193 PolarHBondContact NZ-OE1 3.34Å
159	E	97.3	Very high	95.4	Very high	132 Å²	132	34.8 Å²	34.8	62%	0.617	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-46	-176.2	-52.9	-53.6	141.4	0	0	111.6	Y155	Y155-E159 HydrophobicContact CD2-CB 3.82Å; Y155-E159 HydrophobicContact CD2-CG 3.52Å; Y155-E159 HydrophobicContact CE2-CB 3.72Å; Y155-E159 HydrophobicContact CE2-CG 3.73Å; Y155-E159 HydrophobicContact CG-CB 4.48Å; Y155-E159 HydrophobicContact CG-CG 4.41Å; Y155-E159 WeakPolarHBondContact O-CA 3.36Å; Y155-E159 WeakPolarHBondContact O-CB 3.5Å; Y155-E159 PolarHBondContact O-N 2.9Å
160	I	97.5	Very high	94.3	Very high	47 Å²	47	35.7 Å²	35.7	24%	0.241	16%	0.164	C	C	.	.	S	Bend	trans	-90.9	-10.5	-175.2	-47.5	-59.3	0	0	0	112.9	Y155 L156 K162 W329	Y155-I160 HydrophobicContact CD1-CG1 4.07Å; Y155-I160 HydrophobicContact CE1-CD1 3.82Å; Y155-I160 HydrophobicContact CE1-CG1 3.6Å; Y155-I160 PolarHBondContact O-N 3.29Å; L156-I160 HydrophobicContact CD2-CG1 4.38Å; L156-I160 CarbonylContact O-C 3.35Å; L156-I160 WeakPolarHBondContact O-CB 3.41Å; L156-I160 PolarHBondContact O-N 3.29Å; I160-K162 HydrophobicContact CB-CG 4.19Å; I160-K162 HydrophobicContact CG2-CD 4.37Å; I160-K162 HydrophobicContact CG2-CG 3.76Å; I160-W329 HydrophobicContact CG2-CZ2 4.03Å
161	K	97.6	Very high	92.8	Very high	160 Å²	160	35.5 Å²	35.5	70%	0.696	17%	0.166	S	C	*	.			trans	58.7	44.4	179.4	-50.9	-55.7	-172.5	-170.2	0	113.9	L156 I157 K158	L156-K161 PolarHBondContact O-N 2.65Å; I157-K161 WeakPolarHBondContact O-CA 3.47Å; I157-K161 PolarHBondContact O-N 2.88Å; K158-K161 VanDerWaalsContact O-CE 3.28Å; K158-K161 WeakPolarHBondContact O-CE 3.31Å; K158-K161 PolarHBondContact O-NZ 3.18Å
162	K	97.1	Very high	91.2	Very high	65 Å²	65	37.8 Å²	37.8	28%	0.283	18%	0.181	S	C	.	.			trans	-101.3	150.4	178	-61	-58.7	-171.5	177	0	113	L156 I157 I160 D227	L156-K162 HydrophobicContact CB-CB 4.4Å; L156-K162 PolarHBondContact O-N 2.84Å; I157-K162 WeakPolarHBondContact CG1-O 3.31Å; I160-K162 HydrophobicContact CB-CG 4.19Å; I160-K162 HydrophobicContact CG2-CD 4.37Å; I160-K162 HydrophobicContact CG2-CG 3.76Å; K162-D227 WeakPolarHBondContact CA-OD2 3.47Å; K162-D227 HydrophobicContact CB-CB 4.14Å; K162-D227 HydrophobicContact CD-CB 3.79Å; K162-D227 HydrophobicContact CG-CB 4.41Å
163	K	97	Very high	89.4	Confident	87 Å²	87	37.9 Å²	37.9	38%	0.378	18%	0.182	S	C	.	.			trans	-86.6	124.3	163.5	-70.8	-175.3	176.2	-174	0	110.2	N195 Y226 D227 I228	K163-N195 CarbonylContact C-O 3.57Å; K163-N195 WeakPolarHBondContact CA-O 3.44Å; K163-N195 HydrophobicContact CG-CB 4.11Å; K163-Y226 HydrophobicContact CB-CD1 3.99Å; K163-D227 PolarHBondContact N-OD2 3.21Å; K163-D227 PolarHBondContact O-N 2.94Å; K163-I228 PolarHBondContact O-N 3.4Å
164	V	97.8	Very high	87.4	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.4	-171.5	-177.9	0	0	0	0	110.5	L156 I157 V166 N195 C196 Y197 I228 L230	L156-V164 HydrophobicContact CB-CG2 3.76Å; L156-V164 HydrophobicContact CD1-CG2 3.99Å; I157-V164 HydrophobicContact CD1-CB 4.42Å; I157-V164 HydrophobicContact CD1-CG2 4.32Å; I157-V164 HydrophobicContact CG1-CB 4.43Å; I157-V164 HydrophobicContact CG1-CG2 3.84Å; V164-V166 HydrophobicContact CG1-CG2 4.15Å; V164-N195 PolarHBondContact N-O 3.18Å; V164-C196 CarbonylContact O-C 3.32Å; V164-C196 WeakPolarHBondContact O-CA 3.46Å; V164-Y197 PolarHBondContact O-N 3.2Å; V164-I228 HydrophobicContact CB-CG2 4.24Å; V164-I228 HydrophobicContact CG1-CG2 4.23Å; V164-I228 HydrophobicContact CG2-CG2 3.8Å; V164-L230 HydrophobicContact CG1-CD1 3.89Å; V164-L230 HydrophobicContact CG1-CG 4.11Å
165	A	96.3	Very high	85.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138.2	165.9	0	0	0	0	0	109.4	Y197 C221 Y226 I228 V229 L230	A165-Y197 CarbonylContact C-O 3.51Å; A165-Y197 VanDerWaalsContact CA-O 3.32Å; A165-Y197 WeakPolarHBondContact CA-O 3.49Å; A165-C221 HydrophobicContact CB-CB 3.82Å; A165-Y226 HydrophobicContact CB-CD1 3.79Å; A165-Y226 HydrophobicContact CB-CD2 4.45Å; A165-Y226 HydrophobicContact CB-CE1 4.25Å; A165-Y226 HydrophobicContact CB-CG 3.91Å; A165-I228 PolarHBondContact N-O 3.31Å; A165-V229 HydrophobicContact CB-CG1 4.34Å; A165-V229 HydrophobicContact CB-CG2 4.25Å; A165-V229 CarbonylContact O-C 3.56Å; A165-V229 WeakPolarHBondContact O-CA 3.47Å; A165-L230 PolarHBondContact O-N 2.58Å
166	V	94.8	Very high	83.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121	174	-174.6	0	0	0	0	108.2	I149 V164 M187 L190 Y197 I198 R199 L230	I149-V166 HydrophobicContact CG2-CG1 3.94Å; I149-V166 HydrophobicContact CG2-CG2 4.04Å; V164-V166 HydrophobicContact CG1-CG2 4.15Å; V166-M187 HydrophobicContact CG1-CE 4Å; V166-M187 HydrophobicContact CG1-SD 4.25Å; V166-L190 HydrophobicContact CG2-CD2 3.99Å; V166-Y197 PolarHBondContact N-O 3.45Å; V166-I198 HydrophobicContact CB-CG1 4.15Å; V166-I198 HydrophobicContact CB-CG2 4.35Å; V166-I198 HydrophobicContact CG2-CG1 4.42Å; V166-I198 CarbonylContact O-C 3.6Å; V166-I198 VanDerWaalsContact O-CA 3.31Å; V166-I198 WeakPolarHBondContact O-CA 3.1Å; V166-R199 PolarHBondContact O-N 2.88Å; V166-L230 CarbonylContact C-O 3.54Å; V166-L230 VanDerWaalsContact CA-O 3.31Å; V166-L230 WeakPolarHBondContact CA-O 3.34Å; V166-L230 HydrophobicContact CG2-CB 4.36Å; V166-L230 HydrophobicContact CG2-CD1 4.38Å
167	L	91.7	Very high	81.5	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.8	177.2	-52.2	178.7	0	0	0	107.7	R199 V218 V229 L230 I231 E232	L167-R199 HydrophobicContact CD2-CB 3.61Å; L167-R199 HydrophobicContact CD2-CG 4.35Å; L167-V218 HydrophobicContact CD1-CB 4.42Å; L167-V218 HydrophobicContact CD1-CG2 3.7Å; L167-V229 HydrophobicContact CD1-CG1 3.65Å; L167-V229 HydrophobicContact CG-CG1 3.95Å; L167-L230 PolarHBondContact N-O 3.38Å; L167-I231 CarbonylContact O-C 3.53Å; L167-I231 VanDerWaalsContact O-CA 3.31Å; L167-I231 WeakPolarHBondContact O-CA 3.28Å; L167-E232 PolarHBondContact O-N 3.35Å
168	T	86.9	Confident	79.4	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	144.1	174	72.9	0	0	0	0	109.9	D183 M187 R199 P200 S201 E232	T168-D183 VanDerWaalsContact CB-OD2 3.3Å; T168-D183 WeakPolarHBondContact CB-OD2 3.38Å; T168-D183 HydrophobicContact CG2-CB 3.89Å; T168-D183 PolarHBondContact OG1-OD2 3.46Å; T168-M187 HydrophobicContact CG2-CE 4.39Å; T168-R199 PolarHBondContact N-O 2.7Å; T168-P200 WeakPolarHBondContact OG1-CA 3.33Å; T168-S201 WeakPolarHBondContact O-CA 3.49Å; T168-S201 VanDerWaalsContact O-CB 3.31Å; T168-S201 WeakPolarHBondContact O-CB 3.41Å; T168-S201 PolarHBondContact O-N 3.45Å; T168-S201 PolarHBondContact O-OG 3.35Å; T168-S201 PolarHBondContact OG1-N 3.1Å; T168-S201 VanDerWaalsContact OG1-N 3.11Å; T168-S201 PolarHBondContact OG1-OG 3.22Å; T168-E232 CarbonylContact C-O 3.57Å; T168-E232 HydrophobicContact CG2-CB 4.26Å
169	V	79	Confident	77.2	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.03	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	105.4	-179.3	-176	0	0	0	0	109.8	S201 V210 T214 I231 E232 V234 V243	V169-S201 WeakPolarHBondContact CA-OG 3Å; V169-S201 PolarHBondContact N-OG 3.16Å; V169-V210 HydrophobicContact CG1-CG1 3.71Å; V169-T214 HydrophobicContact CG2-CG2 3.63Å; V169-I231 HydrophobicContact CG2-CG2 3.58Å; V169-E232 PolarHBondContact N-O 3.16Å; V169-V234 PolarHBondContact O-N 3.3Å; V169-V243 HydrophobicContact CB-CG1 4.41Å; V169-V243 HydrophobicContact CG2-CG1 4.28Å
170	D	73.4	Confident	75	Confident	19 Å²	19	54.5 Å²	54.5	10%	0.102	29%	0.29	C	S	.	.			trans	-116.3	105	179	-173.8	-3.9	0	0	0	110.3	S172 S173 S201 V234	D170-S172 PolarHBondContact O-N 3.08Å; D170-S172 WeakPolarHBondContact OD1-CA 3.33Å; D170-S172 WeakPolarHBondContact OD1-CB 3.42Å; D170-S172 PolarHBondContact OD1-N 2.82Å; D170-S172 PolarHBondContact OD1-OG 2.78Å; D170-S172 PolarHBondContact OD2-OG 3.48Å; D170-S173 WeakPolarHBondContact O-CB 3.5Å; D170-S173 PolarHBondContact O-N 2.78Å; D170-S173 VanDerWaalsContact O-N 3.16Å; D170-S173 PolarHBondContact O-OG 3.3Å; D170-S201 PolarHBondContact N-OG 3.14Å; D170-V234 HydrophobicContact CB-CB 3.77Å; D170-V234 HydrophobicContact CB-CG1 4.24Å; D170-V234 HydrophobicContact CB-CG2 4.17Å
171	P	63.9	Low	72.8	Confident	31 Å²	31	59.6 Å²	59.6	20%	0.201	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.6	173.3	-22.8	33.4	0	0	0	113.9	S173 V174 L207 S239	P171-S173 PolarHBondContact O-N 2.87Å; P171-V174 WeakPolarHBondContact O-CB 3.3Å; P171-V174 WeakPolarHBondContact O-CG2 3.16Å; P171-V174 PolarHBondContact O-N 2.89Å; P171-L207 HydrophobicContact CB-CD1 3.89Å; P171-L207 HydrophobicContact CG-CD1 4.14Å; P171-S239 WeakPolarHBondContact CG-OG 3.33Å
172	S	62.3	Low	70.9	Confident	61 Å²	61	53.6 Å²	53.6	43%	0.427	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.6	179.7	83.7	0	0	0	0	112.2	D170 V174 R175 T176	D170-S172 PolarHBondContact O-N 3.08Å; D170-S172 WeakPolarHBondContact OD1-CA 3.33Å; D170-S172 WeakPolarHBondContact OD1-CB 3.42Å; D170-S172 PolarHBondContact OD1-N 2.82Å; D170-S172 PolarHBondContact OD1-OG 2.78Å; D170-S172 PolarHBondContact OD2-OG 3.48Å; S172-V174 PolarHBondContact O-N 3.36Å; S172-R175 PolarHBondContact O-N 2.79Å; S172-T176 PolarHBondContact O-N 2.94Å; S172-T176 VanDerWaalsContact O-N 3.12Å; S172-T176 PolarHBondContact O-OG1 3.27Å
173	S	58.5	Low	69.3	Low	3 Å²	3	50.9 Å²	50.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-54.1	-25.1	170.9	67.1	0	0	0	0	113.1	D170 P171 R175 G177 G178	D170-S173 WeakPolarHBondContact O-CB 3.5Å; D170-S173 PolarHBondContact O-N 2.78Å; D170-S173 VanDerWaalsContact O-N 3.16Å; D170-S173 PolarHBondContact O-OG 3.3Å; P171-S173 PolarHBondContact O-N 2.87Å; S173-R175 PolarHBondContact O-N 3.13Å; S173-G177 WeakPolarHBondContact O-CA 3.39Å; S173-G177 PolarHBondContact O-N 3.45Å; S173-G178 PolarHBondContact O-N 3.48Å
174	V	56.5	Low	67.6	Low	66 Å²	66	48.8 Å²	48.8	40%	0.4	28%	0.282	S	S	.	.	H	α-helix	trans	-56.5	-37.9	172.1	176.3	0	0	0	0	111.4	P171 S172 S204 G205 V210	P171-V174 WeakPolarHBondContact O-CB 3.3Å; P171-V174 WeakPolarHBondContact O-CG2 3.16Å; P171-V174 PolarHBondContact O-N 2.89Å; S172-V174 PolarHBondContact O-N 3.36Å; V174-S204 WeakPolarHBondContact CG2-O 3.19Å; V174-G205 WeakPolarHBondContact CG1-O 3.11Å; V174-V210 HydrophobicContact CG2-CG2 4.34Å
175	R	58.6	Low	65.8	Low	234 Å²	234	51.9 Å²	51.9	88%	0.883	31%	0.307	S	S	*	.	H	α-helix	trans	-93.1	-37	-178.3	-169.8	178.4	-178.7	-172.5	0.7	112.7	S172 S173	S172-R175 PolarHBondContact O-N 2.79Å; S173-R175 PolarHBondContact O-N 3.13Å
176	T	57.8	Low	64.7	Low	93 Å²	93	59.3 Å²	59.3	57%	0.571	34%	0.335	S	S	*	.	H	α-helix	trans	-93	-10.2	-171.4	56.9	0	0	0	0	113.9	S172	S172-T176 PolarHBondContact O-N 2.94Å; S172-T176 VanDerWaalsContact O-N 3.12Å; S172-T176 PolarHBondContact O-OG1 3.27Å
177	G	52.7	Low	64.1	Low	53 Å²	53	59.3 Å²	59.3	55%	0.546	34%	0.335	S	S	.	.			trans	71	24.1	-172.9	0	0	0	0	0	112.8	S173 T203	S173-G177 WeakPolarHBondContact O-CA 3.39Å; S173-G177 PolarHBondContact O-N 3.45Å; G177-T203 WeakPolarHBondContact O-CG2 3.15Å
178	G	53.3	Low	63.9	Low	17 Å²	17	61.7 Å²	61.7	18%	0.175	35%	0.35	C	S	.	.			trans	77.3	140.6	173.4	0	0	0	0	0	113.9	S173	S173-G178 PolarHBondContact O-N 3.48Å
179	S	51.5	Low	64.1	Low	51 Å²	51	65.2 Å²	65.2	36%	0.357	37%	0.369	S	S	.	.			trans	-94	112.2	171.5	94.3	0	0	0	0	108.8
180	I	50.2	Low	64.8	Low	145 Å²	145	65 Å²	65	74%	0.744	37%	0.368	S	S	*	.	S	Bend	trans	-74	-32.5	-176.9	-62.9	174.3	0	0	0	111.3	P200	I180-P200 VanDerWaalsContact O-CG 3.3Å; I180-P200 WeakPolarHBondContact O-CG 3.42Å
181	M	52.6	Low	65.6	Low	153 Å²	153	66.3 Å²	66.3	75%	0.754	38%	0.378	S	S	*	.	S	Bend	trans	-118.9	-16.8	-165.1	-140.6	157.8	75.4	0	0	114.5	D183 A185	M181-D183 PolarHBondContact O-N 2.87Å; M181-A185 WeakPolarHBondContact O-CB 3.43Å; M181-A185 PolarHBondContact O-N 2.88Å
182	G	58	Low	66.9	Low	35 Å²	35	73.3 Å²	73.3	36%	0.361	40%	0.401	S	S	.	.	H	α-helix	trans	-64.9	-43.2	-170.2	0	0	0	0	0	113.4
183	D	63.7	Low	68.5	Low	8 Å²	8	72.6 Å²	72.6	4%	0.043	39%	0.391	C	S	.	.	H	α-helix	trans	-77.6	-38.8	-176.9	-65.8	-19.1	0	0	0	112.1	T168 M181 A185 R186	T168-D183 VanDerWaalsContact CB-OD2 3.3Å; T168-D183 WeakPolarHBondContact CB-OD2 3.38Å; T168-D183 HydrophobicContact CG2-CB 3.89Å; T168-D183 PolarHBondContact OG1-OD2 3.46Å; M181-D183 PolarHBondContact O-N 2.87Å; D183-A185 VanDerWaalsContact C-N 3.3Å; D183-A185 PolarHBondContact O-N 3.12Å; D183-R186 PolarHBondContact O-N 3.31Å; D183-R186 VanDerWaalsContact O-N 3.14Å
184	V	59.8	Low	70.1	Confident	43 Å²	43	78.7 Å²	78.7	26%	0.261	42%	0.423	S	S	.	.	H	α-helix	trans	-63.5	-38.5	178.7	-177.3	0	0	0	0	111	R186 M187 I198 P200	V184-R186 PolarHBondContact O-N 3.41Å; V184-M187 CarbonylContact O-C 3.47Å; V184-M187 PolarHBondContact O-N 3.2Å; V184-M187 VanDerWaalsContact O-N 3.12Å; V184-I198 HydrophobicContact CG2-CG2 4.18Å; V184-P200 HydrophobicContact CG2-CG 3.92Å
185	A	60.8	Low	72	Confident	65 Å²	65	78.8 Å²	78.8	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-61.3	-27.1	177.8	0	0	0	0	0	113.1	M181 D183 M187 T188	M181-A185 WeakPolarHBondContact O-CB 3.43Å; M181-A185 PolarHBondContact O-N 2.88Å; D183-A185 VanDerWaalsContact C-N 3.3Å; D183-A185 PolarHBondContact O-N 3.12Å; A185-M187 VanDerWaalsContact C-N 3.34Å; A185-T188 PolarHBondContact O-OG1 3.12Å
186	R	73.3	Confident	73.7	Confident	155 Å²	155	67.9 Å²	67.9	59%	0.585	38%	0.381	S	S	*	.	H	α-helix	trans	-78.3	-18.4	179	-64.3	177.2	-179.4	-177.9	2.7	113.5	D183 V184	D183-R186 PolarHBondContact O-N 3.31Å; D183-R186 VanDerWaalsContact O-N 3.14Å; V184-R186 PolarHBondContact O-N 3.41Å
187	M	82.6	Confident	75.5	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	52.2	-179.2	-65.9	-178.1	-76.8	0	0	110.4	I149 E150 V166 T168 V184 A185 N189 L190 S191 I198	I149-M187 HydrophobicContact CB-SD 3.94Å; I149-M187 HydrophobicContact CG2-SD 3.46Å; I149-M187 WeakPolarHBondContact CG2-SD 3.37Å; E150-M187 HydrophobicContact CB-CG 4.25Å; E150-M187 WeakPolarHBondContact OE1-CA 3.35Å; V166-M187 HydrophobicContact CG1-CE 4Å; V166-M187 HydrophobicContact CG1-SD 4.25Å; T168-M187 HydrophobicContact CG2-CE 4.39Å; V184-M187 CarbonylContact O-C 3.47Å; V184-M187 PolarHBondContact O-N 3.2Å; V184-M187 VanDerWaalsContact O-N 3.12Å; A185-M187 VanDerWaalsContact C-N 3.34Å; M187-N189 PolarHBondContact O-N 3.27Å; M187-L190 HydrophobicContact CB-CB 4.36Å; M187-L190 PolarHBondContact O-N 3.28Å; M187-L190 HydrophobicContact SD-CD2 4.39Å; M187-S191 VanDerWaalsContact O-CB 3.29Å; M187-S191 WeakPolarHBondContact O-CB 3.48Å; M187-S191 PolarHBondContact O-N 2.9Å; M187-S191 PolarHBondContact O-OG 3.46Å; M187-I198 HydrophobicContact CB-CD1 4.01Å; M187-I198 HydrophobicContact CE-CD1 4.29Å; M187-I198 HydrophobicContact CE-CG2 4.11Å
188	T	86.8	Confident	77.4	Confident	55 Å²	55	63 Å²	63	34%	0.337	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-39.4	-172.5	-66.5	0	0	0	0	112.9	E150 A185 S191 R192	E150-T188 PolarHBondContact OE1-N 3.1Å; A185-T188 PolarHBondContact O-OG1 3.12Å; T188-S191 PolarHBondContact O-OG 3.22Å; T188-R192 WeakPolarHBondContact O-CG 3.36Å
189	N	92.1	Very high	79	Confident	78 Å²	78	64.4 Å²	64.4	42%	0.417	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-42.5	-178.6	-64.8	-52.5	0	0	0	110.8	E150 L154 M187 R192	E150-N189 HydrophobicContact CG-CB 4.31Å; E150-N189 PolarHBondContact OE1-N 3.46Å; E150-N189 PolarHBondContact OE2-ND2 3.41Å; L154-N189 HydrophobicContact CD1-CB 3.93Å; M187-N189 PolarHBondContact O-N 3.27Å; N189-R192 PolarHBondContact O-N 2.82Å
190	L	92.8	Very high	80.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-66.9	-37.8	-179.1	-177.2	61	0	0	0	112	I149 E150 L154 I157 V166 M187 R192 E193 C196 I198	I149-L190 HydrophobicContact CG2-CD2 4.18Å; E150-L190 HydrophobicContact CG-CB 4.12Å; L154-L190 HydrophobicContact CG-CD1 4.46Å; I157-L190 HydrophobicContact CD1-CD1 3.66Å; V166-L190 HydrophobicContact CG2-CD2 3.99Å; M187-L190 HydrophobicContact CB-CB 4.36Å; M187-L190 PolarHBondContact O-N 3.28Å; M187-L190 HydrophobicContact SD-CD2 4.39Å; L190-R192 PolarHBondContact O-N 3.11Å; L190-E193 PolarHBondContact O-N 2.86Å; L190-C196 HydrophobicContact CD1-CB 3.95Å; L190-C196 HydrophobicContact CG-CB 4.27Å; L190-C196 VanDerWaalsContact CG-SG 3.52Å; L190-C196 VanDerWaalsContact O-CB 3.28Å; L190-C196 WeakPolarHBondContact O-CB 3.35Å; L190-I198 HydrophobicContact CD2-CD1 4.48Å; L190-I198 HydrophobicContact CG-CD1 4.31Å
191	S	89.5	Confident	81.5	Confident	47 Å²	47	57.1 Å²	57.1	33%	0.329	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-64.1	-18.1	177.5	56.6	0	0	0	0	114.5	M187 T188	M187-S191 VanDerWaalsContact O-CB 3.29Å; M187-S191 WeakPolarHBondContact O-CB 3.48Å; M187-S191 PolarHBondContact O-N 2.9Å; M187-S191 PolarHBondContact O-OG 3.46Å; T188-S191 PolarHBondContact O-OG 3.22Å
192	R	91.9	Very high	82	Confident	178 Å²	178	50.2 Å²	50.2	67%	0.672	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-89.4	-15.5	177.8	-70	173.6	175.6	153.8	-0.5	113.9	T188 N189 L190	T188-R192 WeakPolarHBondContact O-CG 3.36Å; N189-R192 PolarHBondContact O-N 2.82Å; L190-R192 PolarHBondContact O-N 3.11Å
193	E	95.3	Very high	82	Confident	45 Å²	45	52.1 Å²	52.1	21%	0.21	27%	0.271	C	S	.	.			trans	-74.3	132.5	-176.7	-66.4	-66.9	152.2	0	0	110.9	R87 L154 I157 K158 L190 N195 C196	R87-E193 PolarHBondContact NH2-O 2.88Å; L154-E193 HydrophobicContact CD2-CG 3.66Å; I157-E193 HydrophobicContact CD1-CB 3.85Å; I157-E193 HydrophobicContact CD1-CG 4.2Å; K158-E193 VanDerWaalsContact CE-CD 3.46Å; K158-E193 WeakPolarHBondContact CE-OE1 3.3Å; K158-E193 IonicContact NZ-OE1 2.75Å; K158-E193 PolarHBondContact NZ-OE1 3.34Å; L190-E193 PolarHBondContact O-N 2.86Å; E193-N195 PolarHBondContact O-N 3.3Å; E193-N195 VanDerWaalsContact O-N 3.15Å; E193-C196 HydrophobicContact CB-CB 4.15Å; E193-C196 PolarHBondContact O-N 3.26Å
194	D	92.7	Very high	81.7	Confident	131 Å²	131	52.9 Å²	52.9	70%	0.701	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-9.8	-179.4	-76.8	-27.1	0	0	0	115.9	R87	R87-D194 VanDerWaalsContact CZ-C 3.47Å; R87-D194 IonicContact NH1-OD1 3.63Å; R87-D194 PolarHBondContact NH1-OD1 3.04Å; R87-D194 PolarHBondContact NH2-O 3.38Å
195	N	95.4	Very high	81.5	Confident	68 Å²	68	53.3 Å²	53.3	36%	0.364	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	10.3	173.2	-69	-49.5	0	0	0	113.4	I157 K163 V164 E193	I157-N195 HydrophobicContact CD1-CB 4.49Å; I157-N195 HydrophobicContact CG1-CB 4.27Å; I157-N195 HydrophobicContact CG2-CB 4.05Å; K163-N195 CarbonylContact C-O 3.57Å; K163-N195 WeakPolarHBondContact CA-O 3.44Å; K163-N195 HydrophobicContact CG-CB 4.11Å; V164-N195 PolarHBondContact N-O 3.18Å; E193-N195 PolarHBondContact O-N 3.3Å; E193-N195 VanDerWaalsContact O-N 3.15Å
196	C	95.6	Very high	81.6	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.034	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.7	175.6	-167.4	0	0	0	0	114	R87 I157 V164 L190 E193	R87-C196 VanDerWaalsContact CZ-O 3.28Å; R87-C196 PolarHBondContact NE-O 2.85Å; R87-C196 VanDerWaalsContact NH2-N 3.11Å; R87-C196 PolarHBondContact NH2-O 2.99Å; I157-C196 HydrophobicContact CD1-CB 3.75Å; V164-C196 CarbonylContact O-C 3.32Å; V164-C196 WeakPolarHBondContact O-CA 3.46Å; L190-C196 HydrophobicContact CD1-CB 3.95Å; L190-C196 HydrophobicContact CG-CB 4.27Å; L190-C196 VanDerWaalsContact CG-SG 3.52Å; L190-C196 VanDerWaalsContact O-CB 3.28Å; L190-C196 WeakPolarHBondContact O-CB 3.35Å; E193-C196 HydrophobicContact CB-CB 4.15Å; E193-C196 PolarHBondContact O-N 3.26Å
197	Y	94.4	Very high	81	Confident	19 Å²	19	47.8 Å²	47.8	8%	0.075	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.3	166	170.4	-104.1	0	0	0	110	L90 A91 I94 V164 A165 V166 R199 Y226	L90-Y197 HydrophobicContact CD2-CD1 3.75Å; L90-Y197 HydrophobicContact CD2-CD2 4.36Å; L90-Y197 HydrophobicContact CD2-CE1 3.81Å; L90-Y197 HydrophobicContact CD2-CE2 4.43Å; L90-Y197 HydrophobicContact CD2-CG 4.04Å; L90-Y197 HydrophobicContact CG-CE1 4.15Å; A91-Y197 WeakPolarHBondContact CA-OH 3.46Å; A91-Y197 HydrophobicContact CB-CE2 4.17Å; I94-Y197 HydrophobicContact CD1-CE1 4.01Å; V164-Y197 PolarHBondContact O-N 3.2Å; A165-Y197 CarbonylContact C-O 3.51Å; A165-Y197 VanDerWaalsContact CA-O 3.32Å; A165-Y197 WeakPolarHBondContact CA-O 3.49Å; V166-Y197 PolarHBondContact N-O 3.45Å; Y197-R199 HydrophobicContact CE1-CB 3.79Å; Y197-Y226 VanDerWaalsContact CB-CZ 3.46Å; Y197-Y226 WeakPolarHBondContact CB-OH 3.23Å
198	I	92.3	Very high	80	Confident	24 Å²	24	49.4 Å²	49.4	12%	0.123	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.6	179.6	-52	-171.8	0	0	0	108.5	V166 V184 M187 L190	V166-I198 HydrophobicContact CB-CG1 4.15Å; V166-I198 HydrophobicContact CB-CG2 4.35Å; V166-I198 HydrophobicContact CG2-CG1 4.42Å; V166-I198 CarbonylContact O-C 3.6Å; V166-I198 VanDerWaalsContact O-CA 3.31Å; V166-I198 WeakPolarHBondContact O-CA 3.1Å; V184-I198 HydrophobicContact CG2-CG2 4.18Å; M187-I198 HydrophobicContact CB-CD1 4.01Å; M187-I198 HydrophobicContact CE-CD1 4.29Å; M187-I198 HydrophobicContact CE-CG2 4.11Å; L190-I198 HydrophobicContact CD2-CD1 4.48Å; L190-I198 HydrophobicContact CG-CD1 4.31Å
199	R	88.4	Confident	78.9	Confident	47 Å²	47	47.4 Å²	47.4	18%	0.177	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117	174.6	-178.1	57.7	174.5	-169.5	0.2	109.1	T95 E98 V166 L167 T168 Y197	T95-R199 PolarHBondContact OG1-NH2 3.33Å; E98-R199 IonicContact OE1-NE 2.59Å; E98-R199 IonicContact OE1-NH2 3.77Å; E98-R199 IonicContact OE2-CZ 2.76Å; E98-R199 IonicContact OE2-NH2 3.8Å; E98-R199 PolarHBondContact OE2-NH2 3.13Å; V166-R199 PolarHBondContact O-N 2.88Å; L167-R199 HydrophobicContact CD2-CB 3.61Å; L167-R199 HydrophobicContact CD2-CG 4.35Å; T168-R199 PolarHBondContact N-O 2.7Å; Y197-R199 HydrophobicContact CE1-CB 3.79Å
200	P	81.8	Confident	77.7	Confident	26 Å²	26	43.9 Å²	43.9	17%	0.169	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-60.1	157.8	167.5	-21.2	32	0	0	0	111.7	T168 I180 V184 A202	T168-P200 WeakPolarHBondContact OG1-CA 3.33Å; I180-P200 VanDerWaalsContact O-CG 3.3Å; I180-P200 WeakPolarHBondContact O-CG 3.42Å; V184-P200 HydrophobicContact CG2-CG 3.92Å; P200-A202 PolarHBondContact O-N 2.85Å
201	S	71.4	Confident	76.7	Confident	17 Å²	17	46.2 Å²	46.2	12%	0.119	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-52.4	133.2	179.5	-53	0	0	0	0	114	T168 V169 D170 T203	T168-S201 WeakPolarHBondContact O-CA 3.49Å; T168-S201 VanDerWaalsContact O-CB 3.31Å; T168-S201 WeakPolarHBondContact O-CB 3.41Å; T168-S201 PolarHBondContact O-N 3.45Å; T168-S201 PolarHBondContact O-OG 3.35Å; T168-S201 PolarHBondContact OG1-N 3.1Å; T168-S201 VanDerWaalsContact OG1-N 3.11Å; T168-S201 PolarHBondContact OG1-OG 3.22Å; V169-S201 WeakPolarHBondContact CA-OG 3Å; V169-S201 PolarHBondContact N-OG 3.16Å; D170-S201 PolarHBondContact N-OG 3.14Å; S201-T203 PolarHBondContact O-N 3.04Å
202	A	63.5	Low	76	Confident	8 Å²	8	44.6 Å²	44.6	7%	0.066	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-59.5	131.1	170.8	0	0	0	0	0	110.5	E98 P200 S204	E98-A202 HydrophobicContact CG-CB 4.14Å; E98-A202 WeakPolarHBondContact OE1-CB 3Å; P200-A202 PolarHBondContact O-N 2.85Å; A202-S204 PolarHBondContact O-N 3.49Å
203	T	58.3	Low	75.5	Confident	76 Å²	76	36.4 Å²	36.4	47%	0.466	22%	0.222	S	C	.	.			trans	-75.4	110.1	167.3	46.1	0	0	0	0	109.5	G177 S201	G177-T203 WeakPolarHBondContact O-CG2 3.15Å; S201-T203 PolarHBondContact O-N 3.04Å
204	S	57.3	Low	75	Confident	23 Å²	23	34.6 Å²	34.6	16%	0.161	21%	0.214	C	C	.	.			trans	-132.1	146.8	163.9	78	0	0	0	0	109.3	V174 A202 S206 G209 V210	V174-S204 WeakPolarHBondContact CG2-O 3.19Å; A202-S204 PolarHBondContact O-N 3.49Å; S204-S206 PolarHBondContact O-N 3.1Å; S204-S206 VanDerWaalsContact O-N 3.08Å; S204-S206 PolarHBondContact OG-O 3.21Å; S204-G209 WeakPolarHBondContact OG-CA 3.18Å; S204-V210 WeakPolarHBondContact OG-CA 3.2Å; S204-V210 WeakPolarHBondContact OG-CG2 3.38Å; S204-V210 PolarHBondContact OG-N 3.21Å
205	G	55.1	Low	74.7	Confident	53 Å²	53	28.7 Å²	28.7	55%	0.546	18%	0.183	S	C	.	.	S	Bend	trans	-74.4	7.2	-173.5	0	0	0	0	0	114.4	V174	V174-G205 WeakPolarHBondContact CG1-O 3.11Å
206	S	63.5	Low	74.5	Confident	39 Å²	39	25.6 Å²	25.6	27%	0.273	17%	0.166	S	C	.	.	S	Bend	trans	-147.7	152.5	179.4	68.5	0	0	0	0	110.5	S204 G208 G209 V210	S204-S206 PolarHBondContact O-N 3.1Å; S204-S206 VanDerWaalsContact O-N 3.08Å; S204-S206 PolarHBondContact OG-O 3.21Å; S206-G208 PolarHBondContact O-N 3.29Å; S206-G209 PolarHBondContact O-N 3.27Å; S206-G209 VanDerWaalsContact O-N 3.08Å; S206-G209 PolarHBondContact OG-N 3.3Å; S206-V210 PolarHBondContact O-N 3.01Å; S206-V210 VanDerWaalsContact O-N 3.14Å
207	L	59.7	Low	74.3	Confident	64 Å²	64	25.6 Å²	25.6	34%	0.335	17%	0.166	S	C	.	.	H	α-helix	trans	-57	-36.5	173.9	-175.6	67.5	0	0	0	111.9	P171 V210 R211	P171-L207 HydrophobicContact CB-CD1 3.89Å; P171-L207 HydrophobicContact CG-CD1 4.14Å; L207-V210 PolarHBondContact O-N 3.23Å; L207-R211 PolarHBondContact O-N 3.42Å
208	G	61.5	Low	74.2	Confident	35 Å²	35	24.8 Å²	24.8	36%	0.361	16%	0.163	S	C	.	.	H	α-helix	trans	-64.4	-38.5	175.7	0	0	0	0	0	112.9	S206 V210 R211 S212	S206-G208 PolarHBondContact O-N 3.29Å; G208-V210 VanDerWaalsContact C-N 3.31Å; G208-V210 PolarHBondContact O-N 3.04Å; G208-R211 WeakPolarHBondContact O-CB 3.25Å; G208-R211 PolarHBondContact O-N 3.38Å; G208-S212 PolarHBondContact O-N 3.37Å
209	G	64.4	Low	74.2	Confident	13 Å²	13	23.8 Å²	23.8	13%	0.134	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-35.8	173.2	0	0	0	0	0	112.5	S204 S206 R211 S212 G213	S204-G209 WeakPolarHBondContact OG-CA 3.18Å; S206-G209 PolarHBondContact O-N 3.27Å; S206-G209 VanDerWaalsContact O-N 3.08Å; S206-G209 PolarHBondContact OG-N 3.3Å; G209-R211 VanDerWaalsContact C-N 3.35Å; G209-S212 PolarHBondContact O-N 3.5Å; G209-G213 PolarHBondContact O-N 3.12Å
210	V	67.3	Low	74.5	Confident	3 Å²	3	21.6 Å²	21.6	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-69.2	-41.3	-179.6	175.5	0	0	0	0	108.6	V169 V174 S204 S206 L207 G208 T214	V169-V210 HydrophobicContact CG1-CG1 3.71Å; V174-V210 HydrophobicContact CG2-CG2 4.34Å; S204-V210 WeakPolarHBondContact OG-CA 3.2Å; S204-V210 WeakPolarHBondContact OG-CG2 3.38Å; S204-V210 PolarHBondContact OG-N 3.21Å; S206-V210 PolarHBondContact O-N 3.01Å; S206-V210 VanDerWaalsContact O-N 3.14Å; L207-V210 PolarHBondContact O-N 3.23Å; G208-V210 VanDerWaalsContact C-N 3.31Å; G208-V210 PolarHBondContact O-N 3.04Å; V210-T214 WeakPolarHBondContact O-CB 3.3Å; V210-T214 PolarHBondContact O-N 2.9Å; V210-T214 PolarHBondContact O-OG1 3.41Å
211	R	70.6	Confident	75.2	Confident	49 Å²	49	20.3 Å²	20.3	19%	0.185	14%	0.142	C	C	.	.	H	α-helix	trans	-57.5	-53.7	171.5	-73.3	177.3	-173.4	-145.2	-1.9	111.5	L207 G208 G209 G213 T214 H215 S241 A242 D245	L207-R211 PolarHBondContact O-N 3.42Å; G208-R211 WeakPolarHBondContact O-CB 3.25Å; G208-R211 PolarHBondContact O-N 3.38Å; G209-R211 VanDerWaalsContact C-N 3.35Å; R211-G213 PolarHBondContact O-N 2.67Å; R211-T214 PolarHBondContact O-N 3.45Å; R211-H215 PolarHBondContact O-CD2 2.91Å; R211-H215 VanDerWaalsContact O-CD2 3.3Å; R211-H215 PolarHBondContact O-N 3.49Å; R211-S241 PolarHBondContact NH2-OG 2.75Å; R211-A242 HydrophobicContact CG-CB 3.67Å; R211-A242 VanDerWaalsContact NE-CB 3.34Å; R211-D245 IonicContact NH1-OD2 3.63Å; R211-D245 PolarHBondContact NH1-OD2 3.15Å
212	S	75	Confident	76.2	Confident	14 Å²	14	19.7 Å²	19.7	10%	0.098	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-49.4	-179.1	-163.3	0	0	0	0	111.8	G208 G209 T214 H215 E216 W356	G208-S212 PolarHBondContact O-N 3.37Å; G209-S212 PolarHBondContact O-N 3.5Å; S212-T214 VanDerWaalsContact C-N 3.26Å; S212-T214 PolarHBondContact O-N 3.28Å; S212-H215 PolarHBondContact O-N 2.77Å; S212-E216 VanDerWaalsContact O-CG 3.25Å; S212-E216 WeakPolarHBondContact O-CG 3.48Å; S212-E216 PolarHBondContact O-N 3.19Å; S212-E216 PolarHBondContact OG-OE1 3.09Å; S212-W356 PolarHBondContact OG-NE1 2.97Å
213	G	81.8	Confident	77.6	Confident	5 Å²	5	20 Å²	20	5%	0.052	14%	0.141	C	C	.	.	H	α-helix	trans	-62.2	-33.4	179.3	0	0	0	0	0	113	G209 R211 S217	G209-G213 PolarHBondContact O-N 3.12Å; R211-G213 PolarHBondContact O-N 2.67Å; G213-S217 VanDerWaalsContact O-CB 3.29Å; G213-S217 WeakPolarHBondContact O-CB 3.31Å; G213-S217 PolarHBondContact O-N 3.05Å; G213-S217 PolarHBondContact O-OG 2.76Å
214	T	84.1	Confident	79.3	Confident	7 Å²	7	17.2 Å²	17.2	4%	0.043	13%	0.126	C	C	.	.	H	α-helix	trans	-68.6	-46.2	174.3	-54.8	0	0	0	0	111.4	V169 V210 R211 S212 E216 S217 V218 I231 I246	V169-T214 HydrophobicContact CG2-CG2 3.63Å; V210-T214 WeakPolarHBondContact O-CB 3.3Å; V210-T214 PolarHBondContact O-N 2.9Å; V210-T214 PolarHBondContact O-OG1 3.41Å; R211-T214 PolarHBondContact O-N 3.45Å; S212-T214 VanDerWaalsContact C-N 3.26Å; S212-T214 PolarHBondContact O-N 3.28Å; T214-E216 VanDerWaalsContact C-N 3.35Å; T214-E216 PolarHBondContact O-N 3.41Å; T214-S217 PolarHBondContact O-N 2.86Å; T214-V218 HydrophobicContact CG2-CG2 4.43Å; T214-V218 WeakPolarHBondContact O-CG2 3.47Å; T214-V218 PolarHBondContact O-N 2.83Å; T214-I231 HydrophobicContact CG2-CG2 4.14Å; T214-I246 HydrophobicContact CG2-CD1 3.72Å
215	H	87.5	Confident	81	Confident	8 Å²	8	17.8 Å²	17.8	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-57.1	-47.9	175	-87	-85.9	0	0	0	111.8	R211 S212 S217 V218 V219 D245 I246 W356	R211-H215 PolarHBondContact O-CD2 2.91Å; R211-H215 VanDerWaalsContact O-CD2 3.3Å; R211-H215 PolarHBondContact O-N 3.49Å; S212-H215 PolarHBondContact O-N 2.77Å; H215-S217 VanDerWaalsContact C-N 3.34Å; H215-S217 PolarHBondContact O-N 2.94Å; H215-V218 WeakPolarHBondContact O-CB 3.37Å; H215-V218 PolarHBondContact O-N 3.27Å; H215-V219 WeakPolarHBondContact O-CG2 3.37Å; H215-V219 PolarHBondContact O-N 3.14Å; H215-V219 VanDerWaalsContact O-N 3.12Å; H215-D245 PolarHBondContact CE1-O 2.77Å; H215-D245 VanDerWaalsContact CE1-O 3.26Å; H215-I246 WeakPolarHBondContact NE2-CG1 2.95Å; H215-W356 HydrophobicContact CB-CD2 3.65Å; H215-W356 HydrophobicContact CB-CE3 3.92Å; H215-W356 HydrophobicContact CB-CG 4.11Å; H215-W356 HydrophobicContact CB-CH2 4.47Å; H215-W356 HydrophobicContact CB-CZ2 4.2Å; H215-W356 HydrophobicContact CB-CZ3 4.32Å; H215-W356 AromaticContact CG-CD2 3.9Å; H215-W356 AromaticContact CG-CG 3.91Å
216	E	90	Very high	82.9	Confident	3 Å²	3	16 Å²	16	1%	0.014	11%	0.112	C	C	.	.	H	α-helix	trans	-58.6	-47.9	177.8	-65.7	160.4	-168.7	0	0	110.1	V97 R105 L112 S212 T214 V218 V219 F220 W356	V97-E216 HydrophobicContact CG1-CB 3.99Å; V97-E216 WeakPolarHBondContact CG1-OE2 3.34Å; V97-E216 HydrophobicContact CG2-CG 4.26Å; V97-E216 WeakPolarHBondContact CG2-OE2 3.49Å; R105-E216 IonicContact NH2-OE1 3.71Å; R105-E216 PolarHBondContact NH2-OE1 2.84Å; L112-E216 HydrophobicContact CD2-CB 4.11Å; L112-E216 HydrophobicContact CD2-CG 3.91Å; S212-E216 VanDerWaalsContact O-CG 3.25Å; S212-E216 WeakPolarHBondContact O-CG 3.48Å; S212-E216 PolarHBondContact O-N 3.19Å; S212-E216 PolarHBondContact OG-OE1 3.09Å; T214-E216 VanDerWaalsContact C-N 3.35Å; T214-E216 PolarHBondContact O-N 3.41Å; E216-V218 PolarHBondContact O-N 2.74Å; E216-V219 PolarHBondContact O-N 3.05Å; E216-F220 WeakPolarHBondContact O-CD2 3.38Å; E216-F220 PolarHBondContact O-N 3.47Å; E216-W356 HydrophobicContact CG-CH2 3.86Å; E216-W356 HydrophobicContact CG-CZ2 3.38Å
217	S	91.9	Very high	84.5	Confident	5 Å²	5	16.8 Å²	16.8	4%	0.035	11%	0.113	C	C	.	.	H	α-helix	trans	-60.9	-39.3	177.9	-65.5	0	0	0	0	113.5	I94 G213 T214 H215 F220 C221	I94-S217 WeakPolarHBondContact CG2-OG 3.5Å; G213-S217 VanDerWaalsContact O-CB 3.29Å; G213-S217 WeakPolarHBondContact O-CB 3.31Å; G213-S217 PolarHBondContact O-N 3.05Å; G213-S217 PolarHBondContact O-OG 2.76Å; T214-S217 PolarHBondContact O-N 2.86Å; H215-S217 VanDerWaalsContact C-N 3.34Å; H215-S217 PolarHBondContact O-N 2.94Å; S217-F220 PolarHBondContact O-N 3.3Å; S217-C221 PolarHBondContact O-N 3.28Å; S217-C221 PolarHBondContact O-SG 3.37Å
218	V	93	Very high	86.3	Confident	1 Å²	1	13.9 Å²	13.9	1%	0.006	10%	0.098	C	C	.	.	H	α-helix	trans	-58.5	-53	174.6	175.3	0	0	0	0	109.3	R134 L167 T214 H215 E216 F220 C221 E222 V229 I231 I246	R134-V218 HydrophobicContact CG-CG1 3.9Å; L167-V218 HydrophobicContact CD1-CB 4.42Å; L167-V218 HydrophobicContact CD1-CG2 3.7Å; T214-V218 HydrophobicContact CG2-CG2 4.43Å; T214-V218 WeakPolarHBondContact O-CG2 3.47Å; T214-V218 PolarHBondContact O-N 2.83Å; H215-V218 WeakPolarHBondContact O-CB 3.37Å; H215-V218 PolarHBondContact O-N 3.27Å; E216-V218 PolarHBondContact O-N 2.74Å; V218-F220 VanDerWaalsContact C-N 3.3Å; V218-F220 PolarHBondContact O-N 3.17Å; V218-C221 WeakPolarHBondContact O-CA 3.35Å; V218-C221 WeakPolarHBondContact O-CB 3.25Å; V218-C221 PolarHBondContact O-N 3.21Å; V218-E222 HydrophobicContact CG1-CG 4.28Å; V218-E222 WeakPolarHBondContact O-CG 3.41Å; V218-E222 PolarHBondContact O-N 2.96Å; V218-V229 HydrophobicContact CG1-CG1 4.43Å; V218-V229 HydrophobicContact CG1-CG2 4.49Å; V218-V229 HydrophobicContact CG2-CG1 4.37Å; V218-I231 HydrophobicContact CG2-CD1 3.86Å; V218-I231 HydrophobicContact CG2-CG1 4.44Å; V218-I246 HydrophobicContact CB-CG2 4.46Å; V218-I246 HydrophobicContact CG2-CG2 3.67Å
219	V	92.3	Very high	88	Confident	4 Å²	4	12.2 Å²	12.2	2%	0.024	8%	0.081	C	C	.	.	H	α-helix	trans	-62.5	-38.2	-177.6	173.7	0	0	0	0	111.5	L112 L116 H215 E216 C221 E222 G223	L112-V219 HydrophobicContact CD1-CB 3.73Å; L112-V219 HydrophobicContact CD1-CG1 3.41Å; L112-V219 VanDerWaalsContact CD1-CG1 3.41Å; L112-V219 HydrophobicContact CG-CG1 4.28Å; L116-V219 HydrophobicContact CD1-CG1 4.47Å; L116-V219 HydrophobicContact CD2-CB 4.48Å; L116-V219 HydrophobicContact CD2-CG1 3.4Å; L116-V219 HydrophobicContact CD2-CG2 4.2Å; L116-V219 HydrophobicContact CG-CG1 3.62Å; H215-V219 WeakPolarHBondContact O-CG2 3.37Å; H215-V219 PolarHBondContact O-N 3.14Å; H215-V219 VanDerWaalsContact O-N 3.12Å; E216-V219 PolarHBondContact O-N 3.05Å; V219-C221 VanDerWaalsContact C-N 3.34Å; V219-C221 PolarHBondContact O-N 2.94Å; V219-E222 PolarHBondContact O-N 2.98Å; V219-G223 PolarHBondContact O-N 2.87Å
220	F	95	Very high	89.5	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-57.3	-46.1	171.4	-87.8	-65.8	0	0	0	112	L90 A93 I94 V97 I111 L112 L115 E216 S217 V218 G223 A224	L90-F220 HydrophobicContact CD1-CB 3.71Å; L90-F220 HydrophobicContact CD1-CD1 4.49Å; L90-F220 HydrophobicContact CD1-CG 4.47Å; A93-F220 HydrophobicContact CB-CD1 4.18Å; A93-F220 HydrophobicContact CB-CE1 3.69Å; A93-F220 HydrophobicContact CB-CZ 4.22Å; I94-F220 HydrophobicContact CD1-CB 4.11Å; I94-F220 HydrophobicContact CG1-CB 3.8Å; I94-F220 HydrophobicContact CG1-CD2 3.72Å; I94-F220 HydrophobicContact CG1-CE2 4.5Å; I94-F220 HydrophobicContact CG1-CG 3.81Å; V97-F220 HydrophobicContact CB-CE2 3.96Å; V97-F220 HydrophobicContact CB-CZ 4.42Å; V97-F220 HydrophobicContact CG1-CD2 4.36Å; V97-F220 HydrophobicContact CG1-CE2 3.6Å; V97-F220 HydrophobicContact CG1-CZ 4.47Å; I111-F220 HydrophobicContact CB-CE1 4.13Å; I111-F220 HydrophobicContact CG2-CE1 3.73Å; L112-F220 HydrophobicContact CB-CE1 4.37Å; L112-F220 HydrophobicContact CB-CE2 4.16Å; L112-F220 HydrophobicContact CB-CZ 3.83Å; L112-F220 HydrophobicContact CD1-CD1 4.38Å; L112-F220 HydrophobicContact CD1-CD2 3.77Å; L112-F220 HydrophobicContact CD1-CE1 4.36Å; L112-F220 HydrophobicContact CD1-CE2 3.73Å; L112-F220 HydrophobicContact CD1-CG 4.07Å; L112-F220 HydrophobicContact CD1-CZ 4.04Å; L112-F220 HydrophobicContact CD2-CE2 4.46Å; L112-F220 HydrophobicContact CG-CE2 4.35Å; L112-F220 HydrophobicContact CG-CZ 4.47Å; L115-F220 HydrophobicContact CD1-CD1 3.47Å; L115-F220 VanDerWaalsContact CD1-CD1 3.47Å; L115-F220 HydrophobicContact CD1-CE1 3.97Å; L115-F220 HydrophobicContact CD1-CG 4.37Å; E216-F220 WeakPolarHBondContact O-CD2 3.38Å; E216-F220 PolarHBondContact O-N 3.47Å; S217-F220 PolarHBondContact O-N 3.3Å; V218-F220 VanDerWaalsContact C-N 3.3Å; V218-F220 PolarHBondContact O-N 3.17Å; F220-G223 PolarHBondContact O-N 3.45Å; F220-A224 WeakPolarHBondContact O-CB 3.32Å; F220-A224 PolarHBondContact O-N 3.04Å
221	C	95.2	Very high	90.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-65.1	-41	176.3	-62.1	0	0	0	0	111.9	A165 S217 V218 V219 G223 A224 G225 Y226 V229	A165-C221 HydrophobicContact CB-CB 3.82Å; S217-C221 PolarHBondContact O-N 3.28Å; S217-C221 PolarHBondContact O-SG 3.37Å; V218-C221 WeakPolarHBondContact O-CA 3.35Å; V218-C221 WeakPolarHBondContact O-CB 3.25Å; V218-C221 PolarHBondContact O-N 3.21Å; V219-C221 VanDerWaalsContact C-N 3.34Å; V219-C221 PolarHBondContact O-N 2.94Å; C221-G223 VanDerWaalsContact C-N 3.26Å; C221-G223 PolarHBondContact O-N 3.32Å; C221-A224 PolarHBondContact O-N 3.21Å; C221-G225 PolarHBondContact O-N 3.01Å; C221-Y226 HydrophobicContact CB-CD2 4.14Å; C221-Y226 VanDerWaalsContact O-CD2 3.28Å; C221-Y226 WeakPolarHBondContact O-CD2 3.38Å; C221-Y226 PolarHBondContact O-N 3.44Å; C221-V229 HydrophobicContact CB-CG2 3.86Å
222	E	94	Very high	91.7	Very high	3 Å²	3	9.3 Å²	9.3	1%	0.014	7%	0.065	C	C	.	.	H	α-helix	trans	-63.1	-35	176.2	-60.1	-169.4	131.2	0	0	112.9	R122 I132 R134 V218 V219 R349	R122-E222 PolarHBondContact NH1-O 3.29Å; R122-E222 PolarHBondContact NH2-O 3.22Å; I132-E222 HydrophobicContact CB-CB 4.08Å; I132-E222 HydrophobicContact CB-CG 3.74Å; I132-E222 HydrophobicContact CG1-CB 3.91Å; I132-E222 HydrophobicContact CG1-CG 4.16Å; I132-E222 HydrophobicContact CG2-CB 4.47Å; I132-E222 HydrophobicContact CG2-CG 4Å; R134-E222 IonicContact CZ-OE1 2.8Å; R134-E222 IonicContact CZ-OE2 3.93Å; R134-E222 IonicContact NE-OE1 3.89Å; R134-E222 PolarHBondContact NE-OE1 2.96Å; R134-E222 IonicContact NE-OE2 2.62Å; R134-E222 VanDerWaalsContact NH2-CD 3.25Å; R134-E222 IonicContact NH2-OE1 3.68Å; R134-E222 PolarHBondContact NH2-OE1 2.89Å; R134-E222 VanDerWaalsContact NH2-OE1 3.12Å; R134-E222 IonicContact NH2-OE2 3.59Å; R134-E222 PolarHBondContact NH2-OE2 2.7Å; V218-E222 HydrophobicContact CG1-CG 4.28Å; V218-E222 WeakPolarHBondContact O-CG 3.41Å; V218-E222 PolarHBondContact O-N 2.96Å; V219-E222 PolarHBondContact O-N 2.98Å; E222-R349 IonicContact OE1-CZ 3.24Å; E222-R349 IonicContact OE1-NH1 3.31Å; E222-R349 PolarHBondContact OE1-NH1 3.48Å; E222-R349 IonicContact OE1-NH2 3.26Å
223	G	92.2	Very high	92.1	Very high	16 Å²	16	8.6 Å²	8.6	17%	0.165	6%	0.061	C	C	.	.	H	α-helix	trans	-73.1	-35.9	176.8	0	0	0	0	0	113.2	V219 F220 C221 G225	V219-G223 PolarHBondContact O-N 2.87Å; F220-G223 PolarHBondContact O-N 3.45Å; C221-G223 VanDerWaalsContact C-N 3.26Å; C221-G223 PolarHBondContact O-N 3.32Å; G223-G225 PolarHBondContact O-N 2.9Å
224	A	93.5	Very high	91.6	Very high	17 Å²	17	9.5 Å²	9.5	14%	0.14	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-1.9	177.5	0	0	0	0	0	114.2	I82 L90 F220 C221 Y226	I82-A224 HydrophobicContact CG2-CB 3.83Å; L90-A224 HydrophobicContact CD1-CB 4.07Å; L90-A224 HydrophobicContact CD2-CB 4.03Å; F220-A224 WeakPolarHBondContact O-CB 3.32Å; F220-A224 PolarHBondContact O-N 3.04Å; C221-A224 PolarHBondContact O-N 3.21Å; A224-Y226 HydrophobicContact CB-CD2 4.04Å; A224-Y226 HydrophobicContact CB-CE2 3.92Å
225	G	92.5	Very high	90.6	Very high	35 Å²	35	10.5 Å²	10.5	36%	0.361	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	27	173.1	0	0	0	0	0	115.1	C221 G223	C221-G225 PolarHBondContact O-N 3.01Å; G223-G225 PolarHBondContact O-N 2.9Å
226	Y	96.1	Very high	88.7	Confident	16 Å²	16	16 Å²	16	6%	0.063	11%	0.11	C	C	.	.			trans	-71.6	150.6	165.6	-69.4	-93.9	0	0	0	110.4	L90 I132 K163 A165 Y197 C221 A224	L90-Y226 HydrophobicContact CD2-CE2 3.62Å; I132-Y226 WeakPolarHBondContact CD1-O 3.25Å; I132-Y226 WeakPolarHBondContact CG1-O 3.47Å; I132-Y226 WeakPolarHBondContact CG2-O 3.33Å; K163-Y226 HydrophobicContact CB-CD1 3.99Å; A165-Y226 HydrophobicContact CB-CD1 3.79Å; A165-Y226 HydrophobicContact CB-CD2 4.45Å; A165-Y226 HydrophobicContact CB-CE1 4.25Å; A165-Y226 HydrophobicContact CB-CG 3.91Å; Y197-Y226 VanDerWaalsContact CB-CZ 3.46Å; Y197-Y226 WeakPolarHBondContact CB-OH 3.23Å; C221-Y226 HydrophobicContact CB-CD2 4.14Å; C221-Y226 VanDerWaalsContact O-CD2 3.28Å; C221-Y226 WeakPolarHBondContact O-CD2 3.38Å; C221-Y226 PolarHBondContact O-N 3.44Å; A224-Y226 HydrophobicContact CB-CD2 4.04Å; A224-Y226 HydrophobicContact CB-CE2 3.92Å
227	D	96.4	Very high	87.2	Confident	55 Å²	55	16.8 Å²	16.8	29%	0.294	12%	0.12	S	C	.	.	S	Bend	trans	-89.8	-27.9	179.3	-65.6	-69.2	0	0	0	112.7	F133 K162 K163	F133-D227 PolarHBondContact N-O 3.11Å; K162-D227 WeakPolarHBondContact CA-OD2 3.47Å; K162-D227 HydrophobicContact CB-CB 4.14Å; K162-D227 HydrophobicContact CD-CB 3.79Å; K162-D227 HydrophobicContact CG-CB 4.41Å; K163-D227 PolarHBondContact N-OD2 3.21Å; K163-D227 PolarHBondContact O-N 2.94Å
228	I	97.9	Very high	85.7	Confident	3 Å²	3	22.6 Å²	22.6	2%	0.015	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	139.3	-177.1	-175	171.3	0	0	0	110.5	F133 V135 L156 K163 V164 A165 L230 W329 M332	F133-I228 HydrophobicContact CB-CG1 4.33Å; F133-I228 HydrophobicContact CD1-CD1 4.01Å; F133-I228 HydrophobicContact CD1-CG1 4.38Å; F133-I228 CarbonylContact O-C 3.52Å; F133-I228 VanDerWaalsContact O-CA 3.29Å; F133-I228 WeakPolarHBondContact O-CA 3.28Å; F133-I228 WeakPolarHBondContact O-CG1 3.35Å; V135-I228 HydrophobicContact CG2-CD1 4.05Å; V135-I228 HydrophobicContact CG2-CG1 4.31Å; L156-I228 HydrophobicContact CD1-CD1 4.02Å; L156-I228 HydrophobicContact CD1-CG2 4.04Å; K163-I228 PolarHBondContact O-N 3.4Å; V164-I228 HydrophobicContact CB-CG2 4.24Å; V164-I228 HydrophobicContact CG1-CG2 4.23Å; V164-I228 HydrophobicContact CG2-CG2 3.8Å; A165-I228 PolarHBondContact N-O 3.31Å; I228-L230 HydrophobicContact CD1-CD2 3.68Å; I228-L230 HydrophobicContact CG1-CD2 3.89Å; I228-W329 HydrophobicContact CD1-CZ3 4.21Å; I228-M332 HydrophobicContact CD1-CE 4.42Å
229	V	97.2	Very high	84.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	113.6	174	-174.2	0	0	0	0	108.4	I132 F133 V135 A165 L167 V218 C221 I231	I132-V229 HydrophobicContact CG2-CG2 4.13Å; F133-V229 PolarHBondContact O-N 3.42Å; V135-V229 PolarHBondContact N-O 2.79Å; A165-V229 HydrophobicContact CB-CG1 4.34Å; A165-V229 HydrophobicContact CB-CG2 4.25Å; A165-V229 CarbonylContact O-C 3.56Å; A165-V229 WeakPolarHBondContact O-CA 3.47Å; L167-V229 HydrophobicContact CD1-CG1 3.65Å; L167-V229 HydrophobicContact CG-CG1 3.95Å; V218-V229 HydrophobicContact CG1-CG1 4.43Å; V218-V229 HydrophobicContact CG1-CG2 4.49Å; V218-V229 HydrophobicContact CG2-CG1 4.37Å; C221-V229 HydrophobicContact CB-CG2 3.86Å; V229-I231 HydrophobicContact CG1-CG1 4.23Å
230	L	96.4	Very high	83.2	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	125.9	173.5	-54.5	-177.2	0	0	0	108.9	V135 I137 I149 F152 V164 A165 V166 L167 I228	V135-L230 HydrophobicContact CB-CD2 3.94Å; V135-L230 HydrophobicContact CG1-CD2 4.46Å; V135-L230 HydrophobicContact CG2-CD2 4.45Å; V135-L230 CarbonylContact O-C 3.6Å; V135-L230 WeakPolarHBondContact O-CA 3.36Å; I137-L230 HydrophobicContact CD1-CB 4.38Å; I137-L230 HydrophobicContact CD1-CD1 4.4Å; I137-L230 HydrophobicContact CD1-CD2 4.24Å; I149-L230 HydrophobicContact CG2-CD1 4.17Å; F152-L230 HydrophobicContact CD1-CD1 4.03Å; F152-L230 HydrophobicContact CD1-CD2 4.47Å; F152-L230 HydrophobicContact CE1-CD1 4.46Å; F152-L230 HydrophobicContact CE1-CD2 4.16Å; V164-L230 HydrophobicContact CG1-CD1 3.89Å; V164-L230 HydrophobicContact CG1-CG 4.11Å; A165-L230 PolarHBondContact O-N 2.58Å; V166-L230 CarbonylContact C-O 3.54Å; V166-L230 VanDerWaalsContact CA-O 3.31Å; V166-L230 WeakPolarHBondContact CA-O 3.34Å; V166-L230 HydrophobicContact CG2-CB 4.36Å; V166-L230 HydrophobicContact CG2-CD1 4.38Å; L167-L230 PolarHBondContact N-O 3.38Å; I228-L230 HydrophobicContact CD1-CD2 3.68Å; I228-L230 HydrophobicContact CG1-CD2 3.89Å
231	I	93.4	Very high	82	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	104	-178.2	-50	170.4	0	0	0	107.8	V135 A136 I137 L167 V169 T214 V218 V229 V243 I246 A247	V135-I231 PolarHBondContact O-N 2.85Å; A136-I231 CarbonylContact C-O 3.56Å; A136-I231 WeakPolarHBondContact CA-O 3.45Å; I137-I231 PolarHBondContact N-O 3.36Å; L167-I231 CarbonylContact O-C 3.53Å; L167-I231 VanDerWaalsContact O-CA 3.31Å; L167-I231 WeakPolarHBondContact O-CA 3.28Å; V169-I231 HydrophobicContact CG2-CG2 3.58Å; T214-I231 HydrophobicContact CG2-CG2 4.14Å; V218-I231 HydrophobicContact CG2-CD1 3.86Å; V218-I231 HydrophobicContact CG2-CG1 4.44Å; V229-I231 HydrophobicContact CG1-CG1 4.23Å; I231-V243 HydrophobicContact CG2-CB 4.42Å; I231-V243 HydrophobicContact CG2-CG1 3.75Å; I231-I246 HydrophobicContact CD1-CB 4.22Å; I231-I246 HydrophobicContact CD1-CG2 3.98Å; I231-A247 HydrophobicContact CD1-CB 4.44Å
232	E	90.7	Very high	80.9	Confident	3 Å²	3	25.9 Å²	25.9	1%	0.014	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.1	178.3	-174	178.2	-168.1	0	0	110.2	K145 S146 I149 L167 T168 V169	K145-E232 WeakPolarHBondContact CB-OE1 3.47Å; S146-E232 PolarHBondContact N-OE1 2.93Å; S146-E232 PolarHBondContact OG-OE1 2.82Å; I149-E232 HydrophobicContact CD1-CB 3.6Å; I149-E232 VanDerWaalsContact CD1-CD 3.48Å; I149-E232 HydrophobicContact CD1-CG 3.57Å; L167-E232 PolarHBondContact O-N 3.35Å; T168-E232 CarbonylContact C-O 3.57Å; T168-E232 HydrophobicContact CG2-CB 4.26Å; V169-E232 PolarHBondContact N-O 3.16Å
233	T	83.1	Confident	80.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.7	164.2	56.9	0	0	0	0	110.4	I137 T138 K145 V243	I137-T233 PolarHBondContact O-N 2.95Å; I137-T233 VanDerWaalsContact O-N 3.09Å; T138-T233 VanDerWaalsContact CA-OG1 3.3Å; T138-T233 WeakPolarHBondContact CA-OG1 3.28Å; T138-T233 VanDerWaalsContact CB-OG1 3.25Å; T138-T233 WeakPolarHBondContact CB-OG1 3.04Å; T138-T233 PolarHBondContact OG1-OG1 3.17Å; K145-T233 WeakPolarHBondContact CE-O 3.43Å; T233-V243 HydrophobicContact CG2-CB 4.04Å; T233-V243 HydrophobicContact CG2-CG1 3.41Å; T233-V243 VanDerWaalsContact CG2-CG1 3.41Å; T233-V243 HydrophobicContact CG2-CG2 3.41Å; T233-V243 VanDerWaalsContact CG2-CG2 3.41Å
234	V	71.1	Confident	79.7	Confident	23 Å²	23	25.7 Å²	25.7	14%	0.139	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-100.1	129.3	173.7	-173.9	0	0	0	0	109	V169 D170	V169-V234 PolarHBondContact O-N 3.3Å; D170-V234 HydrophobicContact CB-CB 3.77Å; D170-V234 HydrophobicContact CB-CG1 4.24Å; D170-V234 HydrophobicContact CB-CG2 4.17Å
235	G	62.2	Low	79.2	Confident	28 Å²	28	27.4 Å²	27.4	29%	0.289	17%	0.17	S	C	.	.	S	Bend	trans	94.3	179.3	167.9	0	0	0	0	0	117.2
236	V	49.3	Very low	79	Confident	123 Å²	123	25.8 Å²	25.8	75%	0.745	15%	0.153	S	C	*	.	S	Bend	trans	-89	120	167	-81.4	0	0	0	0	108	P141	P141-V236 VanDerWaalsContact CD-CG1 3.45Å; P141-V236 HydrophobicContact CG-CG1 3.65Å
237	G	57.2	Low	78.9	Confident	20 Å²	20	25 Å²	25	21%	0.206	15%	0.15	C	C	.	.	S	Bend	trans	-164.6	-158.6	-171.9	0	0	0	0	0	117	E240 K266	G237-E240 PolarHBondContact N-OE1 2.97Å; G237-K266 PolarHBondContact O-NZ 2.88Å
238	Q	61.7	Low	78.9	Confident	127 Å²	127	22.5 Å²	22.5	59%	0.593	14%	0.136	S	C	*	.	S	Bend	trans	-108.7	10.1	163.6	-65.6	-71.7	-27.8	0	0	109.6	E240 S241	Q238-E240 WeakPolarHBondContact CA-OE2 3.31Å; Q238-E240 PolarHBondContact N-OE2 3.38Å; Q238-E240 PolarHBondContact O-N 3.29Å; Q238-S241 PolarHBondContact O-OG 2.62Å
239	S	62.1	Low	78.8	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-63.2	-25.9	177.6	12.9	0	0	0	0	112.1	P171 S241 A242 V243	P171-S239 WeakPolarHBondContact CG-OG 3.33Å; S239-S241 VanDerWaalsContact C-N 3.27Å; S239-S241 PolarHBondContact O-N 3.02Å; S239-A242 WeakPolarHBondContact O-CA 3.37Å; S239-A242 VanDerWaalsContact O-CB 3.23Å; S239-A242 WeakPolarHBondContact O-CB 3.17Å; S239-A242 PolarHBondContact O-N 2.94Å; S239-V243 PolarHBondContact O-N 3.5Å
240	E	70	Confident	78.7	Confident	23 Å²	23	22.5 Å²	22.5	11%	0.107	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-39.1	-175.2	-54.6	88.7	164.3	0	0	110	T138 G237 Q238 A242 V243 V244 I269	T138-E240 WeakPolarHBondContact OG1-CG 3.33Å; G237-E240 PolarHBondContact N-OE1 2.97Å; Q238-E240 WeakPolarHBondContact CA-OE2 3.31Å; Q238-E240 PolarHBondContact N-OE2 3.38Å; Q238-E240 PolarHBondContact O-N 3.29Å; E240-A242 VanDerWaalsContact C-N 3.28Å; E240-A242 PolarHBondContact O-N 3.31Å; E240-V243 VanDerWaalsContact O-CG2 3.25Å; E240-V243 WeakPolarHBondContact O-CG2 2.97Å; E240-V244 WeakPolarHBondContact O-CG2 3.24Å; E240-V244 PolarHBondContact O-N 3.12Å; E240-I269 HydrophobicContact CB-CD1 4.07Å; E240-I269 HydrophobicContact CB-CG1 3.9Å; E240-I269 HydrophobicContact CG-CD1 3.68Å; E240-I269 HydrophobicContact CG-CG1 4.1Å
241	S	70.6	Confident	78.6	Confident	45 Å²	45	22.5 Å²	22.5	32%	0.315	14%	0.137	S	C	.	.	H	α-helix	trans	-64.5	-33.3	172.9	66.4	0	0	0	0	112.8	R211 Q238 S239 V243 V244	R211-S241 PolarHBondContact NH2-OG 2.75Å; Q238-S241 PolarHBondContact O-OG 2.62Å; S239-S241 VanDerWaalsContact C-N 3.27Å; S239-S241 PolarHBondContact O-N 3.02Å; S241-V243 PolarHBondContact O-N 3.42Å; S241-V244 PolarHBondContact O-N 3.17Å
242	A	71.6	Confident	78.6	Confident	4 Å²	4	22.6 Å²	22.6	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-38.7	-176.7	0	0	0	0	0	112.2	R211 S239 E240 I246	R211-A242 HydrophobicContact CG-CB 3.67Å; R211-A242 VanDerWaalsContact NE-CB 3.34Å; S239-A242 WeakPolarHBondContact O-CA 3.37Å; S239-A242 VanDerWaalsContact O-CB 3.23Å; S239-A242 WeakPolarHBondContact O-CB 3.17Å; S239-A242 PolarHBondContact O-N 2.94Å; E240-A242 VanDerWaalsContact C-N 3.28Å; E240-A242 PolarHBondContact O-N 3.31Å; A242-I246 VanDerWaalsContact O-CG1 3.23Å; A242-I246 WeakPolarHBondContact O-CG1 3.34Å
243	V	79.5	Confident	78.7	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-81.2	-24.5	-177.8	-64.6	0	0	0	0	113.3	A136 V169 I231 T233 S239 E240 S241 D245 I246 A247	A136-V243 HydrophobicContact CB-CB 3.81Å; A136-V243 HydrophobicContact CB-CG2 3.77Å; V169-V243 HydrophobicContact CB-CG1 4.41Å; V169-V243 HydrophobicContact CG2-CG1 4.28Å; I231-V243 HydrophobicContact CG2-CB 4.42Å; I231-V243 HydrophobicContact CG2-CG1 3.75Å; T233-V243 HydrophobicContact CG2-CB 4.04Å; T233-V243 HydrophobicContact CG2-CG1 3.41Å; T233-V243 VanDerWaalsContact CG2-CG1 3.41Å; T233-V243 HydrophobicContact CG2-CG2 3.41Å; T233-V243 VanDerWaalsContact CG2-CG2 3.41Å; S239-V243 PolarHBondContact O-N 3.5Å; E240-V243 VanDerWaalsContact O-CG2 3.25Å; E240-V243 WeakPolarHBondContact O-CG2 2.97Å; S241-V243 PolarHBondContact O-N 3.42Å; V243-D245 PolarHBondContact O-N 2.8Å; V243-I246 PolarHBondContact O-N 3.26Å; V243-I246 VanDerWaalsContact O-N 3.12Å; V243-A247 WeakPolarHBondContact O-CB 3.02Å; V243-A247 PolarHBondContact O-N 3.41Å
244	V	81.6	Confident	79	Confident	15 Å²	15	22.5 Å²	22.5	9%	0.091	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-37.2	175.1	172.8	0	0	0	0	110.8	E240 S241 I246 V250 N272	E240-V244 WeakPolarHBondContact O-CG2 3.24Å; E240-V244 PolarHBondContact O-N 3.12Å; S241-V244 PolarHBondContact O-N 3.17Å; V244-I246 PolarHBondContact O-N 2.85Å; V244-V250 HydrophobicContact CB-CG2 4.43Å; V244-V250 HydrophobicContact CG2-CG2 3.94Å; V244-N272 HydrophobicContact CG1-CB 4.23Å; V244-N272 HydrophobicContact CG2-CB 3.77Å
245	D	83.2	Confident	79.8	Confident	52 Å²	52	21.8 Å²	21.8	28%	0.278	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.7	-180	-61.4	-26.2	0	0	0	113.3	R211 H215 V243 Q352	R211-D245 IonicContact NH1-OD2 3.63Å; R211-D245 PolarHBondContact NH1-OD2 3.15Å; H215-D245 PolarHBondContact CE1-O 2.77Å; H215-D245 VanDerWaalsContact CE1-O 3.26Å; V243-D245 PolarHBondContact O-N 2.8Å; D245-Q352 VanDerWaalsContact O-CB 3.31Å; D245-Q352 WeakPolarHBondContact O-CB 3.46Å; D245-Q352 WeakPolarHBondContact O-CG 3.5Å
246	I	88	Confident	80.9	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.01	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-35	-176.3	-39	-165.9	0	0	0	112	R134 T214 H215 V218 I231 A242 V243 V244	R134-I246 VanDerWaalsContact CD-O 3.3Å; R134-I246 WeakPolarHBondContact CD-O 2.97Å; T214-I246 HydrophobicContact CG2-CD1 3.72Å; H215-I246 WeakPolarHBondContact NE2-CG1 2.95Å; V218-I246 HydrophobicContact CB-CG2 4.46Å; V218-I246 HydrophobicContact CG2-CG2 3.67Å; I231-I246 HydrophobicContact CD1-CB 4.22Å; I231-I246 HydrophobicContact CD1-CG2 3.98Å; A242-I246 VanDerWaalsContact O-CG1 3.23Å; A242-I246 WeakPolarHBondContact O-CG1 3.34Å; V243-I246 PolarHBondContact O-N 3.26Å; V243-I246 VanDerWaalsContact O-N 3.12Å; V244-I246 PolarHBondContact O-N 2.85Å
247	A	93.7	Very high	81.8	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.112	C	C	.	.			trans	-88.1	150.4	-173.9	0	0	0	0	0	112.6	A136 I231 V243 M249 Q348 Q352	A136-A247 HydrophobicContact CB-CB 3.57Å; I231-A247 HydrophobicContact CD1-CB 4.44Å; V243-A247 WeakPolarHBondContact O-CB 3.02Å; V243-A247 PolarHBondContact O-N 3.41Å; A247-M249 WeakPolarHBondContact CB-O 3.37Å; A247-Q348 PolarHBondContact O-NE2 3.05Å; A247-Q352 PolarHBondContact O-NE2 3.16Å
248	D	95.8	Very high	81.8	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.124	C	C	.	.	S	Bend	trans	-71.3	-49.3	167.5	-53.2	-45.8	0	0	0	108.2	F133 R134 R306 L345 Q348 R349	F133-D248 HydrophobicContact CD2-CB 4.08Å; F133-D248 HydrophobicContact CE2-CB 4.01Å; R134-D248 PolarHBondContact N-OD2 2.9Å; R134-D248 WeakPolarHBondContact O-CB 3.01Å; R134-D248 PolarHBondContact O-N 3.39Å; D248-R306 PolarHBondContact O-NH2 2.79Å; D248-L345 HydrophobicContact CB-CD1 3.65Å; D248-L345 VanDerWaalsContact CG-CD1 3.44Å; D248-L345 WeakPolarHBondContact OD1-CD1 3.5Å; D248-Q348 PolarHBondContact O-NE2 3.23Å; D248-Q348 PolarHBondContact O-OE1 2.83Å; D248-R349 VanDerWaalsContact CG-NH2 3.33Å; D248-R349 IonicContact OD1-CZ 3.82Å; D248-R349 IonicContact OD1-NE 2.79Å; D248-R349 PolarHBondContact OD1-NE 3.24Å; D248-R349 IonicContact OD1-NH2 2.65Å; D248-R349 PolarHBondContact OD1-NH2 3.14Å; D248-R349 VanDerWaalsContact OD1-NH2 3.13Å; D248-R349 IonicContact OD2-CZ 2.59Å; D248-R349 IonicContact OD2-NE 3.97Å; D248-R349 IonicContact OD2-NH2 2.78Å; D248-R349 PolarHBondContact OD2-NH2 2.99Å
249	M	96.4	Very high	81.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.8	-177.5	-164.6	-177.9	-172.3	0	0	112.2	F133 R134 V135 A136 A247 V251 D274 L275 M332 F335	F133-M249 HydrophobicContact CE2-CB 3.89Å; F133-M249 HydrophobicContact CZ-CB 3.84Å; F133-M249 HydrophobicContact CZ-CG 4.49Å; F133-M249 HydrophobicContact CZ-SD 3.86Å; R134-M249 PolarHBondContact O-N 2.94Å; R134-M249 VanDerWaalsContact O-N 3.11Å; V135-M249 CarbonylContact C-O 3.53Å; V135-M249 WeakPolarHBondContact CA-O 3.18Å; A136-M249 PolarHBondContact N-O 2.8Å; A247-M249 WeakPolarHBondContact CB-O 3.37Å; M249-V251 HydrophobicContact SD-CG2 4.37Å; M249-D274 WeakPolarHBondContact CA-OD2 3.34Å; M249-D274 HydrophobicContact CE-CB 4.19Å; M249-D274 HydrophobicContact CG-CB 3.95Å; M249-L275 HydrophobicContact CE-CB 3.34Å; M249-L275 HydrophobicContact CE-CD2 4.04Å; M249-L275 HydrophobicContact CE-CG 4.3Å; M249-M332 HydrophobicContact CE-CG 4.09Å; M249-M332 HydrophobicContact SD-CB 4.05Å; M249-M332 HydrophobicContact SD-CG 3.71Å; M249-F335 HydrophobicContact CB-CD1 3.87Å; M249-F335 HydrophobicContact CB-CE1 3.5Å; M249-F335 HydrophobicContact CB-CZ 4.01Å; M249-F335 HydrophobicContact CE-CB 4.02Å; M249-F335 HydrophobicContact CE-CD2 4.26Å; M249-F335 HydrophobicContact CE-CG 4.01Å; M249-F335 HydrophobicContact CG-CD1 3.8Å; M249-F335 HydrophobicContact CG-CD2 4.35Å; M249-F335 HydrophobicContact CG-CE1 3.75Å; M249-F335 HydrophobicContact CG-CE2 4.31Å; M249-F335 HydrophobicContact CG-CG 4.12Å; M249-F335 HydrophobicContact CG-CZ 4Å; M249-F335 HydrophobicContact SD-CB 4.17Å; M249-F335 HydrophobicContact SD-CD1 3.84Å; M249-F335 HydrophobicContact SD-CE1 4.4Å; M249-F335 HydrophobicContact SD-CG 3.94Å
250	V	94.8	Very high	81.1	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.1	174.9	-178.1	0	0	0	0	109.4	A136 T138 V244 N272 D274 L275	A136-V250 HydrophobicContact CB-CG2 4.35Å; T138-V250 HydrophobicContact CG2-CG1 4.22Å; V244-V250 HydrophobicContact CB-CG2 4.43Å; V244-V250 HydrophobicContact CG2-CG2 3.94Å; V250-N272 VanDerWaalsContact CB-O 3.28Å; V250-N272 WeakPolarHBondContact CB-O 3.25Å; V250-D274 PolarHBondContact N-OD2 3.41Å; V250-D274 PolarHBondContact O-N 3.26Å; V250-L275 PolarHBondContact O-N 3.24Å
251	V	95.4	Very high	80.5	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118	177	-176.2	0	0	0	0	109.1	V135 A136 I137 T138 M249 L253 L275 V277	V135-V251 HydrophobicContact CG1-CG2 3.67Å; A136-V251 PolarHBondContact O-N 3.43Å; I137-V251 WeakPolarHBondContact CA-O 3.48Å; I137-V251 HydrophobicContact CG1-CB 4.37Å; T138-V251 PolarHBondContact N-O 2.99Å; M249-V251 HydrophobicContact SD-CG2 4.37Å; V251-L253 HydrophobicContact CG1-CD2 3.95Å; V251-L275 CarbonylContact C-O 3.57Å; V251-L275 VanDerWaalsContact CA-O 3.31Å; V251-L275 WeakPolarHBondContact CA-O 3.46Å; V251-L275 HydrophobicContact CG1-CD2 4.33Å; V251-L275 HydrophobicContact CG1-CG 4.42Å; V251-L275 HydrophobicContact CG2-CB 4.37Å; V251-L275 HydrophobicContact CG2-CD2 4.29Å; V251-V277 HydrophobicContact CG1-CG2 3.86Å
252	L	92.3	Very high	79.9	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.3	175.9	178	63.6	0	0	0	110.2	T138 L254 L265 I269 M270 A273 L275 I276 V277	T138-L252 HydrophobicContact CG2-CD1 3.98Å; T138-L252 CarbonylContact O-C 3.57Å; L252-L254 HydrophobicContact CD1-CD2 4.39Å; L252-L254 HydrophobicContact CD2-CD2 4.04Å; L252-L254 HydrophobicContact CG-CD2 3.96Å; L252-L254 HydrophobicContact CG-CG 4.37Å; L252-L265 HydrophobicContact CD1-CD2 4.37Å; L252-L265 HydrophobicContact CD2-CD2 4.13Å; L252-I269 HydrophobicContact CD1-CG2 3.77Å; L252-I269 HydrophobicContact CD2-CG2 4.23Å; L252-M270 HydrophobicContact CD2-SD 3.6Å; L252-M270 VanDerWaalsContact CD2-SD 3.6Å; L252-A273 HydrophobicContact CB-CB 3.92Å; L252-A273 HydrophobicContact CD2-CB 4.36Å; L252-L275 PolarHBondContact N-O 3.26Å; L252-I276 HydrophobicContact CB-CG1 4.39Å; L252-I276 HydrophobicContact CD2-CG1 4.49Å; L252-I276 CarbonylContact O-C 3.51Å; L252-I276 WeakPolarHBondContact O-CA 3.43Å; L252-V277 PolarHBondContact O-N 2.64Å
253	L	92.4	Very high	79.1	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	130.9	173.2	-54.6	-166.1	0	0	0	110.8	I137 T138 G139 A143 K145 F148 V251 V277 T279	I137-L253 HydrophobicContact CG2-CD1 3.85Å; I137-L253 HydrophobicContact CG2-CD2 4.47Å; I137-L253 HydrophobicContact CG2-CG 3.94Å; T138-L253 PolarHBondContact O-N 3.02Å; G139-L253 WeakPolarHBondContact CA-O 3.23Å; A143-L253 HydrophobicContact CB-CB 4.28Å; K145-L253 HydrophobicContact CB-CD1 4.25Å; K145-L253 HydrophobicContact CG-CD1 3.92Å; F148-L253 HydrophobicContact CB-CD1 3.78Å; F148-L253 HydrophobicContact CD1-CD1 3.75Å; F148-L253 HydrophobicContact CD1-CD2 4.05Å; F148-L253 HydrophobicContact CE1-CD2 4.13Å; F148-L253 HydrophobicContact CG-CD1 3.83Å; F148-L253 HydrophobicContact CG-CD2 4.32Å; F148-L253 HydrophobicContact CZ-CD2 4.46Å; V251-L253 HydrophobicContact CG1-CD2 3.95Å; L253-V277 WeakPolarHBondContact CA-O 3.44Å; L253-V277 HydrophobicContact CD2-CB 3.64Å; L253-V277 HydrophobicContact CD2-CG1 4.1Å; L253-V277 HydrophobicContact CD2-CG2 4.24Å; L253-T279 HydrophobicContact CB-CG2 4.02Å; L253-T279 HydrophobicContact CD1-CG2 4.13Å; L253-T279 HydrophobicContact CD2-CG2 4.25Å; L253-T279 HydrophobicContact CG-CG2 4.37Å
254	L	89.9	Confident	78	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.1	176.6	-58.3	-179.5	0	0	0	110.1	L252 L265 I276 V277 T279 F296	L252-L254 HydrophobicContact CD1-CD2 4.39Å; L252-L254 HydrophobicContact CD2-CD2 4.04Å; L252-L254 HydrophobicContact CG-CD2 3.96Å; L252-L254 HydrophobicContact CG-CG 4.37Å; L254-L265 HydrophobicContact CD2-CD1 3.68Å; L254-L265 HydrophobicContact CD2-CD2 4.08Å; L254-L265 HydrophobicContact CD2-CG 4.46Å; L254-I276 HydrophobicContact CD1-CG2 3.4Å; L254-I276 VanDerWaalsContact CD1-CG2 3.4Å; L254-I276 HydrophobicContact CG-CG2 3.88Å; L254-V277 PolarHBondContact N-O 2.96Å; L254-T279 PolarHBondContact O-N 3.26Å; L254-T279 PolarHBondContact O-OG1 3.16Å; L254-F296 HydrophobicContact CD1-CD1 3.95Å; L254-F296 HydrophobicContact CD1-CD2 3.62Å; L254-F296 HydrophobicContact CD1-CE1 3.79Å; L254-F296 HydrophobicContact CD1-CE2 3.47Å; L254-F296 VanDerWaalsContact CD1-CE2 3.47Å; L254-F296 HydrophobicContact CD1-CG 3.88Å; L254-F296 HydrophobicContact CD1-CZ 3.56Å
255	S	88.4	Confident	77	Confident	8 Å²	8	38.4 Å²	38.4	6%	0.056	24%	0.239	C	C	.	.			trans	-94.5	140.5	170.9	-171.7	0	0	0	0	109.8	K280	S255-K280 PolarHBondContact OG-NZ 3.27Å
256	P	84.5	Confident	75.8	Confident	4 Å²	4	40.9 Å²	40.9	3%	0.026	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	151.8	167.5	-20.6	33.5	0	0	0	110.6	L258 V278 T279 K280 L285 A288 A289	P256-L258 PolarHBondContact O-N 3.33Å; P256-V278 HydrophobicContact CG-CG1 3.99Å; P256-T279 WeakPolarHBondContact CD-O 3.43Å; P256-T279 WeakPolarHBondContact CG-O 3.22Å; P256-K280 HydrophobicContact CG-CB 4.13Å; P256-L285 HydrophobicContact CB-CB 4.2Å; P256-L285 HydrophobicContact CG-CB 4.34Å; P256-A288 HydrophobicContact CB-CB 3.98Å; P256-A289 HydrophobicContact CB-CB 4.02Å; P256-A289 HydrophobicContact CG-CB 3.59Å
257	A	69	Low	74.6	Confident	68 Å²	68	51 Å²	51	56%	0.562	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	10.4	168.7	0	0	0	0	0	118	G259 L285 A288	A257-G259 PolarHBondContact O-N 3.24Å; A257-L285 HydrophobicContact CB-CD2 4.26Å; A257-A288 HydrophobicContact CB-CB 4.1Å
258	L	57.8	Low	73.4	Confident	90 Å²	90	52.7 Å²	52.7	47%	0.471	30%	0.303	S	S	.	.			trans	-92.6	78.7	164	-66.5	167.2	0	0	0	108.9	P256 D260 E261	P256-L258 PolarHBondContact O-N 3.33Å; L258-D260 PolarHBondContact O-N 3.31Å; L258-E261 HydrophobicContact CB-CB 4.16Å; L258-E261 HydrophobicContact CB-CG 3.56Å; L258-E261 HydrophobicContact CD1-CG 4.12Å; L258-E261 WeakPolarHBondContact CD1-OE1 3.46Å; L258-E261 HydrophobicContact CG-CG 4.45Å; L258-E261 WeakPolarHBondContact O-CB 3.36Å; L258-E261 PolarHBondContact O-N 2.79Å
259	G	50.7	Low	72.3	Confident	71 Å²	71	53.9 Å²	53.9	73%	0.732	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.2	-174.1	0	0	0	0	0	115.4	A257	A257-G259 PolarHBondContact O-N 3.24Å
260	D	57.9	Low	71.5	Confident	129 Å²	129	55 Å²	55	69%	0.69	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.7	175	-81.8	-20.7	0	0	0	114	L258 L262 Q263 G264	L258-D260 PolarHBondContact O-N 3.31Å; D260-L262 PolarHBondContact O-N 2.76Å; D260-Q263 PolarHBondContact O-N 2.95Å; D260-G264 PolarHBondContact O-N 3.37Å
261	E	57	Low	70.8	Confident	31 Å²	31	59.7 Å²	59.7	15%	0.145	34%	0.336	C	S	.	.	H	α-helix	trans	-63.8	-27.2	-178	-89.7	-175.3	162.5	0	0	112.3	S140 L258 Q263 G264 L265	S140-E261 WeakPolarHBondContact CB-OE1 3.41Å; S140-E261 PolarHBondContact OG-OE1 2.93Å; L258-E261 HydrophobicContact CB-CB 4.16Å; L258-E261 HydrophobicContact CB-CG 3.56Å; L258-E261 HydrophobicContact CD1-CG 4.12Å; L258-E261 WeakPolarHBondContact CD1-OE1 3.46Å; L258-E261 HydrophobicContact CG-CG 4.45Å; L258-E261 WeakPolarHBondContact O-CB 3.36Å; L258-E261 PolarHBondContact O-N 2.79Å; E261-Q263 VanDerWaalsContact C-N 3.26Å; E261-Q263 PolarHBondContact O-N 3.29Å; E261-G264 CarbonylContact O-C 3.58Å; E261-G264 PolarHBondContact O-N 3.37Å; E261-L265 HydrophobicContact CB-CD1 4.36Å; E261-L265 WeakPolarHBondContact O-CA 3.06Å; E261-L265 WeakPolarHBondContact O-CB 3.36Å; E261-L265 VanDerWaalsContact O-CD1 3.25Å; E261-L265 WeakPolarHBondContact O-CD1 3.02Å; E261-L265 WeakPolarHBondContact O-CG 3.38Å; E261-L265 PolarHBondContact O-N 3.33Å
262	L	57.7	Low	70.4	Confident	81 Å²	81	62 Å²	62	42%	0.424	35%	0.349	S	S	.	.	H	α-helix	trans	-66.8	-30.5	177	-149.7	144.9	0	0	0	111.8	D260 Q295 F296	D260-L262 PolarHBondContact O-N 2.76Å; L262-Q295 HydrophobicContact CD1-CB 4.11Å; L262-F296 HydrophobicContact CB-CZ 4.3Å; L262-F296 HydrophobicContact CD1-CD2 4.34Å; L262-F296 HydrophobicContact CD1-CE1 4.31Å; L262-F296 HydrophobicContact CD1-CE2 3.93Å; L262-F296 HydrophobicContact CD1-CZ 3.9Å; L262-F296 HydrophobicContact CG-CE1 4.29Å; L262-F296 HydrophobicContact CG-CE2 4.44Å; L262-F296 HydrophobicContact CG-CZ 3.94Å
263	Q	54.8	Low	70.4	Confident	176 Å²	176	62 Å²	62	82%	0.822	35%	0.349	S	S	*	.	H	α-helix	trans	-83.6	-31.9	171.5	-68.8	-172.1	0.9	0	0	112.5	D260 E261	D260-Q263 PolarHBondContact O-N 2.95Å; E261-Q263 VanDerWaalsContact C-N 3.26Å; E261-Q263 PolarHBondContact O-N 3.29Å
264	G	56.5	Low	70.5	Confident	59 Å²	59	62.1 Å²	62.1	61%	0.608	35%	0.349	S	S	*	.	H	α-helix	trans	-80.2	-22.1	179.1	0	0	0	0	0	114.9	D260 E261 K266	D260-G264 PolarHBondContact O-N 3.37Å; E261-G264 CarbonylContact O-C 3.58Å; E261-G264 PolarHBondContact O-N 3.37Å; G264-K266 PolarHBondContact O-N 3.3Å
265	L	59.9	Low	70.8	Confident	27 Å²	27	62 Å²	62	14%	0.141	35%	0.349	C	S	.	.	S	Bend	trans	-68.5	102.2	173.1	-82.1	156.9	0	0	0	107.7	L252 L254 E261 R267 M270 F296	L252-L265 HydrophobicContact CD1-CD2 4.37Å; L252-L265 HydrophobicContact CD2-CD2 4.13Å; L254-L265 HydrophobicContact CD2-CD1 3.68Å; L254-L265 HydrophobicContact CD2-CD2 4.08Å; L254-L265 HydrophobicContact CD2-CG 4.46Å; E261-L265 HydrophobicContact CB-CD1 4.36Å; E261-L265 WeakPolarHBondContact O-CA 3.06Å; E261-L265 WeakPolarHBondContact O-CB 3.36Å; E261-L265 VanDerWaalsContact O-CD1 3.25Å; E261-L265 WeakPolarHBondContact O-CD1 3.02Å; E261-L265 WeakPolarHBondContact O-CG 3.38Å; E261-L265 PolarHBondContact O-N 3.33Å; L265-R267 PolarHBondContact O-N 2.93Å; L265-R267 VanDerWaalsContact O-N 3.12Å; L265-M270 HydrophobicContact CB-CG 4.37Å; L265-F296 HydrophobicContact CD1-CE1 3.63Å; L265-F296 HydrophobicContact CD1-CZ 3.37Å
266	K	58.5	Low	71	Confident	104 Å²	104	61.7 Å²	61.7	45%	0.452	35%	0.347	S	S	.	.			trans	-48	123.4	174.5	-64.6	176.9	-177.7	173.8	0	108.3	G237 G264 G268 I269	G237-K266 PolarHBondContact O-NZ 2.88Å; G264-K266 PolarHBondContact O-N 3.3Å; K266-G268 PolarHBondContact O-N 3Å; K266-I269 HydrophobicContact CB-CD1 4.4Å; K266-I269 PolarHBondContact O-N 3.5Å
267	R	62.3	Low	71.6	Confident	214 Å²	214	61.5 Å²	61.5	81%	0.808	35%	0.345	S	S	*	.	H	α-helix	trans	-35.3	-42.6	175.7	-125.1	173.4	167.1	178.9	-5	113.1	L265 I269 M270 E271	L265-R267 PolarHBondContact O-N 2.93Å; L265-R267 VanDerWaalsContact O-N 3.12Å; R267-I269 PolarHBondContact O-N 3.49Å; R267-M270 PolarHBondContact O-N 2.84Å; R267-E271 WeakPolarHBondContact O-CG 3.04Å; R267-E271 PolarHBondContact O-N 3.17Å
268	G	68.7	Low	72.8	Confident	37 Å²	37	58.2 Å²	58.2	38%	0.381	32%	0.319	S	S	.	.	H	α-helix	trans	-68.3	-20.4	-179.3	0	0	0	0	0	117.2	K266 N272	K266-G268 PolarHBondContact O-N 3Å; G268-N272 PolarHBondContact O-ND2 2.88Å
269	I	72.6	Confident	74.6	Confident	25 Å²	25	54.3 Å²	54.3	13%	0.128	30%	0.298	C	S	.	.	H	α-helix	trans	-81.1	-42.3	176.9	-61.5	170.1	0	0	0	110.1	T138 E240 L252 K266 R267 E271 N272 A273	T138-I269 HydrophobicContact CG2-CG2 4.45Å; E240-I269 HydrophobicContact CB-CD1 4.07Å; E240-I269 HydrophobicContact CB-CG1 3.9Å; E240-I269 HydrophobicContact CG-CD1 3.68Å; E240-I269 HydrophobicContact CG-CG1 4.1Å; L252-I269 HydrophobicContact CD1-CG2 3.77Å; L252-I269 HydrophobicContact CD2-CG2 4.23Å; K266-I269 HydrophobicContact CB-CD1 4.4Å; K266-I269 PolarHBondContact O-N 3.5Å; R267-I269 PolarHBondContact O-N 3.49Å; I269-E271 VanDerWaalsContact C-N 3.31Å; I269-E271 PolarHBondContact O-N 2.9Å; I269-N272 PolarHBondContact O-N 2.58Å; I269-N272 VanDerWaalsContact O-N 3.12Å; I269-A273 PolarHBondContact O-N 3.19Å
270	M	79.6	Confident	76.6	Confident	23 Å²	23	54.3 Å²	54.3	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-38.7	178.9	-79.9	-62.7	-56.1	0	0	112.3	L252 L265 R267 N272 A273 I276 F296 L300	L252-M270 HydrophobicContact CD2-SD 3.6Å; L252-M270 VanDerWaalsContact CD2-SD 3.6Å; L265-M270 HydrophobicContact CB-CG 4.37Å; R267-M270 PolarHBondContact O-N 2.84Å; M270-N272 PolarHBondContact O-N 3.39Å; M270-A273 PolarHBondContact O-N 2.72Å; M270-I276 HydrophobicContact CE-CD1 3.47Å; M270-I276 VanDerWaalsContact CE-CD1 3.47Å; M270-I276 HydrophobicContact SD-CD1 3.86Å; M270-F296 HydrophobicContact CE-CD1 3.66Å; M270-F296 HydrophobicContact CE-CE1 3.96Å; M270-F296 HydrophobicContact SD-CD1 3.86Å; M270-F296 HydrophobicContact SD-CE1 3.62Å; M270-L300 HydrophobicContact CE-CD2 4.11Å
271	E	81.6	Confident	78.4	Confident	103 Å²	103	48.7 Å²	48.7	48%	0.481	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.1	176.7	-71.2	168.8	-167.5	0	0	113.4	R267 I269 T303	R267-E271 WeakPolarHBondContact O-CG 3.04Å; R267-E271 PolarHBondContact O-N 3.17Å; I269-E271 VanDerWaalsContact C-N 3.31Å; I269-E271 PolarHBondContact O-N 2.9Å; E271-T303 HydrophobicContact CG-CG2 4.38Å
272	N	87.2	Confident	80.1	Confident	49 Å²	49	49.8 Å²	49.8	26%	0.262	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-4.9	-178.7	-73.1	-54	0	0	0	113.8	V244 V250 G268 I269 M270	V244-N272 HydrophobicContact CG1-CB 4.23Å; V244-N272 HydrophobicContact CG2-CB 3.77Å; V250-N272 VanDerWaalsContact CB-O 3.28Å; V250-N272 WeakPolarHBondContact CB-O 3.25Å; G268-N272 PolarHBondContact O-ND2 2.88Å; I269-N272 PolarHBondContact O-N 2.58Å; I269-N272 VanDerWaalsContact O-N 3.12Å; M270-N272 PolarHBondContact O-N 3.39Å
273	A	91	Very high	81.7	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.025	27%	0.269	C	S	.	.			trans	-80.9	121.1	-177	0	0	0	0	0	111.4	L252 I269 M270 I276 P312	L252-A273 HydrophobicContact CB-CB 3.92Å; L252-A273 HydrophobicContact CD2-CB 4.36Å; I269-A273 PolarHBondContact O-N 3.19Å; M270-A273 PolarHBondContact O-N 2.72Å; A273-I276 HydrophobicContact CB-CG1 4.07Å; A273-P312 WeakPolarHBondContact O-CB 3.48Å; A273-P312 WeakPolarHBondContact O-CG 3.22Å
274	D	94.8	Very high	83.4	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.274	C	S	.	.	S	Bend	trans	-92.2	-20.9	174.5	-44.5	-69.6	0	0	0	112.2	M249 V250 R306 F307 W310 P312 F335	M249-D274 WeakPolarHBondContact CA-OD2 3.34Å; M249-D274 HydrophobicContact CE-CB 4.19Å; M249-D274 HydrophobicContact CG-CB 3.95Å; V250-D274 PolarHBondContact N-OD2 3.41Å; V250-D274 PolarHBondContact O-N 3.26Å; D274-R306 VanDerWaalsContact CG-NH2 3.3Å; D274-R306 IonicContact OD1-CZ 2.83Å; D274-R306 IonicContact OD1-NE 3.8Å; D274-R306 PolarHBondContact OD1-NE 3.23Å; D274-R306 IonicContact OD1-NH2 2.73Å; D274-R306 PolarHBondContact OD1-NH2 3.35Å; D274-R306 IonicContact OD2-CZ 2.88Å; D274-R306 IonicContact OD2-NE 3.05Å; D274-R306 IonicContact OD2-NH2 2.79Å; D274-R306 PolarHBondContact OD2-NH2 3.26Å; D274-F307 WeakPolarHBondContact OD1-CE2 3.49Å; D274-W310 PolarHBondContact O-NE1 3.33Å; D274-P312 WeakPolarHBondContact O-CA 3.48Å; D274-F335 HydrophobicContact CB-CD2 4.05Å; D274-F335 HydrophobicContact CB-CE2 3.61Å; D274-F335 HydrophobicContact CB-CZ 4.27Å
275	L	95.7	Very high	85.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	132.5	172.4	173.7	65.6	0	0	0	109.5	M249 V250 V251 L252 V277 T313 L315 I328 A331 M332	M249-L275 HydrophobicContact CE-CB 3.34Å; M249-L275 HydrophobicContact CE-CD2 4.04Å; M249-L275 HydrophobicContact CE-CG 4.3Å; V250-L275 PolarHBondContact O-N 3.24Å; V251-L275 CarbonylContact C-O 3.57Å; V251-L275 VanDerWaalsContact CA-O 3.31Å; V251-L275 WeakPolarHBondContact CA-O 3.46Å; V251-L275 HydrophobicContact CG1-CD2 4.33Å; V251-L275 HydrophobicContact CG1-CG 4.42Å; V251-L275 HydrophobicContact CG2-CB 4.37Å; V251-L275 HydrophobicContact CG2-CD2 4.29Å; L252-L275 PolarHBondContact N-O 3.26Å; L275-V277 HydrophobicContact CD2-CG2 4.08Å; L275-V277 HydrophobicContact CG-CG2 4Å; L275-T313 WeakPolarHBondContact CD1-OG1 3.16Å; L275-L315 HydrophobicContact CD1-CD1 3.93Å; L275-L315 HydrophobicContact CD1-CG 4Å; L275-I328 HydrophobicContact CD2-CG2 4Å; L275-A331 HydrophobicContact CD1-CB 4.48Å; L275-M332 HydrophobicContact CD2-CG 3.95Å
276	I	94.2	Very high	86.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.4	173.1	-56.9	178.3	0	0	0	108	L252 L254 M270 A273 F296 L300 T313 V314 L315	L252-I276 HydrophobicContact CB-CG1 4.39Å; L252-I276 HydrophobicContact CD2-CG1 4.49Å; L252-I276 CarbonylContact O-C 3.51Å; L252-I276 WeakPolarHBondContact O-CA 3.43Å; L254-I276 HydrophobicContact CD1-CG2 3.4Å; L254-I276 VanDerWaalsContact CD1-CG2 3.4Å; L254-I276 HydrophobicContact CG-CG2 3.88Å; M270-I276 HydrophobicContact CE-CD1 3.47Å; M270-I276 VanDerWaalsContact CE-CD1 3.47Å; M270-I276 HydrophobicContact SD-CD1 3.86Å; A273-I276 HydrophobicContact CB-CG1 4.07Å; I276-F296 HydrophobicContact CD1-CD1 4.19Å; I276-L300 HydrophobicContact CD1-CD1 4.21Å; I276-L300 HydrophobicContact CD1-CD2 4.16Å; I276-L300 HydrophobicContact CD1-CG 4.39Å; I276-T313 PolarHBondContact N-O 3.12Å; I276-V314 HydrophobicContact CB-CB 4.41Å; I276-V314 HydrophobicContact CB-CG1 4.12Å; I276-V314 HydrophobicContact CB-CG2 4.12Å; I276-V314 HydrophobicContact CD1-CG2 4.33Å; I276-V314 HydrophobicContact CG2-CG1 3.98Å; I276-V314 CarbonylContact O-C 3.55Å; I276-V314 VanDerWaalsContact O-CA 3.31Å; I276-V314 WeakPolarHBondContact O-CA 3.18Å; I276-L315 PolarHBondContact O-N 3.35Å
277	V	95.7	Very high	88.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	114.1	177.7	177.4	0	0	0	0	108.8	F148 V251 L252 L253 L254 L275 T279 L315 A317 I328	F148-V277 HydrophobicContact CE2-CG1 4.31Å; V251-V277 HydrophobicContact CG1-CG2 3.86Å; L252-V277 PolarHBondContact O-N 2.64Å; L253-V277 WeakPolarHBondContact CA-O 3.44Å; L253-V277 HydrophobicContact CD2-CB 3.64Å; L253-V277 HydrophobicContact CD2-CG1 4.1Å; L253-V277 HydrophobicContact CD2-CG2 4.24Å; L254-V277 PolarHBondContact N-O 2.96Å; L275-V277 HydrophobicContact CD2-CG2 4.08Å; L275-V277 HydrophobicContact CG-CG2 4Å; V277-T279 HydrophobicContact CG1-CG2 4.3Å; V277-T279 PolarHBondContact O-N 3.31Å; V277-L315 WeakPolarHBondContact CA-O 3.42Å; V277-A317 HydrophobicContact CG1-CB 3.6Å; V277-I328 HydrophobicContact CB-CD1 4.29Å; V277-I328 HydrophobicContact CG1-CD1 3.57Å; V277-I328 HydrophobicContact CG2-CD1 3.67Å; V277-I328 HydrophobicContact CG2-CG1 4Å
278	V	94.7	Very high	89.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	107.4	169.4	-171.4	0	0	0	0	107.7	P256 A289 T292 R293 V314 L315 L316 A317	P256-V278 HydrophobicContact CG-CG1 3.99Å; V278-A289 HydrophobicContact CG1-CB 3.9Å; V278-T292 HydrophobicContact CG1-CG2 4.11Å; V278-T292 HydrophobicContact CG2-CG2 4.02Å; V278-R293 HydrophobicContact CG2-CB 4.17Å; V278-V314 HydrophobicContact CG2-CG1 3.97Å; V278-L315 PolarHBondContact N-O 3.06Å; V278-L316 HydrophobicContact CB-CD2 3.77Å; V278-L316 HydrophobicContact CG1-CD2 4.34Å; V278-L316 HydrophobicContact CG2-CD2 4.3Å; V278-L316 WeakPolarHBondContact O-CA 3.38Å; V278-A317 PolarHBondContact O-N 3.25Å
279	T	94.9	Very high	90.9	Very high	7 Å²	7	41 Å²	41	4%	0.043	23%	0.231	C	C	.	.			trans	-76	179.2	-177.6	63.1	0	0	0	0	111.7	A143 L253 L254 P256 V277 A281 A317	A143-T279 WeakPolarHBondContact O-CG2 3.31Å; A143-T279 PolarHBondContact O-OG1 3.42Å; L253-T279 HydrophobicContact CB-CG2 4.02Å; L253-T279 HydrophobicContact CD1-CG2 4.13Å; L253-T279 HydrophobicContact CD2-CG2 4.25Å; L253-T279 HydrophobicContact CG-CG2 4.37Å; L254-T279 PolarHBondContact O-N 3.26Å; L254-T279 PolarHBondContact O-OG1 3.16Å; P256-T279 WeakPolarHBondContact CD-O 3.43Å; P256-T279 WeakPolarHBondContact CG-O 3.22Å; V277-T279 HydrophobicContact CG1-CG2 4.3Å; V277-T279 PolarHBondContact O-N 3.31Å; T279-A281 PolarHBondContact O-N 2.85Å; T279-A317 CarbonylContact C-O 3.49Å; T279-A317 VanDerWaalsContact CA-O 3.25Å; T279-A317 WeakPolarHBondContact CA-O 3.28Å
280	K	94	Very high	91.9	Very high	72 Å²	72	44.3 Å²	44.3	31%	0.313	25%	0.248	S	C	.	.			trans	50.2	32.3	176.3	-48.9	174.3	-169.5	163.5	0	113.6	G142 S255 P256 D282 L285 A317	G142-K280 WeakPolarHBondContact O-CE 3.44Å; G142-K280 PolarHBondContact O-NZ 3.49Å; S255-K280 PolarHBondContact OG-NZ 3.27Å; P256-K280 HydrophobicContact CG-CB 4.13Å; K280-D282 PolarHBondContact O-N 2.68Å; K280-L285 HydrophobicContact CB-CD1 3.98Å; K280-L285 HydrophobicContact CD-CD1 4.1Å; K280-L285 WeakPolarHBondContact O-CB 3.44Å; K280-A317 PolarHBondContact N-O 2.98Å
281	A	94.2	Very high	92.5	Very high	10 Å²	10	45.5 Å²	45.5	8%	0.083	26%	0.261	C	S	.	.			trans	-79.4	55.1	-178.6	0	0	0	0	0	111.4	T279 A289 L316 A317	T279-A281 PolarHBondContact O-N 2.85Å; A281-A289 HydrophobicContact CB-CB 3.7Å; A281-L316 HydrophobicContact CB-CB 3.78Å; A281-L316 HydrophobicContact CB-CD2 4.37Å; A281-L316 HydrophobicContact CB-CG 4.44Å; A281-A317 PolarHBondContact N-O 3.39Å
282	D	92.6	Very high	93	Very high	55 Å²	55	41.4 Å²	41.4	29%	0.294	24%	0.243	S	C	.	.	S	Bend	trans	-146.7	165.2	-175.5	57.4	79.4	0	0	0	110.7	K280 E284 L285 A286 S318	K280-D282 PolarHBondContact O-N 2.68Å; D282-E284 PolarHBondContact O-N 2.81Å; D282-L285 PolarHBondContact O-N 3.25Å; D282-L285 VanDerWaalsContact O-N 3.16Å; D282-A286 PolarHBondContact O-N 3.05Å; D282-S318 VanDerWaalsContact CG-OG 3.27Å; D282-S318 WeakPolarHBondContact OD2-CB 3.36Å; D282-S318 PolarHBondContact OD2-OG 2.9Å
283	G	92.1	Very high	93.2	Very high	67 Å²	67	43.7 Å²	43.7	69%	0.691	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	52.7	-136.8	178.4	0	0	0	0	0	113.7	L285 A286	G283-L285 PolarHBondContact O-N 2.73Å; G283-A286 WeakPolarHBondContact O-CB 3.21Å; G283-A286 PolarHBondContact O-N 3.41Å
284	E	91.1	Very high	93.2	Very high	197 Å²	197	46.9 Å²	46.9	92%	0.921	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-65.7	-23.3	-179.8	-61.7	-179	172.1	0	0	113.2	D282	D282-E284 PolarHBondContact O-N 2.81Å
285	L	92.1	Very high	92.9	Very high	64 Å²	64	51.7 Å²	51.7	34%	0.335	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-86	-7.5	-178.8	-66	-179.7	0	0	0	113.4	P256 A257 K280 D282 G283 N287 A288 A289	P256-L285 HydrophobicContact CB-CB 4.2Å; P256-L285 HydrophobicContact CG-CB 4.34Å; A257-L285 HydrophobicContact CB-CD2 4.26Å; K280-L285 HydrophobicContact CB-CD1 3.98Å; K280-L285 HydrophobicContact CD-CD1 4.1Å; K280-L285 WeakPolarHBondContact O-CB 3.44Å; D282-L285 PolarHBondContact O-N 3.25Å; D282-L285 VanDerWaalsContact O-N 3.16Å; G283-L285 PolarHBondContact O-N 2.73Å; L285-N287 PolarHBondContact O-N 2.98Å; L285-A288 PolarHBondContact O-N 3.08Å; L285-A289 WeakPolarHBondContact O-CB 3.19Å; L285-A289 PolarHBondContact O-N 2.61Å
286	A	92.3	Very high	92.6	Very high	28 Å²	28	52 Å²	52	23%	0.231	29%	0.294	C	S	.	.	H	α-helix	trans	-57.3	-45.4	-176.3	0	0	0	0	0	113	D282 G283 A289 I290	D282-A286 PolarHBondContact O-N 3.05Å; G283-A286 WeakPolarHBondContact O-CB 3.21Å; G283-A286 PolarHBondContact O-N 3.41Å; A286-A289 WeakPolarHBondContact O-CB 3.48Å; A286-A289 PolarHBondContact O-N 3.05Å; A286-I290 WeakPolarHBondContact O-CG1 3.38Å; A286-I290 PolarHBondContact O-N 3.24Å
287	N	92.8	Very high	92.3	Very high	130 Å²	130	55 Å²	55	70%	0.695	31%	0.31	S	S	*	.	H	α-helix	trans	-67.2	-41.2	179.2	-72.3	-23.9	0	0	0	111.9	L285 A289 I290 A291	L285-N287 PolarHBondContact O-N 2.98Å; N287-A289 VanDerWaalsContact C-N 3.3Å; N287-A289 PolarHBondContact O-N 3.46Å; N287-I290 PolarHBondContact O-N 3.38Å; N287-A291 PolarHBondContact O-N 3.39Å
288	A	92.3	Very high	91.9	Very high	28 Å²	28	58.2 Å²	58.2	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-40.2	174.8	0	0	0	0	0	111.1	P256 A257 L285 I290 A291 T292	P256-A288 HydrophobicContact CB-CB 3.98Å; A257-A288 HydrophobicContact CB-CB 4.1Å; L285-A288 PolarHBondContact O-N 3.08Å; A288-I290 PolarHBondContact O-N 3.08Å; A288-A291 PolarHBondContact O-N 3.26Å; A288-T292 PolarHBondContact O-N 3.32Å; A288-T292 PolarHBondContact O-OG1 3.4Å; A288-T292 VanDerWaalsContact O-OG1 3.05Å
289	A	93.2	Very high	91.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.6	-42.3	178.6	0	0	0	0	0	111.9	P256 V278 A281 L285 A286 N287 T292 R293 L316	P256-A289 HydrophobicContact CB-CB 4.02Å; P256-A289 HydrophobicContact CG-CB 3.59Å; V278-A289 HydrophobicContact CG1-CB 3.9Å; A281-A289 HydrophobicContact CB-CB 3.7Å; L285-A289 WeakPolarHBondContact O-CB 3.19Å; L285-A289 PolarHBondContact O-N 2.61Å; A286-A289 WeakPolarHBondContact O-CB 3.48Å; A286-A289 PolarHBondContact O-N 3.05Å; N287-A289 VanDerWaalsContact C-N 3.3Å; N287-A289 PolarHBondContact O-N 3.46Å; A289-T292 PolarHBondContact O-N 3.45Å; A289-R293 WeakPolarHBondContact O-CB 3.49Å; A289-R293 PolarHBondContact O-N 3.14Å; A289-L316 HydrophobicContact CB-CD2 4.13Å; A289-L316 WeakPolarHBondContact O-CD2 3.46Å
290	I	93.9	Very high	91	Very high	93 Å²	93	59.6 Å²	59.6	48%	0.477	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-45.3	175.5	-67.7	164	0	0	0	110.6	A286 N287 A288 R293 S294 L316	A286-I290 WeakPolarHBondContact O-CG1 3.38Å; A286-I290 PolarHBondContact O-N 3.24Å; N287-I290 PolarHBondContact O-N 3.38Å; A288-I290 PolarHBondContact O-N 3.08Å; I290-R293 PolarHBondContact O-N 3.06Å; I290-S294 PolarHBondContact O-N 2.95Å; I290-L316 HydrophobicContact CG1-CD1 3.77Å
291	A	92.1	Very high	90.4	Very high	48 Å²	48	63.6 Å²	63.6	40%	0.397	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-47.9	177.3	0	0	0	0	0	111.7	N287 A288 R293 S294 Q295	N287-A291 PolarHBondContact O-N 3.39Å; A288-A291 PolarHBondContact O-N 3.26Å; A291-R293 PolarHBondContact O-N 3.33Å; A291-S294 WeakPolarHBondContact O-CB 3.37Å; A291-S294 PolarHBondContact O-N 3.48Å; A291-Q295 WeakPolarHBondContact O-CG 3.25Å; A291-Q295 PolarHBondContact O-N 3.42Å
292	T	91	Very high	89.8	Confident	17 Å²	17	73.1 Å²	73.1	10%	0.104	40%	0.398	C	S	.	.	H	α-helix	trans	-57	-48.3	175	-60.3	0	0	0	0	110.9	V278 A288 A289 S294 Q295 F296	V278-T292 HydrophobicContact CG1-CG2 4.11Å; V278-T292 HydrophobicContact CG2-CG2 4.02Å; A288-T292 PolarHBondContact O-N 3.32Å; A288-T292 PolarHBondContact O-OG1 3.4Å; A288-T292 VanDerWaalsContact O-OG1 3.05Å; A289-T292 PolarHBondContact O-N 3.45Å; T292-S294 VanDerWaalsContact C-N 3.3Å; T292-S294 PolarHBondContact O-N 3.48Å; T292-Q295 WeakPolarHBondContact O-CB 3.13Å; T292-Q295 PolarHBondContact O-N 2.96Å; T292-Q295 VanDerWaalsContact O-N 3.14Å; T292-F296 HydrophobicContact CG2-CD2 3.73Å; T292-F296 HydrophobicContact CG2-CE2 3.76Å; T292-F296 VanDerWaalsContact O-CD2 3.31Å; T292-F296 WeakPolarHBondContact O-CD2 3.01Å; T292-F296 PolarHBondContact O-N 2.98Å
293	R	93.1	Very high	89.2	Confident	97 Å²	97	72.5 Å²	72.5	37%	0.366	40%	0.397	S	S	.	.	H	α-helix	trans	-55.4	-45.1	176.5	167.5	175.6	170.7	-143.9	-6.9	112.1	V278 A289 I290 A291 Q295 F296 L297 V314 L316	V278-R293 HydrophobicContact CG2-CB 4.17Å; A289-R293 WeakPolarHBondContact O-CB 3.49Å; A289-R293 PolarHBondContact O-N 3.14Å; I290-R293 PolarHBondContact O-N 3.06Å; A291-R293 PolarHBondContact O-N 3.33Å; R293-Q295 VanDerWaalsContact C-N 3.34Å; R293-Q295 PolarHBondContact O-N 3.22Å; R293-F296 PolarHBondContact O-N 3.37Å; R293-L297 HydrophobicContact CG-CD1 3.83Å; R293-L297 HydrophobicContact CG-CG 4.33Å; R293-L297 WeakPolarHBondContact O-CB 3.5Å; R293-L297 WeakPolarHBondContact O-CG 3.19Å; R293-L297 PolarHBondContact O-N 3.41Å; R293-V314 HydrophobicContact CB-CG1 4.09Å; R293-V314 HydrophobicContact CG-CB 4.15Å; R293-V314 HydrophobicContact CG-CG1 3.85Å; R293-V314 PolarHBondContact NE-O 3.5Å; R293-V314 VanDerWaalsContact NE-O 3.13Å; R293-L316 HydrophobicContact CB-CD2 3.66Å; R293-L316 HydrophobicContact CB-CG 4.49Å; R293-L316 HydrophobicContact CG-CD2 4.32Å
294	S	91.4	Very high	88.8	Confident	70 Å²	70	80.3 Å²	80.3	49%	0.49	41%	0.405	S	S	.	.	H	α-helix	trans	-60.9	-43.3	178.7	-167.7	0	0	0	0	111.8	I290 A291 T292 L297 S298	I290-S294 PolarHBondContact O-N 2.95Å; A291-S294 WeakPolarHBondContact O-CB 3.37Å; A291-S294 PolarHBondContact O-N 3.48Å; T292-S294 VanDerWaalsContact C-N 3.3Å; T292-S294 PolarHBondContact O-N 3.48Å; S294-L297 PolarHBondContact O-N 2.92Å; S294-S298 PolarHBondContact O-N 3.27Å; S294-S298 VanDerWaalsContact O-N 3.11Å; S294-S298 PolarHBondContact O-OG 3.12Å
295	Q	88.2	Confident	88.7	Confident	103 Å²	103	72.4 Å²	72.4	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-61.3	-46	178.3	-69.1	169.8	-11.3	0	0	111.9	L262 A291 T292 R293 S298 A299	L262-Q295 HydrophobicContact CD1-CB 4.11Å; A291-Q295 WeakPolarHBondContact O-CG 3.25Å; A291-Q295 PolarHBondContact O-N 3.42Å; T292-Q295 WeakPolarHBondContact O-CB 3.13Å; T292-Q295 PolarHBondContact O-N 2.96Å; T292-Q295 VanDerWaalsContact O-N 3.14Å; R293-Q295 VanDerWaalsContact C-N 3.34Å; R293-Q295 PolarHBondContact O-N 3.22Å; Q295-S298 PolarHBondContact O-N 3.15Å; Q295-A299 PolarHBondContact O-N 2.82Å
296	F	88.5	Confident	88.6	Confident	7 Å²	7	72.5 Å²	72.5	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-70.3	-36.2	179.5	-81.4	-84.2	0	0	0	112.9	L254 L262 L265 M270 I276 T292 R293 S298 A299 L300 V314	L254-F296 HydrophobicContact CD1-CD1 3.95Å; L254-F296 HydrophobicContact CD1-CD2 3.62Å; L254-F296 HydrophobicContact CD1-CE1 3.79Å; L254-F296 HydrophobicContact CD1-CE2 3.47Å; L254-F296 VanDerWaalsContact CD1-CE2 3.47Å; L254-F296 HydrophobicContact CD1-CG 3.88Å; L254-F296 HydrophobicContact CD1-CZ 3.56Å; L262-F296 HydrophobicContact CB-CZ 4.3Å; L262-F296 HydrophobicContact CD1-CD2 4.34Å; L262-F296 HydrophobicContact CD1-CE1 4.31Å; L262-F296 HydrophobicContact CD1-CE2 3.93Å; L262-F296 HydrophobicContact CD1-CZ 3.9Å; L262-F296 HydrophobicContact CG-CE1 4.29Å; L262-F296 HydrophobicContact CG-CE2 4.44Å; L262-F296 HydrophobicContact CG-CZ 3.94Å; L265-F296 HydrophobicContact CD1-CE1 3.63Å; L265-F296 HydrophobicContact CD1-CZ 3.37Å; M270-F296 HydrophobicContact CE-CD1 3.66Å; M270-F296 HydrophobicContact CE-CE1 3.96Å; M270-F296 HydrophobicContact SD-CD1 3.86Å; M270-F296 HydrophobicContact SD-CE1 3.62Å; I276-F296 HydrophobicContact CD1-CD1 4.19Å; T292-F296 HydrophobicContact CG2-CD2 3.73Å; T292-F296 HydrophobicContact CG2-CE2 3.76Å; T292-F296 VanDerWaalsContact O-CD2 3.31Å; T292-F296 WeakPolarHBondContact O-CD2 3.01Å; T292-F296 PolarHBondContact O-N 2.98Å; R293-F296 PolarHBondContact O-N 3.37Å; F296-S298 VanDerWaalsContact C-N 3.3Å; F296-S298 PolarHBondContact O-N 3.43Å; F296-A299 PolarHBondContact O-N 3.02Å; F296-L300 WeakPolarHBondContact O-CG 3.23Å; F296-L300 PolarHBondContact O-N 3.33Å; F296-V314 HydrophobicContact CB-CG1 4.29Å; F296-V314 HydrophobicContact CB-CG2 3.96Å
297	L	89	Confident	88.6	Confident	61 Å²	61	71.9 Å²	71.9	32%	0.319	36%	0.36	S	S	.	.	H	α-helix	trans	-58.8	-43.4	172	-76.2	170.1	0	0	0	111.2	R293 S294 L300 H301 V314	R293-L297 HydrophobicContact CG-CD1 3.83Å; R293-L297 HydrophobicContact CG-CG 4.33Å; R293-L297 WeakPolarHBondContact O-CB 3.5Å; R293-L297 WeakPolarHBondContact O-CG 3.19Å; R293-L297 PolarHBondContact O-N 3.41Å; S294-L297 PolarHBondContact O-N 2.92Å; L297-L300 PolarHBondContact O-N 3.46Å; L297-H301 PolarHBondContact O-CE1 3.45Å; L297-H301 PolarHBondContact O-ND1 3.22Å; L297-V314 HydrophobicContact CD2-CB 3.84Å; L297-V314 HydrophobicContact CD2-CG2 3.7Å; L297-V314 HydrophobicContact CG-CB 3.88Å; L297-V314 HydrophobicContact CG-CG2 3.85Å
298	S	86.6	Confident	88.7	Confident	68 Å²	68	75.5 Å²	75.5	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-63.4	-42.2	175	-61.3	0	0	0	0	112.3	S294 Q295 F296 L300 H301 Y302	S294-S298 PolarHBondContact O-N 3.27Å; S294-S298 VanDerWaalsContact O-N 3.11Å; S294-S298 PolarHBondContact O-OG 3.12Å; Q295-S298 PolarHBondContact O-N 3.15Å; F296-S298 VanDerWaalsContact C-N 3.3Å; F296-S298 PolarHBondContact O-N 3.43Å; S298-L300 PolarHBondContact O-N 3.47Å; S298-H301 WeakPolarHBondContact O-CB 3.25Å; S298-H301 PolarHBondContact O-N 3.16Å; S298-Y302 WeakPolarHBondContact O-CD2 3.34Å
299	A	84.7	Confident	88.8	Confident	30 Å²	30	76.8 Å²	76.8	25%	0.248	38%	0.376	C	S	.	.	H	α-helix	trans	-65	-35.6	179	0	0	0	0	0	113.3	Q295 F296 H301 Y302 T303	Q295-A299 PolarHBondContact O-N 2.82Å; F296-A299 PolarHBondContact O-N 3.02Å; A299-H301 PolarHBondContact O-N 3.32Å; A299-Y302 PolarHBondContact O-N 3.02Å; A299-Y302 VanDerWaalsContact O-N 3.12Å; A299-T303 PolarHBondContact O-OG1 3.05Å
300	L	85.5	Confident	88.9	Confident	6 Å²	6	78.3 Å²	78.3	3%	0.031	38%	0.382	C	S	.	.	H	α-helix	trans	-63.9	-23.1	179.4	-75.4	176.2	0	0	0	113.6	M270 I276 F296 L297 S298 Y302 T303 P312 V314	M270-L300 HydrophobicContact CE-CD2 4.11Å; I276-L300 HydrophobicContact CD1-CD1 4.21Å; I276-L300 HydrophobicContact CD1-CD2 4.16Å; I276-L300 HydrophobicContact CD1-CG 4.39Å; F296-L300 WeakPolarHBondContact O-CG 3.23Å; F296-L300 PolarHBondContact O-N 3.33Å; L297-L300 PolarHBondContact O-N 3.46Å; S298-L300 PolarHBondContact O-N 3.47Å; L300-Y302 PolarHBondContact O-N 3.32Å; L300-T303 PolarHBondContact O-N 3.24Å; L300-T303 VanDerWaalsContact O-N 3.16Å; L300-P312 HydrophobicContact CD1-CB 4.1Å; L300-P312 HydrophobicContact CD2-CB 4.02Å; L300-V314 HydrophobicContact CD1-CG2 3.51Å
301	H	81.9	Confident	88.9	Confident	157 Å²	157	79 Å²	79	73%	0.727	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.9	175.3	-73	74.1	0	0	0	112.9	L297 S298 A299	L297-H301 PolarHBondContact O-CE1 3.45Å; L297-H301 PolarHBondContact O-ND1 3.22Å; S298-H301 WeakPolarHBondContact O-CB 3.25Å; S298-H301 PolarHBondContact O-N 3.16Å; A299-H301 PolarHBondContact O-N 3.32Å
302	Y	81.5	Confident	89	Confident	209 Å²	209	77.4 Å²	77.4	82%	0.82	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	0.2	-179.9	-56.9	-77.2	0	0	0	113	S298 A299 L300	S298-Y302 WeakPolarHBondContact O-CD2 3.34Å; A299-Y302 PolarHBondContact O-N 3.02Å; A299-Y302 VanDerWaalsContact O-N 3.12Å; L300-Y302 PolarHBondContact O-N 3.32Å
303	T	79.9	Confident	89.1	Confident	42 Å²	42	78.9 Å²	78.9	26%	0.258	38%	0.378	S	S	.	.	S	Bend	trans	-105.9	135.4	-177	-51.1	0	0	0	0	109.8	E271 A299 L300	E271-T303 HydrophobicContact CG-CG2 4.38Å; A299-T303 PolarHBondContact O-OG1 3.05Å; L300-T303 PolarHBondContact O-N 3.24Å; L300-T303 VanDerWaalsContact O-N 3.16Å
304	R	83.8	Confident	89.2	Confident	232 Å²	232	74.4 Å²	74.4	88%	0.875	36%	0.362	S	S	*	.			trans	-77.7	130.9	171.1	-70.9	-175.1	178.7	-176.7	0.2	109.1
305	S	88.3	Confident	89.4	Confident	31 Å²	31	73 Å²	73	22%	0.217	35%	0.348	C	S	.	.			trans	-64.4	148.9	170.2	-175.4	0	0	0	0	111	F307 W310	S305-F307 WeakPolarHBondContact CB-O 3.48Å; S305-F307 PolarHBondContact O-N 3.47Å; S305-F307 PolarHBondContact OG-N 3.35Å; S305-F307 PolarHBondContact OG-O 3.12Å; S305-W310 WeakPolarHBondContact CB-O 3.49Å; S305-W310 PolarHBondContact OG-O 2.97Å
306	R	89.8	Confident	89.9	Confident	65 Å²	65	69.9 Å²	69.9	25%	0.245	34%	0.335	C	S	.	.	S	Bend	trans	-64.1	-31.2	172.4	-178.2	167.1	64.1	141.3	7.2	112.3	D248 D274 Q348	D248-R306 PolarHBondContact O-NH2 2.79Å; D274-R306 VanDerWaalsContact CG-NH2 3.3Å; D274-R306 IonicContact OD1-CZ 2.83Å; D274-R306 IonicContact OD1-NE 3.8Å; D274-R306 PolarHBondContact OD1-NE 3.23Å; D274-R306 IonicContact OD1-NH2 2.73Å; D274-R306 PolarHBondContact OD1-NH2 3.35Å; D274-R306 IonicContact OD2-CZ 2.88Å; D274-R306 IonicContact OD2-NE 3.05Å; D274-R306 IonicContact OD2-NH2 2.79Å; D274-R306 PolarHBondContact OD2-NH2 3.26Å; R306-Q348 VanDerWaalsContact NH1-NE2 3.18Å
307	F	93.8	Very high	90.3	Very high	16 Å²	16	69.7 Å²	69.7	7%	0.07	33%	0.334	C	S	.	.	S	Bend	trans	-119.5	145.2	179.7	-54.8	-73.9	0	0	0	110.8	D274 S305 S309 W310 F335 L339 E344 Q348	D274-F307 WeakPolarHBondContact OD1-CE2 3.49Å; S305-F307 WeakPolarHBondContact CB-O 3.48Å; S305-F307 PolarHBondContact O-N 3.47Å; S305-F307 PolarHBondContact OG-N 3.35Å; S305-F307 PolarHBondContact OG-O 3.12Å; F307-S309 VanDerWaalsContact C-N 3.3Å; F307-W310 HydrophobicContact CB-CB 4.3Å; F307-W310 VanDerWaalsContact O-O 3.11Å; F307-F335 AromaticContact CD2-CE2 3.87Å; F307-F335 HydrophobicContact CD2-CE2 3.87Å; F307-F335 HydrophobicContact CD2-CZ 4.08Å; F307-F335 AromaticContact CE2-CE2 3.91Å; F307-F335 HydrophobicContact CE2-CE2 3.91Å; F307-F335 AromaticContact CE2-CZ 3.68Å; F307-F335 HydrophobicContact CE2-CZ 3.68Å; F307-F335 HydrophobicContact CZ-CZ 4.48Å; F307-L339 HydrophobicContact CB-CD1 4.23Å; F307-L339 HydrophobicContact CD1-CD2 3.91Å; F307-L339 HydrophobicContact CD1-CG 4.28Å; F307-L339 HydrophobicContact CD2-CD1 4.22Å; F307-L339 HydrophobicContact CD2-CD2 3.82Å; F307-L339 HydrophobicContact CD2-CG 4.37Å; F307-L339 HydrophobicContact CE1-CD2 3.84Å; F307-L339 HydrophobicContact CE2-CD2 3.72Å; F307-L339 HydrophobicContact CG-CD1 4.18Å; F307-L339 HydrophobicContact CG-CD2 3.89Å; F307-L339 HydrophobicContact CG-CG 4.13Å; F307-L339 HydrophobicContact CZ-CD2 3.74Å; F307-E344 WeakPolarHBondContact CA-OE1 3.43Å; F307-E344 HydrophobicContact CD1-CB 4.06Å; F307-Q348 HydrophobicContact CE1-CB 4.38Å; F307-Q348 HydrophobicContact CE1-CG 4.42Å; F307-Q348 VanDerWaalsContact CZ-CD 3.49Å; F307-Q348 HydrophobicContact CZ-CG 4.46Å
308	K	93.8	Very high	90.6	Very high	206 Å²	206	66.8 Å²	66.8	90%	0.896	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-30.8	177.7	-64.8	179.2	-177.2	174.9	0	111.6	W310 E344	K308-W310 VanDerWaalsContact C-N 3.33Å; K308-E344 PolarHBondContact N-OE1 3.06Å
309	S	94.7	Very high	90.9	Very high	54 Å²	54	64.6 Å²	64.6	38%	0.378	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	5.5	-174.5	-45	0	0	0	0	113.6	F307 S342 E344	F307-S309 VanDerWaalsContact C-N 3.3Å; S309-S342 WeakPolarHBondContact OG-CB 3.44Å; S309-S342 PolarHBondContact OG-OG 3.01Å; S309-E344 WeakPolarHBondContact CB-OE2 3.42Å; S309-E344 PolarHBondContact N-OE2 3.47Å; S309-E344 PolarHBondContact OG-OE2 2.9Å
310	W	95.9	Very high	91.2	Very high	33 Å²	33	69 Å²	69	13%	0.125	33%	0.328	C	S	.	.			trans	-137.9	137	-179.9	-172.4	-108.2	0	0	0	112	D274 S305 F307 K308 A331 D334 F335 A338 L339	D274-W310 PolarHBondContact O-NE1 3.33Å; S305-W310 WeakPolarHBondContact CB-O 3.49Å; S305-W310 PolarHBondContact OG-O 2.97Å; F307-W310 HydrophobicContact CB-CB 4.3Å; F307-W310 VanDerWaalsContact O-O 3.11Å; K308-W310 VanDerWaalsContact C-N 3.33Å; W310-A331 VanDerWaalsContact CH2-O 3.27Å; W310-A331 WeakPolarHBondContact CH2-O 3.36Å; W310-D334 HydrophobicContact CH2-CB 3.97Å; W310-D334 HydrophobicContact CZ3-CB 4.01Å; W310-F335 HydrophobicContact CB-CD2 4.17Å; W310-F335 HydrophobicContact CB-CE2 4.34Å; W310-F335 AromaticContact CD1-CD2 3.5Å; W310-F335 AromaticContact CD1-CE2 3.84Å; W310-F335 HydrophobicContact CD2-CB 4.1Å; W310-F335 AromaticContact CD2-CD2 3.58Å; W310-F335 HydrophobicContact CD2-CD2 3.58Å; W310-F335 HydrophobicContact CD2-CG 4.31Å; W310-F335 AromaticContact CE2-CD2 3.63Å; W310-F335 HydrophobicContact CE3-CB 4.12Å; W310-F335 HydrophobicContact CE3-CD2 4.28Å; W310-F335 AromaticContact CG-CD2 3.49Å; W310-F335 HydrophobicContact CG-CD2 3.49Å; W310-F335 VanDerWaalsContact CG-CD2 3.49Å; W310-F335 AromaticContact CG-CE2 3.98Å; W310-F335 HydrophobicContact CG-CE2 3.98Å; W310-F335 HydrophobicContact CH2-CB 3.8Å; W310-F335 HydrophobicContact CZ2-CB 3.77Å; W310-F335 HydrophobicContact CZ2-CD2 4.33Å; W310-F335 HydrophobicContact CZ3-CB 3.99Å; W310-F335 VanDerWaalsContact CZ3-N 3.27Å; W310-F335 AromaticContact NE1-CD2 3.57Å; W310-A338 HydrophobicContact CE3-CB 4.19Å; W310-L339 HydrophobicContact CB-CD1 3.88Å
311	Q	93.3	Very high	91.6	Very high	108 Å²	108	72 Å²	72	51%	0.505	35%	0.35	S	S	.	.			trans	-109.7	124.3	169.1	-175	62.5	26.3	0	0	108.7	T313	Q311-T313 PolarHBondContact O-N 3.11Å
312	P	93.4	Very high	92.2	Very high	13 Å²	13	71.2 Å²	71.2	8%	0.084	35%	0.345	C	S	.	.			trans	-56.7	141.6	177.6	-26.5	34.6	0	0	0	112.4	A273 D274 L300	A273-P312 WeakPolarHBondContact O-CB 3.48Å; A273-P312 WeakPolarHBondContact O-CG 3.22Å; D274-P312 WeakPolarHBondContact O-CA 3.48Å; L300-P312 HydrophobicContact CD1-CB 4.1Å; L300-P312 HydrophobicContact CD2-CB 4.02Å
313	T	93.4	Very high	92.8	Very high	49 Å²	49	68.3 Å²	68.3	30%	0.301	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	161.1	179.1	58.1	0	0	0	0	111	L275 I276 Q311	L275-T313 WeakPolarHBondContact CD1-OG1 3.16Å; I276-T313 PolarHBondContact N-O 3.12Å; Q311-T313 PolarHBondContact O-N 3.11Å
314	V	95	Very high	93.6	Very high	3 Å²	3	66.7 Å²	66.7	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.3	176.8	-167.7	0	0	0	0	109.5	I276 V278 R293 F296 L297 L300	I276-V314 HydrophobicContact CB-CB 4.41Å; I276-V314 HydrophobicContact CB-CG1 4.12Å; I276-V314 HydrophobicContact CB-CG2 4.12Å; I276-V314 HydrophobicContact CD1-CG2 4.33Å; I276-V314 HydrophobicContact CG2-CG1 3.98Å; I276-V314 CarbonylContact O-C 3.55Å; I276-V314 VanDerWaalsContact O-CA 3.31Å; I276-V314 WeakPolarHBondContact O-CA 3.18Å; V278-V314 HydrophobicContact CG2-CG1 3.97Å; R293-V314 HydrophobicContact CB-CG1 4.09Å; R293-V314 HydrophobicContact CG-CB 4.15Å; R293-V314 HydrophobicContact CG-CG1 3.85Å; R293-V314 PolarHBondContact NE-O 3.5Å; R293-V314 VanDerWaalsContact NE-O 3.13Å; F296-V314 HydrophobicContact CB-CG1 4.29Å; F296-V314 HydrophobicContact CB-CG2 3.96Å; L297-V314 HydrophobicContact CD2-CB 3.84Å; L297-V314 HydrophobicContact CD2-CG2 3.7Å; L297-V314 HydrophobicContact CG-CB 3.88Å; L297-V314 HydrophobicContact CG-CG2 3.85Å; L300-V314 HydrophobicContact CD1-CG2 3.51Å
315	L	97.3	Very high	94.3	Very high	39 Å²	39	55.7 Å²	55.7	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	159.4	-179.9	-62.8	-178.7	0	0	0	111.3	L275 I276 V277 V278 I328 A331	L275-L315 HydrophobicContact CD1-CD1 3.93Å; L275-L315 HydrophobicContact CD1-CG 4Å; I276-L315 PolarHBondContact O-N 3.35Å; V277-L315 WeakPolarHBondContact CA-O 3.42Å; V278-L315 PolarHBondContact N-O 3.06Å; L315-I328 HydrophobicContact CB-CG1 4.18Å; L315-I328 HydrophobicContact CD1-CB 4.45Å; L315-I328 HydrophobicContact CD1-CG1 3.78Å; L315-A331 HydrophobicContact CD1-CB 3.85Å
316	L	97.2	Very high	94.8	Very high	39 Å²	39	56.9 Å²	56.9	20%	0.204	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	139.3	173.8	-61.5	-178.6	0	0	0	108.8	V278 A281 A289 I290 R293 G324	V278-L316 HydrophobicContact CB-CD2 3.77Å; V278-L316 HydrophobicContact CG1-CD2 4.34Å; V278-L316 HydrophobicContact CG2-CD2 4.3Å; V278-L316 WeakPolarHBondContact O-CA 3.38Å; A281-L316 HydrophobicContact CB-CB 3.78Å; A281-L316 HydrophobicContact CB-CD2 4.37Å; A281-L316 HydrophobicContact CB-CG 4.44Å; A289-L316 HydrophobicContact CB-CD2 4.13Å; A289-L316 WeakPolarHBondContact O-CD2 3.46Å; I290-L316 HydrophobicContact CG1-CD1 3.77Å; R293-L316 HydrophobicContact CB-CD2 3.66Å; R293-L316 HydrophobicContact CB-CG 4.49Å; R293-L316 HydrophobicContact CG-CD2 4.32Å; L316-G324 WeakPolarHBondContact O-CA 2.94Å
317	A	97.1	Very high	95.1	Very high	2 Å²	2	58.9 Å²	58.9	2%	0.017	31%	0.305	C	S	.	.			trans	-141.1	151.9	171.5	0	0	0	0	0	113.2	F148 V277 V278 T279 K280 A281 K323 I328	F148-A317 HydrophobicContact CE2-CB 4.42Å; V277-A317 HydrophobicContact CG1-CB 3.6Å; V278-A317 PolarHBondContact O-N 3.25Å; T279-A317 CarbonylContact C-O 3.49Å; T279-A317 VanDerWaalsContact CA-O 3.25Å; T279-A317 WeakPolarHBondContact CA-O 3.28Å; K280-A317 PolarHBondContact N-O 2.98Å; A281-A317 PolarHBondContact N-O 3.39Å; A317-K323 WeakPolarHBondContact CA-O 3.25Å; A317-I328 HydrophobicContact CB-CD1 3.57Å
318	S	96.3	Very high	95.4	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.007	30%	0.302	C	S	.	.			trans	-127.5	113.7	167.9	168.2	0	0	0	0	107.6	D282 V320 S321 K322 K323	D282-S318 VanDerWaalsContact CG-OG 3.27Å; D282-S318 WeakPolarHBondContact OD2-CB 3.36Å; D282-S318 PolarHBondContact OD2-OG 2.9Å; S318-V320 PolarHBondContact O-N 3.5Å; S318-S321 WeakPolarHBondContact CB-OG 3.34Å; S318-S321 PolarHBondContact OG-N 3.47Å; S318-S321 PolarHBondContact OG-OG 3.48Å; S318-K322 CarbonylContact O-C 3.45Å; S318-K322 WeakPolarHBondContact O-CA 3.32Å; S318-K322 PolarHBondContact O-N 3.17Å; S318-K323 PolarHBondContact N-O 3.47Å; S318-K323 PolarHBondContact O-N 2.88Å
319	A	92.6	Very high	95.6	Very high	22 Å²	22	50.3 Å²	50.3	18%	0.182	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-31.1	176.5	0	0	0	0	0	111.6	T147 A151	T147-A319 HydrophobicContact CG2-CB 3.77Å; A151-A319 HydrophobicContact CB-CB 3.99Å
320	V	91.4	Very high	95.7	Very high	121 Å²	121	53.8 Å²	53.8	73%	0.733	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-53.3	-179.1	179.4	0	0	0	0	111.2	S318 K322	S318-V320 PolarHBondContact O-N 3.5Å; V320-K322 VanDerWaalsContact C-N 3.27Å; V320-K322 PolarHBondContact O-N 3.33Å
321	S	93.1	Very high	95.8	Very high	69 Å²	69	52.7 Å²	52.7	48%	0.483	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-6	178.3	68	0	0	0	0	113.3	S318 K323	S318-S321 WeakPolarHBondContact CB-OG 3.34Å; S318-S321 PolarHBondContact OG-N 3.47Å; S318-S321 PolarHBondContact OG-OG 3.48Å; S321-K323 PolarHBondContact O-N 2.77Å; S321-K323 VanDerWaalsContact O-N 3.11Å; S321-K323 WeakPolarHBondContact OG-CB 3.35Å
322	K	94.4	Very high	96.1	Very high	142 Å²	142	47.7 Å²	47.7	62%	0.617	25%	0.25	S	C	*	.			trans	59.8	11.3	-174.2	-53.7	174.2	-175.9	174.6	0	114.3	S318 V320 I325	S318-K322 CarbonylContact O-C 3.45Å; S318-K322 WeakPolarHBondContact O-CA 3.32Å; S318-K322 PolarHBondContact O-N 3.17Å; V320-K322 VanDerWaalsContact C-N 3.27Å; V320-K322 PolarHBondContact O-N 3.33Å; K322-I325 WeakPolarHBondContact O-CB 3.23Å; K322-I325 WeakPolarHBondContact O-CG1 3.44Å
323	K	95.2	Very high	96.3	Very high	148 Å²	148	48.2 Å²	48.2	64%	0.643	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	137.1	176.9	-174.4	179.6	179.2	-178.3	0	110.5	A317 S318 S321 I325	A317-K323 WeakPolarHBondContact CA-O 3.25Å; S318-K323 PolarHBondContact N-O 3.47Å; S318-K323 PolarHBondContact O-N 2.88Å; S321-K323 PolarHBondContact O-N 2.77Å; S321-K323 VanDerWaalsContact O-N 3.11Å; S321-K323 WeakPolarHBondContact OG-CB 3.35Å; K323-I325 VanDerWaalsContact C-N 3.27Å; K323-I325 PolarHBondContact O-N 2.86Å
324	G	97	Very high	96.5	Very high	7 Å²	7	48.7 Å²	48.7	7%	0.072	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-12.2	178.5	0	0	0	0	0	114.8	L316 E327 I328	L316-G324 WeakPolarHBondContact O-CA 2.94Å; G324-E327 WeakPolarHBondContact CA-OE2 3.47Å; G324-E327 PolarHBondContact N-OE2 3.19Å; G324-E327 PolarHBondContact O-N 2.86Å; G324-I328 WeakPolarHBondContact O-CB 3.43Å; G324-I328 VanDerWaalsContact O-CG1 3.27Å; G324-I328 WeakPolarHBondContact O-CG1 3.49Å; G324-I328 PolarHBondContact O-N 3.24Å
325	I	97.5	Very high	96.6	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-64.1	-46.8	-178.2	-64.4	-62.5	0	0	0	112.2	F148 F152 Y155 K322 K323 E327 I328 W329	F148-I325 HydrophobicContact CD2-CD1 4.01Å; F148-I325 HydrophobicContact CE2-CD1 3.65Å; F152-I325 HydrophobicContact CD2-CG2 4.07Å; Y155-I325 HydrophobicContact CD1-CG2 3.72Å; Y155-I325 HydrophobicContact CD2-CG2 4.09Å; Y155-I325 HydrophobicContact CE1-CG2 4.39Å; Y155-I325 HydrophobicContact CG-CG2 3.54Å; K322-I325 WeakPolarHBondContact O-CB 3.23Å; K322-I325 WeakPolarHBondContact O-CG1 3.44Å; K323-I325 VanDerWaalsContact C-N 3.27Å; K323-I325 PolarHBondContact O-N 2.86Å; I325-E327 VanDerWaalsContact C-N 3.34Å; I325-E327 PolarHBondContact O-N 3.01Å; I325-I328 PolarHBondContact O-N 2.82Å; I325-W329 PolarHBondContact O-N 3.08Å
326	P	97.8	Very high	96.6	Very high	56 Å²	56	49.4 Å²	49.4	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-60.2	-40.6	174.3	-24.9	35.7	0	0	0	113.4	Y155 I328 W329 K330	Y155-P326 HydrophobicContact CE2-CB 4.45Å; Y155-P326 HydrophobicContact CE2-CG 3.92Å; Y155-P326 WeakPolarHBondContact OH-CB 3.17Å; P326-I328 VanDerWaalsContact C-N 3.35Å; P326-W329 PolarHBondContact O-N 2.91Å; P326-K330 PolarHBondContact O-N 3.16Å
327	E	98.1	Very high	96.6	Very high	107 Å²	107	53.9 Å²	53.9	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-66.4	-38	179.8	-64.3	84.9	167.2	0	0	111.7	G324 I325 K330 A331	G324-E327 WeakPolarHBondContact CA-OE2 3.47Å; G324-E327 PolarHBondContact N-OE2 3.19Å; G324-E327 PolarHBondContact O-N 2.86Å; I325-E327 VanDerWaalsContact C-N 3.34Å; I325-E327 PolarHBondContact O-N 3.01Å; E327-K330 PolarHBondContact O-N 3.34Å; E327-A331 PolarHBondContact O-N 3.42Å
328	I	98.3	Very high	96.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-47.9	172.4	-74.5	166.1	0	0	0	110.7	F148 F152 L275 V277 L315 A317 G324 I325 P326 K330 A331 M332	F148-I328 HydrophobicContact CE2-CD1 3.76Å; F148-I328 HydrophobicContact CZ-CD1 4.13Å; F148-I328 HydrophobicContact CZ-CG2 4.21Å; F152-I328 HydrophobicContact CE2-CG2 4.06Å; L275-I328 HydrophobicContact CD2-CG2 4Å; V277-I328 HydrophobicContact CB-CD1 4.29Å; V277-I328 HydrophobicContact CG1-CD1 3.57Å; V277-I328 HydrophobicContact CG2-CD1 3.67Å; V277-I328 HydrophobicContact CG2-CG1 4Å; L315-I328 HydrophobicContact CB-CG1 4.18Å; L315-I328 HydrophobicContact CD1-CB 4.45Å; L315-I328 HydrophobicContact CD1-CG1 3.78Å; A317-I328 HydrophobicContact CB-CD1 3.57Å; G324-I328 WeakPolarHBondContact O-CB 3.43Å; G324-I328 VanDerWaalsContact O-CG1 3.27Å; G324-I328 WeakPolarHBondContact O-CG1 3.49Å; G324-I328 PolarHBondContact O-N 3.24Å; I325-I328 PolarHBondContact O-N 2.82Å; P326-I328 VanDerWaalsContact C-N 3.35Å; I328-K330 VanDerWaalsContact C-N 3.26Å; I328-K330 PolarHBondContact O-N 3.2Å; I328-A331 PolarHBondContact O-N 2.92Å; I328-M332 HydrophobicContact CG2-CG 4.24Å; I328-M332 HydrophobicContact CG2-SD 3.65Å; I328-M332 WeakPolarHBondContact O-CB 3.29Å; I328-M332 WeakPolarHBondContact O-CG 3.38Å; I328-M332 PolarHBondContact O-N 3.23Å
329	W	98.2	Very high	96.7	Very high	41 Å²	41	55 Å²	55	16%	0.155	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-39.4	177.1	172.9	-116.6	0	0	0	112.1	F152 Y155 L156 I160 I228 I325 P326 M332 S333	F152-W329 HydrophobicContact CE2-CB 4.13Å; F152-W329 AromaticContact CZ-CE3 4Å; F152-W329 HydrophobicContact CZ-CE3 4Å; Y155-W329 HydrophobicContact CE1-CB 3.87Å; Y155-W329 HydrophobicContact CE1-CG 4.12Å; L156-W329 HydrophobicContact CD2-CD2 3.79Å; L156-W329 HydrophobicContact CD2-CE3 3.56Å; L156-W329 HydrophobicContact CD2-CG 4.45Å; L156-W329 HydrophobicContact CD2-CH2 4.17Å; L156-W329 HydrophobicContact CD2-CZ2 4.4Å; L156-W329 HydrophobicContact CD2-CZ3 3.76Å; I160-W329 HydrophobicContact CG2-CZ2 4.03Å; I228-W329 HydrophobicContact CD1-CZ3 4.21Å; I325-W329 PolarHBondContact O-N 3.08Å; P326-W329 PolarHBondContact O-N 2.91Å; W329-M332 HydrophobicContact CE3-CB 4.42Å; W329-M332 PolarHBondContact O-N 3.5Å; W329-S333 VanDerWaalsContact CE2-OG 3.31Å; W329-S333 WeakPolarHBondContact CZ2-OG 3.22Å; W329-S333 WeakPolarHBondContact O-CB 3.49Å; W329-S333 PolarHBondContact O-N 2.97Å; W329-S333 PolarHBondContact O-OG 3.06Å
330	K	98.1	Very high	96.9	Very high	127 Å²	127	55.5 Å²	55.5	55%	0.552	29%	0.285	S	S	*	.	H	α-helix	trans	-60.4	-51.3	173.9	-178.7	-179.6	-178.2	-62	0	111.2	P326 E327 I328 M332 S333 D334	P326-K330 PolarHBondContact O-N 3.16Å; E327-K330 PolarHBondContact O-N 3.34Å; I328-K330 VanDerWaalsContact C-N 3.26Å; I328-K330 PolarHBondContact O-N 3.2Å; K330-M332 VanDerWaalsContact C-N 3.28Å; K330-M332 PolarHBondContact O-N 3.06Å; K330-S333 WeakPolarHBondContact O-CB 3.19Å; K330-S333 PolarHBondContact O-N 3.21Å; K330-S333 VanDerWaalsContact O-N 3.07Å; K330-D334 IonicContact NZ-OD1 2.82Å; K330-D334 IonicContact NZ-OD2 3.26Å; K330-D334 PolarHBondContact NZ-OD2 3.29Å; K330-D334 WeakPolarHBondContact O-CB 3.24Å; K330-D334 PolarHBondContact O-N 3.12Å
331	A	98.1	Very high	97.1	Very high	11 Å²	11	54.2 Å²	54.2	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-38.4	178.8	0	0	0	0	0	112.7	L275 W310 L315 E327 I328 F335	L275-A331 HydrophobicContact CD1-CB 4.48Å; W310-A331 VanDerWaalsContact CH2-O 3.27Å; W310-A331 WeakPolarHBondContact CH2-O 3.36Å; L315-A331 HydrophobicContact CD1-CB 3.85Å; E327-A331 PolarHBondContact O-N 3.42Å; I328-A331 PolarHBondContact O-N 2.92Å; A331-F335 WeakPolarHBondContact O-CB 3.32Å; A331-F335 PolarHBondContact O-N 2.71Å
332	M	98.2	Very high	97.3	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-35.6	175.4	-69.4	176	64.8	0	0	112.7	F133 V135 F152 I228 M249 L275 I328 W329 K330 R336	F133-M332 HydrophobicContact CE1-CB 4.07Å; F133-M332 HydrophobicContact CE1-CE 3.91Å; V135-M332 HydrophobicContact CB-CE 4.13Å; V135-M332 HydrophobicContact CG1-CE 3.64Å; V135-M332 HydrophobicContact CG2-CE 3.55Å; F152-M332 HydrophobicContact CE1-CE 3.95Å; F152-M332 HydrophobicContact CE1-SD 4.03Å; F152-M332 HydrophobicContact CE2-SD 4Å; F152-M332 HydrophobicContact CZ-CE 3.75Å; F152-M332 HydrophobicContact CZ-SD 3.37Å; F152-M332 WeakPolarHBondContact CZ-SD 3.44Å; I228-M332 HydrophobicContact CD1-CE 4.42Å; M249-M332 HydrophobicContact CE-CG 4.09Å; M249-M332 HydrophobicContact SD-CB 4.05Å; M249-M332 HydrophobicContact SD-CG 3.71Å; L275-M332 HydrophobicContact CD2-CG 3.95Å; I328-M332 HydrophobicContact CG2-CG 4.24Å; I328-M332 HydrophobicContact CG2-SD 3.65Å; I328-M332 WeakPolarHBondContact O-CB 3.29Å; I328-M332 WeakPolarHBondContact O-CG 3.38Å; I328-M332 PolarHBondContact O-N 3.23Å; W329-M332 HydrophobicContact CE3-CB 4.42Å; W329-M332 PolarHBondContact O-N 3.5Å; K330-M332 VanDerWaalsContact C-N 3.28Å; K330-M332 PolarHBondContact O-N 3.06Å; M332-R336 PolarHBondContact O-N 3.36Å; M332-R336 VanDerWaalsContact O-N 3.13Å
333	S	97.6	Very high	97.4	Very high	25 Å²	25	47.9 Å²	47.9	18%	0.175	26%	0.264	C	S	.	.	H	α-helix	trans	-70.4	-45.7	175.4	-56.9	0	0	0	0	110.8	W329 K330 F335 R336 E337	W329-S333 VanDerWaalsContact CE2-OG 3.31Å; W329-S333 WeakPolarHBondContact CZ2-OG 3.22Å; W329-S333 WeakPolarHBondContact O-CB 3.49Å; W329-S333 PolarHBondContact O-N 2.97Å; W329-S333 PolarHBondContact O-OG 3.06Å; K330-S333 WeakPolarHBondContact O-CB 3.19Å; K330-S333 PolarHBondContact O-N 3.21Å; K330-S333 VanDerWaalsContact O-N 3.07Å; S333-F335 VanDerWaalsContact C-N 3.3Å; S333-F335 PolarHBondContact O-N 2.84Å; S333-R336 PolarHBondContact O-N 3.05Å; S333-R336 VanDerWaalsContact O-N 3.14Å; S333-E337 WeakPolarHBondContact O-CG 3.35Å; S333-E337 PolarHBondContact O-N 2.98Å
334	D	98	Very high	97.4	Very high	59 Å²	59	42.4 Å²	42.4	32%	0.316	24%	0.241	S	C	.	.	H	α-helix	trans	-57.6	-42.4	175.1	-64.5	-13	0	0	0	110.5	W310 K330 E337 A338	W310-D334 HydrophobicContact CH2-CB 3.97Å; W310-D334 HydrophobicContact CZ3-CB 4.01Å; K330-D334 IonicContact NZ-OD1 2.82Å; K330-D334 IonicContact NZ-OD2 3.26Å; K330-D334 PolarHBondContact NZ-OD2 3.29Å; K330-D334 WeakPolarHBondContact O-CB 3.24Å; K330-D334 PolarHBondContact O-N 3.12Å; D334-E337 PolarHBondContact O-N 2.99Å; D334-A338 WeakPolarHBondContact O-CB 3.45Å; D334-A338 PolarHBondContact O-N 2.84Å
335	F	97.9	Very high	97.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-52	173.6	171.5	-90.5	0	0	0	111.7	F133 M249 D274 F307 W310 A331 S333 E337 A338 L339	F133-F335 HydrophobicContact CE2-CD1 4.13Å; F133-F335 HydrophobicContact CE2-CE1 4.29Å; F133-F335 HydrophobicContact CZ-CD1 4.09Å; M249-F335 HydrophobicContact CB-CD1 3.87Å; M249-F335 HydrophobicContact CB-CE1 3.5Å; M249-F335 HydrophobicContact CB-CZ 4.01Å; M249-F335 HydrophobicContact CE-CB 4.02Å; M249-F335 HydrophobicContact CE-CD2 4.26Å; M249-F335 HydrophobicContact CE-CG 4.01Å; M249-F335 HydrophobicContact CG-CD1 3.8Å; M249-F335 HydrophobicContact CG-CD2 4.35Å; M249-F335 HydrophobicContact CG-CE1 3.75Å; M249-F335 HydrophobicContact CG-CE2 4.31Å; M249-F335 HydrophobicContact CG-CG 4.12Å; M249-F335 HydrophobicContact CG-CZ 4Å; M249-F335 HydrophobicContact SD-CB 4.17Å; M249-F335 HydrophobicContact SD-CD1 3.84Å; M249-F335 HydrophobicContact SD-CE1 4.4Å; M249-F335 HydrophobicContact SD-CG 3.94Å; D274-F335 HydrophobicContact CB-CD2 4.05Å; D274-F335 HydrophobicContact CB-CE2 3.61Å; D274-F335 HydrophobicContact CB-CZ 4.27Å; F307-F335 AromaticContact CD2-CE2 3.87Å; F307-F335 HydrophobicContact CD2-CE2 3.87Å; F307-F335 HydrophobicContact CD2-CZ 4.08Å; F307-F335 AromaticContact CE2-CE2 3.91Å; F307-F335 HydrophobicContact CE2-CE2 3.91Å; F307-F335 AromaticContact CE2-CZ 3.68Å; F307-F335 HydrophobicContact CE2-CZ 3.68Å; F307-F335 HydrophobicContact CZ-CZ 4.48Å; W310-F335 HydrophobicContact CB-CD2 4.17Å; W310-F335 HydrophobicContact CB-CE2 4.34Å; W310-F335 AromaticContact CD1-CD2 3.5Å; W310-F335 AromaticContact CD1-CE2 3.84Å; W310-F335 HydrophobicContact CD2-CB 4.1Å; W310-F335 AromaticContact CD2-CD2 3.58Å; W310-F335 HydrophobicContact CD2-CD2 3.58Å; W310-F335 HydrophobicContact CD2-CG 4.31Å; W310-F335 AromaticContact CE2-CD2 3.63Å; W310-F335 HydrophobicContact CE3-CB 4.12Å; W310-F335 HydrophobicContact CE3-CD2 4.28Å; W310-F335 AromaticContact CG-CD2 3.49Å; W310-F335 HydrophobicContact CG-CD2 3.49Å; W310-F335 VanDerWaalsContact CG-CD2 3.49Å; W310-F335 AromaticContact CG-CE2 3.98Å; W310-F335 HydrophobicContact CG-CE2 3.98Å; W310-F335 HydrophobicContact CH2-CB 3.8Å; W310-F335 HydrophobicContact CZ2-CB 3.77Å; W310-F335 HydrophobicContact CZ2-CD2 4.33Å; W310-F335 HydrophobicContact CZ3-CB 3.99Å; W310-F335 VanDerWaalsContact CZ3-N 3.27Å; W310-F335 AromaticContact NE1-CD2 3.57Å; A331-F335 WeakPolarHBondContact O-CB 3.32Å; A331-F335 PolarHBondContact O-N 2.71Å; S333-F335 VanDerWaalsContact C-N 3.3Å; S333-F335 PolarHBondContact O-N 2.84Å; F335-E337 VanDerWaalsContact C-N 3.3Å; F335-E337 PolarHBondContact O-N 2.57Å; F335-A338 PolarHBondContact O-N 2.78Å; F335-L339 HydrophobicContact CD2-CD1 3.89Å; F335-L339 HydrophobicContact CE1-CD1 4.4Å; F335-L339 HydrophobicContact CE1-CD2 3.64Å; F335-L339 HydrophobicContact CE2-CD1 3.67Å; F335-L339 HydrophobicContact CE2-CD2 3.86Å; F335-L339 HydrophobicContact CE2-CG 4.42Å; F335-L339 HydrophobicContact CG-CD1 4.37Å; F335-L339 HydrophobicContact CZ-CD1 3.96Å; F335-L339 HydrophobicContact CZ-CD2 3.27Å; F335-L339 HydrophobicContact CZ-CG 4.23Å; F335-L339 WeakPolarHBondContact O-CD1 3.47Å; F335-L339 PolarHBondContact O-N 2.9Å
336	R	96.9	Very high	97.2	Very high	56 Å²	56	43.7 Å²	43.7	21%	0.211	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-42.3	-178.4	177.8	-179.7	169.7	170.7	1.4	111.1	S129 L131 F133 M332 S333 T340	S129-R336 PolarHBondContact O-NH2 2.79Å; L131-R336 PolarHBondContact O-NH2 2.97Å; F133-R336 HydrophobicContact CD2-CG 4.48Å; F133-R336 HydrophobicContact CE2-CB 4.24Å; F133-R336 HydrophobicContact CZ-CB 4.25Å; M332-R336 PolarHBondContact O-N 3.36Å; M332-R336 VanDerWaalsContact O-N 3.13Å; S333-R336 PolarHBondContact O-N 3.05Å; S333-R336 VanDerWaalsContact O-N 3.14Å; R336-T340 WeakPolarHBondContact O-CB 3.04Å; R336-T340 PolarHBondContact O-N 2.88Å; R336-T340 PolarHBondContact O-OG1 3.4Å
337	E	97.1	Very high	97.1	Very high	134 Å²	134	46.2 Å²	46.2	63%	0.626	26%	0.258	S	S	*	.	H	α-helix	trans	-64.1	-46.8	177.6	-73.3	-179.4	-174	0	0	111.7	S333 D334 F335 L339 T340 A341	S333-E337 WeakPolarHBondContact O-CG 3.35Å; S333-E337 PolarHBondContact O-N 2.98Å; D334-E337 PolarHBondContact O-N 2.99Å; F335-E337 VanDerWaalsContact C-N 3.3Å; F335-E337 PolarHBondContact O-N 2.57Å; E337-L339 PolarHBondContact O-N 2.85Å; E337-T340 PolarHBondContact O-N 2.9Å; E337-A341 WeakPolarHBondContact O-CB 3.35Å; E337-A341 PolarHBondContact O-N 3.36Å
338	A	97.6	Very high	96.9	Very high	27 Å²	27	42 Å²	42	22%	0.223	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-48.9	179.5	0	0	0	0	0	112.5	W310 D334 F335 T340 A341 S342	W310-A338 HydrophobicContact CE3-CB 4.19Å; D334-A338 WeakPolarHBondContact O-CB 3.45Å; D334-A338 PolarHBondContact O-N 2.84Å; F335-A338 PolarHBondContact O-N 2.78Å; A338-T340 VanDerWaalsContact C-N 3.33Å; A338-T340 PolarHBondContact O-N 3.26Å; A338-A341 PolarHBondContact O-N 3.34Å; A338-S342 PolarHBondContact O-N 3.32Å; A338-S342 PolarHBondContact O-OG 2.78Å
339	L	97.2	Very high	96.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-70.7	-29.3	178.6	-89.4	68.7	0	0	0	113.1	F307 W310 F335 E337 S342 G343 E344 L345	F307-L339 HydrophobicContact CB-CD1 4.23Å; F307-L339 HydrophobicContact CD1-CD2 3.91Å; F307-L339 HydrophobicContact CD1-CG 4.28Å; F307-L339 HydrophobicContact CD2-CD1 4.22Å; F307-L339 HydrophobicContact CD2-CD2 3.82Å; F307-L339 HydrophobicContact CD2-CG 4.37Å; F307-L339 HydrophobicContact CE1-CD2 3.84Å; F307-L339 HydrophobicContact CE2-CD2 3.72Å; F307-L339 HydrophobicContact CG-CD1 4.18Å; F307-L339 HydrophobicContact CG-CD2 3.89Å; F307-L339 HydrophobicContact CG-CG 4.13Å; F307-L339 HydrophobicContact CZ-CD2 3.74Å; W310-L339 HydrophobicContact CB-CD1 3.88Å; F335-L339 HydrophobicContact CD2-CD1 3.89Å; F335-L339 HydrophobicContact CE1-CD1 4.4Å; F335-L339 HydrophobicContact CE1-CD2 3.64Å; F335-L339 HydrophobicContact CE2-CD1 3.67Å; F335-L339 HydrophobicContact CE2-CD2 3.86Å; F335-L339 HydrophobicContact CE2-CG 4.42Å; F335-L339 HydrophobicContact CG-CD1 4.37Å; F335-L339 HydrophobicContact CZ-CD1 3.96Å; F335-L339 HydrophobicContact CZ-CD2 3.27Å; F335-L339 HydrophobicContact CZ-CG 4.23Å; F335-L339 WeakPolarHBondContact O-CD1 3.47Å; F335-L339 PolarHBondContact O-N 2.9Å; E337-L339 PolarHBondContact O-N 2.85Å; L339-S342 WeakPolarHBondContact CA-OG 3.32Å; L339-S342 PolarHBondContact O-OG 3.14Å; L339-G343 PolarHBondContact O-N 2.98Å; L339-E344 HydrophobicContact CG-CB 4.25Å; L339-E344 PolarHBondContact O-N 3.33Å; L339-L345 HydrophobicContact CB-CB 4.06Å; L339-L345 PolarHBondContact O-N 3.05Å; L339-L345 VanDerWaalsContact O-N 3.14Å
340	T	96.6	Very high	96.4	Very high	32 Å²	32	45 Å²	45	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-67.2	-45.2	173.5	-65.7	0	0	0	0	110.5	P128 R336 E337 A338 G343 L345	P128-T340 HydrophobicContact CB-CG2 4.01Å; R336-T340 WeakPolarHBondContact O-CB 3.04Å; R336-T340 PolarHBondContact O-N 2.88Å; R336-T340 PolarHBondContact O-OG1 3.4Å; E337-T340 PolarHBondContact O-N 2.9Å; A338-T340 VanDerWaalsContact C-N 3.33Å; A338-T340 PolarHBondContact O-N 3.26Å; T340-G343 PolarHBondContact O-N 2.84Å; T340-L345 WeakPolarHBondContact OG1-CD2 3.14Å
341	A	96.4	Very high	96.2	Very high	93 Å²	93	45.4 Å²	45.4	77%	0.769	26%	0.258	S	S	*	.	H	α-helix	trans	-67.7	-35	179.7	0	0	0	0	0	112.6	E337 A338	E337-A341 WeakPolarHBondContact O-CB 3.35Å; E337-A341 PolarHBondContact O-N 3.36Å; A338-A341 PolarHBondContact O-N 3.34Å
342	S	96.9	Very high	95.8	Very high	50 Å²	50	45.3 Å²	45.3	35%	0.35	26%	0.256	S	S	.	.	H	α-helix	trans	-79.2	-17.6	178.5	71.8	0	0	0	0	114.3	S309 A338 L339 E344	S309-S342 WeakPolarHBondContact OG-CB 3.44Å; S309-S342 PolarHBondContact OG-OG 3.01Å; A338-S342 PolarHBondContact O-N 3.32Å; A338-S342 PolarHBondContact O-OG 2.78Å; L339-S342 WeakPolarHBondContact CA-OG 3.32Å; L339-S342 PolarHBondContact O-OG 3.14Å; S342-E344 VanDerWaalsContact C-N 3.25Å; S342-E344 PolarHBondContact O-N 2.85Å; S342-E344 WeakPolarHBondContact OG-CB 3.31Å; S342-E344 WeakPolarHBondContact OG-CG 3.15Å; S342-E344 PolarHBondContact OG-N 3.29Å; S342-E344 PolarHBondContact OG-OE2 3.05Å
343	G	96	Very high	95.4	Very high	28 Å²	28	46.5 Å²	46.5	29%	0.289	26%	0.262	S	S	.	.	S	Bend	trans	84.5	-9.7	-172.6	0	0	0	0	0	114.3	L339 T340 L345 V346 D347	L339-G343 PolarHBondContact O-N 2.98Å; T340-G343 PolarHBondContact O-N 2.84Å; G343-L345 PolarHBondContact O-N 3.26Å; G343-L345 VanDerWaalsContact O-N 3.16Å; G343-V346 PolarHBondContact O-N 2.87Å; G343-V346 VanDerWaalsContact O-N 3.1Å; G343-D347 PolarHBondContact O-N 3.04Å
344	E	96.6	Very high	95	Very high	34 Å²	34	47 Å²	47	16%	0.159	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-30	-178.3	-72.3	174.9	111.1	0	0	112.5	F307 K308 S309 L339 S342 V346 D347 Q348	F307-E344 WeakPolarHBondContact CA-OE1 3.43Å; F307-E344 HydrophobicContact CD1-CB 4.06Å; K308-E344 PolarHBondContact N-OE1 3.06Å; S309-E344 WeakPolarHBondContact CB-OE2 3.42Å; S309-E344 PolarHBondContact N-OE2 3.47Å; S309-E344 PolarHBondContact OG-OE2 2.9Å; L339-E344 HydrophobicContact CG-CB 4.25Å; L339-E344 PolarHBondContact O-N 3.33Å; S342-E344 VanDerWaalsContact C-N 3.25Å; S342-E344 PolarHBondContact O-N 2.85Å; S342-E344 WeakPolarHBondContact OG-CB 3.31Å; S342-E344 WeakPolarHBondContact OG-CG 3.15Å; S342-E344 PolarHBondContact OG-N 3.29Å; S342-E344 PolarHBondContact OG-OE2 3.05Å; E344-V346 PolarHBondContact O-N 3.47Å; E344-D347 PolarHBondContact O-N 3.37Å; E344-Q348 VanDerWaalsContact O-CB 3.23Å; E344-Q348 WeakPolarHBondContact O-CB 3.44Å; E344-Q348 PolarHBondContact O-N 3.33Å
345	L	95.4	Very high	94.6	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-45.6	176.1	-176.5	61	0	0	0	112.5	L131 D248 L339 T340 G343 R349	L131-L345 HydrophobicContact CD1-CD2 4.08Å; L131-L345 HydrophobicContact CD1-CG 4.25Å; D248-L345 HydrophobicContact CB-CD1 3.65Å; D248-L345 VanDerWaalsContact CG-CD1 3.44Å; D248-L345 WeakPolarHBondContact OD1-CD1 3.5Å; L339-L345 HydrophobicContact CB-CB 4.06Å; L339-L345 PolarHBondContact O-N 3.05Å; L339-L345 VanDerWaalsContact O-N 3.14Å; T340-L345 WeakPolarHBondContact OG1-CD2 3.14Å; G343-L345 PolarHBondContact O-N 3.26Å; G343-L345 VanDerWaalsContact O-N 3.16Å; L345-R349 WeakPolarHBondContact O-CG 3.46Å; L345-R349 PolarHBondContact O-N 3.28Å; L345-R349 VanDerWaalsContact O-N 3.1Å
346	V	94.7	Very high	94	Very high	33 Å²	33	47.1 Å²	47.1	20%	0.2	26%	0.263	C	S	.	.	H	α-helix	trans	-72.8	-40.5	-177.7	177.8	0	0	0	0	110	P128 L131 G343 E344 R349 N350	P128-V346 HydrophobicContact CB-CG2 3.83Å; P128-V346 HydrophobicContact CG-CG2 3.96Å; L131-V346 HydrophobicContact CD1-CG2 4.23Å; G343-V346 PolarHBondContact O-N 2.87Å; G343-V346 VanDerWaalsContact O-N 3.1Å; E344-V346 PolarHBondContact O-N 3.47Å; V346-R349 PolarHBondContact O-N 3.39Å; V346-N350 VanDerWaalsContact O-CG 3.28Å; V346-N350 PolarHBondContact O-N 2.89Å; V346-N350 PolarHBondContact O-ND2 2.72Å
347	D	94.9	Very high	93.6	Very high	109 Å²	109	45.2 Å²	45.2	58%	0.583	26%	0.257	S	S	*	.	H	α-helix	trans	-61.6	-44.7	176.5	-72.6	-16.4	0	0	0	111.6	G343 E344 N350 K351	G343-D347 PolarHBondContact O-N 3.04Å; E344-D347 PolarHBondContact O-N 3.37Å; D347-N350 PolarHBondContact O-N 2.98Å; D347-K351 PolarHBondContact O-N 3.07Å
348	Q	94.1	Very high	93.1	Very high	20 Å²	20	45 Å²	45	9%	0.093	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-50.4	174.5	-176.4	-173.6	6.3	0	0	110.7	A247 D248 R306 F307 E344 N350 K351 Q352	A247-Q348 PolarHBondContact O-NE2 3.05Å; D248-Q348 PolarHBondContact O-NE2 3.23Å; D248-Q348 PolarHBondContact O-OE1 2.83Å; R306-Q348 VanDerWaalsContact NH1-NE2 3.18Å; F307-Q348 HydrophobicContact CE1-CB 4.38Å; F307-Q348 HydrophobicContact CE1-CG 4.42Å; F307-Q348 VanDerWaalsContact CZ-CD 3.49Å; F307-Q348 HydrophobicContact CZ-CG 4.46Å; E344-Q348 VanDerWaalsContact O-CB 3.23Å; E344-Q348 WeakPolarHBondContact O-CB 3.44Å; E344-Q348 PolarHBondContact O-N 3.33Å; Q348-N350 VanDerWaalsContact C-N 3.33Å; Q348-N350 PolarHBondContact O-N 3.24Å; Q348-K351 WeakPolarHBondContact O-CB 3.34Å; Q348-K351 PolarHBondContact O-N 3.08Å; Q348-K351 VanDerWaalsContact O-N 3.17Å; Q348-Q352 HydrophobicContact CG-CG 4.34Å; Q348-Q352 VanDerWaalsContact O-CG 3.24Å; Q348-Q352 WeakPolarHBondContact O-CG 3.39Å; Q348-Q352 PolarHBondContact O-N 3.3Å
349	R	93.6	Very high	92.4	Very high	15 Å²	15	47 Å²	47	6%	0.057	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-39	179.2	-75.7	-172.9	178.9	-144.1	0.9	113.3	I132 E222 D248 L345 V346 K351 Q352 M353	I132-R349 PolarHBondContact O-NH2 3.27Å; E222-R349 IonicContact OE1-CZ 3.24Å; E222-R349 IonicContact OE1-NH1 3.31Å; E222-R349 PolarHBondContact OE1-NH1 3.48Å; E222-R349 IonicContact OE1-NH2 3.26Å; D248-R349 VanDerWaalsContact CG-NH2 3.33Å; D248-R349 IonicContact OD1-CZ 3.82Å; D248-R349 IonicContact OD1-NE 2.79Å; D248-R349 PolarHBondContact OD1-NE 3.24Å; D248-R349 IonicContact OD1-NH2 2.65Å; D248-R349 PolarHBondContact OD1-NH2 3.14Å; D248-R349 VanDerWaalsContact OD1-NH2 3.13Å; D248-R349 IonicContact OD2-CZ 2.59Å; D248-R349 IonicContact OD2-NE 3.97Å; D248-R349 IonicContact OD2-NH2 2.78Å; D248-R349 PolarHBondContact OD2-NH2 2.99Å; L345-R349 WeakPolarHBondContact O-CG 3.46Å; L345-R349 PolarHBondContact O-N 3.28Å; L345-R349 VanDerWaalsContact O-N 3.1Å; V346-R349 PolarHBondContact O-N 3.39Å; R349-K351 VanDerWaalsContact C-N 3.33Å; R349-Q352 PolarHBondContact O-N 3.08Å; R349-M353 WeakPolarHBondContact O-CB 3.41Å; R349-M353 VanDerWaalsContact O-CG 3.25Å; R349-M353 WeakPolarHBondContact O-CG 3.27Å; R349-M353 PolarHBondContact O-N 2.71Å
350	N	92.7	Very high	91.7	Very high	89 Å²	89	49.1 Å²	49.1	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-63.3	-41.1	176.1	-73.3	-29.3	0	0	0	111.7	V346 D347 Q348 T354	V346-N350 VanDerWaalsContact O-CG 3.28Å; V346-N350 PolarHBondContact O-N 2.89Å; V346-N350 PolarHBondContact O-ND2 2.72Å; D347-N350 PolarHBondContact O-N 2.98Å; Q348-N350 VanDerWaalsContact C-N 3.33Å; Q348-N350 PolarHBondContact O-N 3.24Å; N350-T354 PolarHBondContact O-N 3.43Å; N350-T354 VanDerWaalsContact O-N 3.08Å; N350-T354 PolarHBondContact O-OG1 3.4Å
351	K	92.8	Very high	91.2	Very high	135 Å²	135	48.6 Å²	48.6	59%	0.587	26%	0.264	S	S	*	.	H	α-helix	trans	-61.8	-51.5	173.3	176.2	179.5	171.7	115.9	0	110.9	D347 Q348 R349 M353 T354 D355	D347-K351 PolarHBondContact O-N 3.07Å; Q348-K351 WeakPolarHBondContact O-CB 3.34Å; Q348-K351 PolarHBondContact O-N 3.08Å; Q348-K351 VanDerWaalsContact O-N 3.17Å; R349-K351 VanDerWaalsContact C-N 3.33Å; K351-M353 VanDerWaalsContact C-N 3.29Å; K351-M353 PolarHBondContact O-N 2.95Å; K351-T354 WeakPolarHBondContact O-CA 3.05Å; K351-T354 WeakPolarHBondContact O-CB 3.39Å; K351-T354 PolarHBondContact O-N 3.49Å; K351-D355 WeakPolarHBondContact CE-OD2 3.18Å; K351-D355 WeakPolarHBondContact CG-OD2 3.3Å; K351-D355 VanDerWaalsContact O-CG 3.31Å; K351-D355 PolarHBondContact O-N 3.44Å
352	Q	91.3	Very high	90.6	Very high	9 Å²	9	48.6 Å²	48.6	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-56.5	-41.8	179.3	-67.7	175.3	-23.3	0	0	112.5	D245 A247 Q348 R349 D355 W356	D245-Q352 VanDerWaalsContact O-CB 3.31Å; D245-Q352 WeakPolarHBondContact O-CB 3.46Å; D245-Q352 WeakPolarHBondContact O-CG 3.5Å; A247-Q352 PolarHBondContact O-NE2 3.16Å; Q348-Q352 HydrophobicContact CG-CG 4.34Å; Q348-Q352 VanDerWaalsContact O-CG 3.24Å; Q348-Q352 WeakPolarHBondContact O-CG 3.39Å; Q348-Q352 PolarHBondContact O-N 3.3Å; R349-Q352 PolarHBondContact O-N 3.08Å; Q352-D355 PolarHBondContact O-N 3.37Å; Q352-W356 VanDerWaalsContact O-CB 3.28Å; Q352-W356 WeakPolarHBondContact O-CB 3.42Å; Q352-W356 PolarHBondContact O-N 3.39Å
353	M	88.3	Confident	89.8	Confident	27 Å²	27	47.8 Å²	47.8	13%	0.133	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-38.3	176	-71.3	-62.6	-76.3	0	0	112.2	F13 L116 R349 K351 W356 M357	F13-M353 HydrophobicContact CD1-CB 4.06Å; F13-M353 HydrophobicContact CD1-CE 3.43Å; F13-M353 VanDerWaalsContact CD1-CE 3.43Å; F13-M353 WeakPolarHBondContact CD1-O 3.43Å; F13-M353 HydrophobicContact CD1-SD 4.34Å; F13-M353 HydrophobicContact CE1-CE 3.64Å; F13-M353 HydrophobicContact CE1-SD 4.35Å; F13-M353 HydrophobicContact CG-CE 4.2Å; L116-M353 HydrophobicContact CD1-CE 4.46Å; L116-M353 HydrophobicContact CD2-CE 4.03Å; R349-M353 WeakPolarHBondContact O-CB 3.41Å; R349-M353 VanDerWaalsContact O-CG 3.25Å; R349-M353 WeakPolarHBondContact O-CG 3.27Å; R349-M353 PolarHBondContact O-N 2.71Å; K351-M353 VanDerWaalsContact C-N 3.29Å; K351-M353 PolarHBondContact O-N 2.95Å; M353-W356 HydrophobicContact CE-CE3 4.26Å; M353-W356 HydrophobicContact CE-CZ3 4.07Å; M353-W356 HydrophobicContact SD-CE3 3.84Å; M353-W356 HydrophobicContact SD-CZ3 4.08Å; M353-M357 PolarHBondContact O-N 2.88Å; M353-M357 VanDerWaalsContact O-N 3.11Å
354	T	90.5	Very high	89.1	Confident	35 Å²	35	47.5 Å²	47.5	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-68.9	-45	176.8	-56.3	0	0	0	0	111.2	N350 K351 W356 M357 W358	N350-T354 PolarHBondContact O-N 3.43Å; N350-T354 VanDerWaalsContact O-N 3.08Å; N350-T354 PolarHBondContact O-OG1 3.4Å; K351-T354 WeakPolarHBondContact O-CA 3.05Å; K351-T354 WeakPolarHBondContact O-CB 3.39Å; K351-T354 PolarHBondContact O-N 3.49Å; T354-W356 VanDerWaalsContact C-N 3.32Å; T354-W356 PolarHBondContact O-N 3.35Å; T354-M357 WeakPolarHBondContact O-CB 3.44Å; T354-M357 PolarHBondContact O-N 2.9Å; T354-W358 VanDerWaalsContact O-CD1 3.22Å; T354-W358 PolarHBondContact O-N 2.86Å; T354-W358 VanDerWaalsContact O-N 3.07Å
355	D	88	Confident	88.5	Confident	51 Å²	51	49.9 Å²	49.9	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-63.8	-40.3	178	-66.7	-15.1	0	0	0	110.3	K351 Q352 M357 W358 N359	K351-D355 WeakPolarHBondContact CE-OD2 3.18Å; K351-D355 WeakPolarHBondContact CG-OD2 3.3Å; K351-D355 VanDerWaalsContact O-CG 3.31Å; K351-D355 PolarHBondContact O-N 3.44Å; Q352-D355 PolarHBondContact O-N 3.37Å; D355-M357 PolarHBondContact O-N 3.45Å; D355-W358 PolarHBondContact O-N 3.24Å; D355-N359 WeakPolarHBondContact O-CB 3.28Å; D355-N359 PolarHBondContact O-N 2.86Å; D355-N359 PolarHBondContact O-ND2 3.46Å; D355-N359 VanDerWaalsContact O-ND2 3.08Å
356	W	85.9	Confident	88	Confident	11 Å²	11	51.6 Å²	51.6	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-44	174	178.2	27.6	0	0	0	112.4	F13 L112 S212 H215 E216 Q352 M353 T354 W358 N359 H360	F13-W356 HydrophobicContact CD1-CE3 4.48Å; F13-W356 AromaticContact CE1-CD2 3.88Å; F13-W356 HydrophobicContact CE1-CD2 3.88Å; F13-W356 AromaticContact CE1-CE3 3.35Å; F13-W356 HydrophobicContact CE1-CE3 3.35Å; F13-W356 HydrophobicContact CE1-CH2 4.22Å; F13-W356 AromaticContact CE1-CZ3 3.55Å; F13-W356 HydrophobicContact CE1-CZ3 3.55Å; F13-W356 HydrophobicContact CZ-CD2 4.17Å; F13-W356 AromaticContact CZ-CE3 3.84Å; F13-W356 HydrophobicContact CZ-CE3 3.84Å; F13-W356 AromaticContact CZ-CH2 3.89Å; F13-W356 HydrophobicContact CZ-CH2 3.89Å; F13-W356 HydrophobicContact CZ-CZ2 4.24Å; F13-W356 AromaticContact CZ-CZ3 3.69Å; F13-W356 HydrophobicContact CZ-CZ3 3.69Å; L112-W356 HydrophobicContact CD2-CH2 4.13Å; S212-W356 PolarHBondContact OG-NE1 2.97Å; H215-W356 HydrophobicContact CB-CD2 3.65Å; H215-W356 HydrophobicContact CB-CE3 3.92Å; H215-W356 HydrophobicContact CB-CG 4.11Å; H215-W356 HydrophobicContact CB-CH2 4.47Å; H215-W356 HydrophobicContact CB-CZ2 4.2Å; H215-W356 HydrophobicContact CB-CZ3 4.32Å; H215-W356 AromaticContact CG-CD2 3.9Å; H215-W356 AromaticContact CG-CG 3.91Å; E216-W356 HydrophobicContact CG-CH2 3.86Å; E216-W356 HydrophobicContact CG-CZ2 3.38Å; Q352-W356 VanDerWaalsContact O-CB 3.28Å; Q352-W356 WeakPolarHBondContact O-CB 3.42Å; Q352-W356 PolarHBondContact O-N 3.39Å; M353-W356 HydrophobicContact CE-CE3 4.26Å; M353-W356 HydrophobicContact CE-CZ3 4.07Å; M353-W356 HydrophobicContact SD-CE3 3.84Å; M353-W356 HydrophobicContact SD-CZ3 4.08Å; T354-W356 VanDerWaalsContact C-N 3.32Å; T354-W356 PolarHBondContact O-N 3.35Å; W356-W358 PolarHBondContact O-N 2.88Å; W356-N359 PolarHBondContact O-N 3.45Å; W356-H360 PolarHBondContact O-N 3.27Å
357	M	88.1	Confident	87.4	Confident	15 Å²	15	54.5 Å²	54.5	7%	0.074	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-47.4	175.1	-178.2	-159.3	71	0	0	111.6	A10 F13 F14 M353 T354 D355 H360 V361	A10-M357 HydrophobicContact CB-SD 3.92Å; F13-M357 HydrophobicContact CD1-CB 4.43Å; F14-M357 HydrophobicContact CE2-SD 3.98Å; F14-M357 HydrophobicContact CZ-SD 4.15Å; M353-M357 PolarHBondContact O-N 2.88Å; M353-M357 VanDerWaalsContact O-N 3.11Å; T354-M357 WeakPolarHBondContact O-CB 3.44Å; T354-M357 PolarHBondContact O-N 2.9Å; D355-M357 PolarHBondContact O-N 3.45Å; M357-H360 WeakPolarHBondContact O-CB 3.34Å; M357-H360 PolarHBondContact O-N 3.46Å; M357-V361 WeakPolarHBondContact O-CG2 3.34Å; M357-V361 PolarHBondContact O-N 3.49Å
358	W	88.3	Confident	86.9	Confident	130 Å²	130	50.5 Å²	50.5	49%	0.492	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-42.9	178.9	-75	117.2	0	0	0	112.6	T354 D355 W356 H360 V361 D362	T354-W358 VanDerWaalsContact O-CD1 3.22Å; T354-W358 PolarHBondContact O-N 2.86Å; T354-W358 VanDerWaalsContact O-N 3.07Å; D355-W358 PolarHBondContact O-N 3.24Å; W356-W358 PolarHBondContact O-N 2.88Å; W358-H360 PolarHBondContact O-N 2.78Å; W358-V361 HydrophobicContact CE3-CB 4.43Å; W358-V361 WeakPolarHBondContact O-CB 3.17Å; W358-V361 PolarHBondContact O-N 3.22Å; W358-D362 PolarHBondContact O-N 3.26Å
359	N	82.9	Confident	86.6	Confident	68 Å²	68	51.6 Å²	51.6	36%	0.364	26%	0.256	S	S	.	.	H	α-helix	trans	-57.6	-37.3	174.4	-73	-32.7	0	0	0	111.9	D355 W356 D363	D355-N359 WeakPolarHBondContact O-CB 3.28Å; D355-N359 PolarHBondContact O-N 2.86Å; D355-N359 PolarHBondContact O-ND2 3.46Å; D355-N359 VanDerWaalsContact O-ND2 3.08Å; W356-N359 PolarHBondContact O-N 3.45Å; N359-D363 WeakPolarHBondContact O-CB 2.99Å; N359-D363 PolarHBondContact O-N 2.84Å
360	H	82.7	Confident	86.2	Confident	45 Å²	45	59.9 Å²	59.9	21%	0.208	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-43.2	174.6	-174.5	85.8	0	0	0	112	W356 M357 W358 D362 D363 V364	W356-H360 PolarHBondContact O-N 3.27Å; M357-H360 WeakPolarHBondContact O-CB 3.34Å; M357-H360 PolarHBondContact O-N 3.46Å; W358-H360 PolarHBondContact O-N 2.78Å; H360-D362 VanDerWaalsContact C-N 3.32Å; H360-D362 PolarHBondContact O-N 3.13Å; H360-D363 PolarHBondContact O-N 2.7Å; H360-V364 WeakPolarHBondContact O-CG2 3.38Å; H360-V364 PolarHBondContact O-N 2.94Å
361	V	85	Confident	85.7	Confident	21 Å²	21	58.3 Å²	58.3	13%	0.127	28%	0.283	C	S	.	.	H	α-helix	trans	-58.5	-46.6	175.2	171.6	0	0	0	0	110.5	L6 M357 W358 D363 V364 L365	L6-V361 HydrophobicContact CD2-CG1 4.4Å; L6-V361 HydrophobicContact CD2-CG2 3.8Å; M357-V361 WeakPolarHBondContact O-CG2 3.34Å; M357-V361 PolarHBondContact O-N 3.49Å; W358-V361 HydrophobicContact CE3-CB 4.43Å; W358-V361 WeakPolarHBondContact O-CB 3.17Å; W358-V361 PolarHBondContact O-N 3.22Å; V361-D363 PolarHBondContact O-N 3.34Å; V361-V364 PolarHBondContact O-N 3.14Å; V361-L365 HydrophobicContact CG1-CD1 3.77Å; V361-L365 HydrophobicContact CG1-CG 4.2Å; V361-L365 WeakPolarHBondContact O-CB 3.38Å; V361-L365 VanDerWaalsContact O-CG 3.31Å; V361-L365 WeakPolarHBondContact O-CG 3.44Å; V361-L365 PolarHBondContact O-N 3.16Å
362	D	84.8	Confident	85.3	Confident	94 Å²	94	53.2 Å²	53.2	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-61.9	-43.5	179.7	-68.9	-20.1	0	0	0	112	W358 H360 L365 A366	W358-D362 PolarHBondContact O-N 3.26Å; H360-D362 VanDerWaalsContact C-N 3.32Å; H360-D362 PolarHBondContact O-N 3.13Å; D362-L365 PolarHBondContact O-N 3.21Å; D362-A366 VanDerWaalsContact O-CB 3.28Å; D362-A366 WeakPolarHBondContact O-CB 3.45Å; D362-A366 PolarHBondContact O-N 3.41Å
363	D	79.5	Confident	85	Confident	32 Å²	32	55 Å²	55	17%	0.171	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-41.7	176.8	-178	59.8	0	0	0	112	N359 H360 V361 K367	N359-D363 WeakPolarHBondContact O-CB 2.99Å; N359-D363 PolarHBondContact O-N 2.84Å; H360-D363 PolarHBondContact O-N 2.7Å; V361-D363 PolarHBondContact O-N 3.34Å; D363-K367 VanDerWaalsContact O-CG 3.29Å; D363-K367 WeakPolarHBondContact O-CG 3.21Å; D363-K367 PolarHBondContact O-N 2.94Å; D363-K367 WeakPolarHBondContact OD1-CE 3.25Å; D363-K367 IonicContact OD1-NZ 2.7Å; D363-K367 WeakPolarHBondContact OD2-CE 3.41Å; D363-K367 IonicContact OD2-NZ 3.13Å; D363-K367 PolarHBondContact OD2-NZ 3.38Å
364	V	80.1	Confident	85	Confident	23 Å²	23	53.8 Å²	53.8	14%	0.139	27%	0.269	C	S	.	.	H	α-helix	trans	-66.6	-45.2	176.6	171.4	0	0	0	0	111.5	W64 H360 V361 K367 L368	W64-V364 HydrophobicContact CH2-CG1 4.36Å; W64-V364 HydrophobicContact CZ2-CG1 4.13Å; H360-V364 WeakPolarHBondContact O-CG2 3.38Å; H360-V364 PolarHBondContact O-N 2.94Å; V361-V364 PolarHBondContact O-N 3.14Å; V364-K367 PolarHBondContact O-N 2.97Å; V364-L368 HydrophobicContact CG1-CD1 3.93Å; V364-L368 HydrophobicContact CG1-CG 4.47Å; V364-L368 WeakPolarHBondContact O-CB 3.28Å; V364-L368 WeakPolarHBondContact O-CG 3.35Å; V364-L368 PolarHBondContact O-N 2.9Å
365	L	85.5	Confident	84.9	Confident	84 Å²	84	52.4 Å²	52.4	44%	0.44	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-42.2	177.5	-72.4	176.9	0	0	0	111.5	V361 D362 K367 L368 F369	V361-L365 HydrophobicContact CG1-CD1 3.77Å; V361-L365 HydrophobicContact CG1-CG 4.2Å; V361-L365 WeakPolarHBondContact O-CB 3.38Å; V361-L365 VanDerWaalsContact O-CG 3.31Å; V361-L365 WeakPolarHBondContact O-CG 3.44Å; V361-L365 PolarHBondContact O-N 3.16Å; D362-L365 PolarHBondContact O-N 3.21Å; L365-K367 VanDerWaalsContact C-N 3.34Å; L365-K367 PolarHBondContact O-N 3.13Å; L365-L368 HydrophobicContact CD2-CD1 4.4Å; L365-L368 PolarHBondContact O-N 3.33Å; L365-F369 WeakPolarHBondContact O-CB 2.91Å; L365-F369 PolarHBondContact O-N 3.32Å
366	A	85.2	Confident	85	Confident	37 Å²	37	54.9 Å²	54.9	31%	0.306	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-40	175.7	0	0	0	0	0	112.1	D362 R370	D362-A366 VanDerWaalsContact O-CB 3.28Å; D362-A366 WeakPolarHBondContact O-CB 3.45Å; D362-A366 PolarHBondContact O-N 3.41Å; A366-R370 WeakPolarHBondContact O-CB 3.37Å; A366-R370 VanDerWaalsContact O-CG 3.28Å; A366-R370 WeakPolarHBondContact O-CG 3.31Å; A366-R370 PolarHBondContact O-N 3.32Å
367	K	80.6	Confident	85.2	Confident	95 Å²	95	62.6 Å²	62.6	41%	0.413	30%	0.302	S	S	.	.	H	α-helix	trans	-67.1	-44	175.1	-74.2	171.3	-170.8	164.5	0	112.3	D363 V364 L365 F369 R370 S371	D363-K367 VanDerWaalsContact O-CG 3.29Å; D363-K367 WeakPolarHBondContact O-CG 3.21Å; D363-K367 PolarHBondContact O-N 2.94Å; D363-K367 WeakPolarHBondContact OD1-CE 3.25Å; D363-K367 IonicContact OD1-NZ 2.7Å; D363-K367 WeakPolarHBondContact OD2-CE 3.41Å; D363-K367 IonicContact OD2-NZ 3.13Å; D363-K367 PolarHBondContact OD2-NZ 3.38Å; V364-K367 PolarHBondContact O-N 2.97Å; L365-K367 VanDerWaalsContact C-N 3.34Å; L365-K367 PolarHBondContact O-N 3.13Å; K367-F369 VanDerWaalsContact C-N 3.34Å; K367-F369 PolarHBondContact O-N 3.07Å; K367-R370 PolarHBondContact O-N 2.99Å; K367-S371 VanDerWaalsContact O-CB 3.3Å; K367-S371 WeakPolarHBondContact O-CB 3.35Å; K367-S371 PolarHBondContact O-N 2.99Å; K367-S371 PolarHBondContact O-OG 3.06Å
368	L	84.4	Confident	85.3	Confident	24 Å²	24	63.5 Å²	63.5	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-57.1	-48.6	174.4	-82.7	166.7	0	0	0	111.2	Y59 V364 L365 S371 H372	Y59-L368 HydrophobicContact CD1-CD2 3.36Å; Y59-L368 HydrophobicContact CD1-CG 4.2Å; Y59-L368 HydrophobicContact CD2-CD2 3.5Å; Y59-L368 HydrophobicContact CD2-CG 4.31Å; Y59-L368 HydrophobicContact CE1-CD1 4.36Å; Y59-L368 HydrophobicContact CE1-CD2 3.45Å; Y59-L368 VanDerWaalsContact CE1-CD2 3.45Å; Y59-L368 HydrophobicContact CE1-CG 3.75Å; Y59-L368 HydrophobicContact CE2-CD2 3.57Å; Y59-L368 HydrophobicContact CE2-CG 3.85Å; Y59-L368 HydrophobicContact CG-CD2 3.39Å; Y59-L368 HydrophobicContact CG-CG 4.46Å; V364-L368 HydrophobicContact CG1-CD1 3.93Å; V364-L368 HydrophobicContact CG1-CG 4.47Å; V364-L368 WeakPolarHBondContact O-CB 3.28Å; V364-L368 WeakPolarHBondContact O-CG 3.35Å; V364-L368 PolarHBondContact O-N 2.9Å; L365-L368 HydrophobicContact CD2-CD1 4.4Å; L365-L368 PolarHBondContact O-N 3.33Å; L368-S371 PolarHBondContact O-N 3.22Å; L368-S371 PolarHBondContact O-OG 3.27Å; L368-H372 PolarHBondContact O-N 3.1Å; L368-H372 VanDerWaalsContact O-N 3.16Å
369	F	87.7	Confident	85.5	Confident	43 Å²	43	58.3 Å²	58.3	19%	0.189	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-50.3	178.5	179.4	-101.3	0	0	0	112	L365 K367 S371 H372 V375 L400 M401 F404	L365-F369 WeakPolarHBondContact O-CB 2.91Å; L365-F369 PolarHBondContact O-N 3.32Å; K367-F369 VanDerWaalsContact C-N 3.34Å; K367-F369 PolarHBondContact O-N 3.07Å; F369-S371 VanDerWaalsContact C-N 3.27Å; F369-S371 PolarHBondContact O-N 3.35Å; F369-H372 WeakPolarHBondContact O-CB 3.39Å; F369-H372 PolarHBondContact O-N 2.83Å; F369-V375 HydrophobicContact CD1-CG1 4.42Å; F369-V375 HydrophobicContact CD2-CG2 4.12Å; F369-V375 HydrophobicContact CE1-CG1 4Å; F369-V375 HydrophobicContact CE2-CG2 3.77Å; F369-V375 HydrophobicContact CZ-CG1 4.11Å; F369-V375 HydrophobicContact CZ-CG2 4.07Å; F369-L400 HydrophobicContact CE1-CB 4.48Å; F369-L400 HydrophobicContact CE2-CB 4.37Å; F369-L400 HydrophobicContact CZ-CB 3.61Å; F369-M401 HydrophobicContact CD2-SD 3.71Å; F369-M401 HydrophobicContact CE2-CG 4.16Å; F369-M401 HydrophobicContact CE2-SD 3.31Å; F369-M401 WeakPolarHBondContact CE2-SD 3.31Å; F369-M401 HydrophobicContact CZ-CG 4.33Å; F369-M401 HydrophobicContact CZ-SD 3.86Å; F369-F404 HydrophobicContact CD2-CB 3.71Å; F369-F404 AromaticContact CD2-CD1 3.92Å; F369-F404 HydrophobicContact CD2-CD1 3.92Å; F369-F404 AromaticContact CD2-CD2 3.85Å; F369-F404 HydrophobicContact CD2-CD2 3.85Å; F369-F404 HydrophobicContact CD2-CE2 4.46Å; F369-F404 AromaticContact CD2-CG 3.55Å; F369-F404 HydrophobicContact CD2-CG 3.55Å; F369-F404 HydrophobicContact CE2-CB 3.6Å; F369-F404 HydrophobicContact CE2-CD1 4.47Å; F369-F404 AromaticContact CE2-CG 4Å; F369-F404 HydrophobicContact CE2-CG 4Å
370	R	86	Confident	86.1	Confident	189 Å²	189	58.6 Å²	58.6	71%	0.713	30%	0.296	S	S	*	.	H	α-helix	trans	-69.1	-21.1	-178.6	-72.1	178.4	179.8	161.9	1.9	114.1	A366 K367 L376	A366-R370 WeakPolarHBondContact O-CB 3.37Å; A366-R370 VanDerWaalsContact O-CG 3.28Å; A366-R370 WeakPolarHBondContact O-CG 3.31Å; A366-R370 PolarHBondContact O-N 3.32Å; K367-R370 PolarHBondContact O-N 2.99Å; R370-L376 VanDerWaalsContact O-CD2 3.25Å; R370-L376 WeakPolarHBondContact O-CD2 3.38Å; R370-L376 WeakPolarHBondContact O-CG 3.25Å
371	S	82.8	Confident	86.6	Confident	56 Å²	56	62.3 Å²	62.3	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-93.5	-6.6	176.2	58.2	0	0	0	0	113.5	K367 L368 F369	K367-S371 VanDerWaalsContact O-CB 3.3Å; K367-S371 WeakPolarHBondContact O-CB 3.35Å; K367-S371 PolarHBondContact O-N 2.99Å; K367-S371 PolarHBondContact O-OG 3.06Å; L368-S371 PolarHBondContact O-N 3.22Å; L368-S371 PolarHBondContact O-OG 3.27Å; F369-S371 VanDerWaalsContact C-N 3.27Å; F369-S371 PolarHBondContact O-N 3.35Å
372	H	84.6	Confident	87	Confident	28 Å²	28	61.7 Å²	61.7	13%	0.13	31%	0.31	C	S	.	.			trans	-66.8	126.5	-178.2	-175.6	-101.4	0	0	0	111	L368 F369 G374 V375 L376 F404	L368-H372 PolarHBondContact O-N 3.1Å; L368-H372 VanDerWaalsContact O-N 3.16Å; F369-H372 WeakPolarHBondContact O-CB 3.39Å; F369-H372 PolarHBondContact O-N 2.83Å; H372-G374 PolarHBondContact ND1-N 3.43Å; H372-G374 PolarHBondContact O-N 3.26Å; H372-G374 VanDerWaalsContact O-N 3.14Å; H372-V375 HydrophobicContact CB-CB 4.27Å; H372-V375 HydrophobicContact CB-CG2 4.04Å; H372-V375 PolarHBondContact O-N 3.19Å; H372-L376 PolarHBondContact O-N 2.85Å; H372-F404 HydrophobicContact CB-CD2 3.74Å; H372-F404 HydrophobicContact CB-CE2 4.07Å; H372-F404 AromaticContact CG-CD2 3.69Å
373	P	85.3	Confident	87.4	Confident	47 Å²	47	61.2 Å²	61.2	31%	0.305	31%	0.306	S	S	.	.	H	α-helix	trans	-57	-35.4	-175.6	-27.3	34.2	0	0	0	114	V375 R377	P373-V375 VanDerWaalsContact C-N 3.34Å; P373-R377 WeakPolarHBondContact O-CG 3.16Å; P373-R377 PolarHBondContact O-N 3.35Å; P373-R377 VanDerWaalsContact O-N 3.1Å
374	G	86.4	Confident	88.2	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-34.5	177	0	0	0	0	0	113.2	H372	H372-G374 PolarHBondContact ND1-N 3.43Å; H372-G374 PolarHBondContact O-N 3.26Å; H372-G374 VanDerWaalsContact O-N 3.14Å
375	V	89.1	Confident	88.9	Confident	6 Å²	6	65.4 Å²	65.4	4%	0.036	32%	0.323	C	S	.	.	H	α-helix	trans	-75.8	-46.5	177.3	174.7	0	0	0	0	109.5	F369 H372 P373 R377 Q378 A379 L400 F404	F369-V375 HydrophobicContact CD1-CG1 4.42Å; F369-V375 HydrophobicContact CD2-CG2 4.12Å; F369-V375 HydrophobicContact CE1-CG1 4Å; F369-V375 HydrophobicContact CE2-CG2 3.77Å; F369-V375 HydrophobicContact CZ-CG1 4.11Å; F369-V375 HydrophobicContact CZ-CG2 4.07Å; H372-V375 HydrophobicContact CB-CB 4.27Å; H372-V375 HydrophobicContact CB-CG2 4.04Å; H372-V375 PolarHBondContact O-N 3.19Å; P373-V375 VanDerWaalsContact C-N 3.34Å; V375-R377 VanDerWaalsContact C-N 3.26Å; V375-R377 PolarHBondContact O-N 3.26Å; V375-Q378 PolarHBondContact O-N 2.85Å; V375-Q378 VanDerWaalsContact O-N 3.12Å; V375-A379 VanDerWaalsContact O-CB 3.25Å; V375-A379 WeakPolarHBondContact O-CB 3.39Å; V375-A379 PolarHBondContact O-N 3.26Å; V375-L400 HydrophobicContact CG1-CD1 4.41Å; V375-L400 HydrophobicContact CG1-CD2 4.37Å; V375-F404 HydrophobicContact CG2-CB 3.97Å; V375-F404 HydrophobicContact CG2-CD2 4.47Å
376	L	89.2	Confident	89.4	Confident	102 Å²	102	64.2 Å²	64.2	53%	0.534	32%	0.317	S	S	.	.	H	α-helix	trans	-58.7	-35	178.8	-76	172.5	0	0	0	113.4	R370 H372 P380	R370-L376 VanDerWaalsContact O-CD2 3.25Å; R370-L376 WeakPolarHBondContact O-CD2 3.38Å; R370-L376 WeakPolarHBondContact O-CG 3.25Å; H372-L376 PolarHBondContact O-N 2.85Å; L376-P380 VanDerWaalsContact O-CD 3.3Å; L376-P380 WeakPolarHBondContact O-CD 3.3Å
377	R	90.7	Very high	90	Very high	174 Å²	174	69.1 Å²	69.1	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-69.1	-36.7	176.4	-77.6	-170.4	-62.9	-99.6	6.3	113.3	P373 V375	P373-R377 WeakPolarHBondContact O-CG 3.16Å; P373-R377 PolarHBondContact O-N 3.35Å; P373-R377 VanDerWaalsContact O-N 3.1Å; V375-R377 VanDerWaalsContact C-N 3.26Å; V375-R377 PolarHBondContact O-N 3.26Å
378	Q	90.4	Very high	90.7	Very high	33 Å²	33	70.9 Å²	70.9	15%	0.154	34%	0.34	C	S	.	.	H	α-helix	trans	-97.9	-27.8	-170.7	-171	170.1	22.7	0	0	113.6	V375 P380 E381 M382 H399 L400	V375-Q378 PolarHBondContact O-N 2.85Å; V375-Q378 VanDerWaalsContact O-N 3.12Å; Q378-P380 VanDerWaalsContact C-CD 3.45Å; Q378-E381 PolarHBondContact O-N 2.72Å; Q378-M382 VanDerWaalsContact CD-CE 3.4Å; Q378-M382 HydrophobicContact CG-CE 3.68Å; Q378-M382 HydrophobicContact CG-CG 4.37Å; Q378-M382 HydrophobicContact CG-SD 4.27Å; Q378-M382 PolarHBondContact O-N 3.16Å; Q378-H399 PolarHBondContact NE2-CD2 3.35Å; Q378-H399 PolarHBondContact NE2-NE2 3.42Å; Q378-H399 PolarHBondContact OE1-CD2 2.84Å; Q378-L400 HydrophobicContact CB-CD2 3.93Å; Q378-L400 HydrophobicContact CG-CD2 4.05Å
379	A	93.1	Very high	91.2	Very high	21 Å²	21	72.9 Å²	72.9	17%	0.174	37%	0.367	C	S	.	.	H	α-helix	trans	-55.3	-40.6	-177.3	0	0	0	0	0	114.2	V375 E381 M382 I383 L400	V375-A379 VanDerWaalsContact O-CB 3.25Å; V375-A379 WeakPolarHBondContact O-CB 3.39Å; V375-A379 PolarHBondContact O-N 3.26Å; A379-E381 PolarHBondContact O-N 3Å; A379-M382 PolarHBondContact O-N 2.91Å; A379-I383 WeakPolarHBondContact O-CB 3.49Å; A379-I383 WeakPolarHBondContact O-CD1 3.43Å; A379-I383 WeakPolarHBondContact O-CG1 3.28Å; A379-I383 PolarHBondContact O-N 3.4Å; A379-L400 HydrophobicContact CB-CD1 4.25Å; A379-L400 HydrophobicContact CB-CD2 4.41Å
380	P	94.8	Very high	91.6	Very high	75 Å²	75	77.7 Å²	77.7	49%	0.487	39%	0.39	S	S	.	.	H	α-helix	trans	-60.4	-43.7	178.5	-25	35.6	0	0	0	113.5	L376 Q378 I383 E384	L376-P380 VanDerWaalsContact O-CD 3.3Å; L376-P380 WeakPolarHBondContact O-CD 3.3Å; Q378-P380 VanDerWaalsContact C-CD 3.45Å; P380-I383 PolarHBondContact O-N 2.84Å; P380-E384 PolarHBondContact O-N 3.1Å; P380-E384 VanDerWaalsContact O-N 3.16Å
381	E	93.4	Very high	92	Very high	122 Å²	122	70.3 Å²	70.3	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-60.9	-49.7	178.5	-178.6	176.2	-154.9	0	0	110.6	Q378 A379 I383 E384 E385	Q378-E381 PolarHBondContact O-N 2.72Å; A379-E381 PolarHBondContact O-N 3Å; E381-I383 VanDerWaalsContact C-N 3.31Å; E381-I383 PolarHBondContact O-N 3.47Å; E381-E384 PolarHBondContact O-N 3.16Å; E381-E385 PolarHBondContact O-N 3.11Å
382	M	92.5	Very high	92.6	Very high	9 Å²	9	71 Å²	71	4%	0.044	37%	0.368	C	S	.	.	H	α-helix	trans	-63.9	-34.3	177.8	-70.8	-176.2	177.4	0	0	113.7	Q378 A379 E384 E385 I386 A396 H399 L400	Q378-M382 VanDerWaalsContact CD-CE 3.4Å; Q378-M382 HydrophobicContact CG-CE 3.68Å; Q378-M382 HydrophobicContact CG-CG 4.37Å; Q378-M382 HydrophobicContact CG-SD 4.27Å; Q378-M382 PolarHBondContact O-N 3.16Å; A379-M382 PolarHBondContact O-N 2.91Å; M382-E384 VanDerWaalsContact C-N 3.26Å; M382-E384 PolarHBondContact O-N 3.46Å; M382-E385 PolarHBondContact O-N 3.12Å; M382-I386 WeakPolarHBondContact O-CB 3.46Å; M382-I386 WeakPolarHBondContact O-CD1 3.34Å; M382-I386 WeakPolarHBondContact O-CG1 3.42Å; M382-I386 PolarHBondContact O-N 2.68Å; M382-A396 HydrophobicContact CB-CB 4.2Å; M382-A396 HydrophobicContact CG-CB 4.49Å; M382-A396 HydrophobicContact SD-CB 4.05Å; M382-A396 VanDerWaalsContact SD-O 3.4Å; M382-H399 HydrophobicContact CE-CB 3.43Å; M382-H399 VanDerWaalsContact CE-CB 3.43Å; M382-H399 WeakPolarHBondContact CE-CD2 3.31Å; M382-H399 HydrophobicContact SD-CB 4.33Å; M382-L400 HydrophobicContact CE-CD2 4.2Å; M382-L400 HydrophobicContact CE-CG 4.45Å; M382-L400 HydrophobicContact SD-CD1 4.19Å; M382-L400 HydrophobicContact SD-CD2 3.52Å; M382-L400 VanDerWaalsContact SD-CD2 3.52Å; M382-L400 HydrophobicContact SD-CG 3.49Å; M382-L400 WeakPolarHBondContact SD-CG 3.49Å
383	I	94.5	Very high	93.1	Very high	84 Å²	84	73.8 Å²	73.8	43%	0.431	39%	0.388	S	S	.	.	H	α-helix	trans	-62.5	-38.7	175.1	-73.2	163.5	0	0	0	110	A379 P380 E381 K387	A379-I383 WeakPolarHBondContact O-CB 3.49Å; A379-I383 WeakPolarHBondContact O-CD1 3.43Å; A379-I383 WeakPolarHBondContact O-CG1 3.28Å; A379-I383 PolarHBondContact O-N 3.4Å; P380-I383 PolarHBondContact O-N 2.84Å; E381-I383 VanDerWaalsContact C-N 3.31Å; E381-I383 PolarHBondContact O-N 3.47Å; I383-K387 HydrophobicContact CG2-CD 4.46Å; I383-K387 VanDerWaalsContact O-CG 3.31Å; I383-K387 WeakPolarHBondContact O-CG 3.37Å; I383-K387 PolarHBondContact O-N 3.31Å; I383-K387 VanDerWaalsContact O-N 3.1Å
384	E	95.9	Very high	93.6	Very high	83 Å²	83	76.2 Å²	76.2	39%	0.388	40%	0.402	S	S	.	.	H	α-helix	trans	-70	-42.9	174.3	-64.2	-50.9	128.6	0	0	112	P380 E381 M382 I386 K387 H388	P380-E384 PolarHBondContact O-N 3.1Å; P380-E384 VanDerWaalsContact O-N 3.16Å; E381-E384 PolarHBondContact O-N 3.16Å; M382-E384 VanDerWaalsContact C-N 3.26Å; M382-E384 PolarHBondContact O-N 3.46Å; E384-I386 VanDerWaalsContact C-N 3.28Å; E384-I386 PolarHBondContact O-N 3.06Å; E384-K387 WeakPolarHBondContact O-CB 3.4Å; E384-K387 PolarHBondContact O-N 3.28Å; E384-K387 VanDerWaalsContact O-N 3.11Å; E384-K387 IonicContact OE1-NZ 3.55Å; E384-K387 PolarHBondContact OE1-NZ 3.34Å; E384-K387 IonicContact OE2-NZ 2.85Å; E384-H388 PolarHBondContact O-CD2 2.9Å; E384-H388 PolarHBondContact O-N 3.1Å
385	E	95.5	Very high	93.9	Very high	60 Å²	60	80.7 Å²	80.7	28%	0.28	43%	0.425	S	S	.	.	H	α-helix	trans	-57.2	-40.6	174	-67.5	178.5	176.8	0	0	112.1	E381 M382 H388 G389 Q390 V391	E381-E385 PolarHBondContact O-N 3.11Å; M382-E385 PolarHBondContact O-N 3.12Å; E385-H388 CarbonylContact O-C 3.6Å; E385-H388 PolarHBondContact O-N 3.46Å; E385-G389 PolarHBondContact O-N 3.41Å; E385-G389 VanDerWaalsContact O-N 3.12Å; E385-Q390 HydrophobicContact CB-CB 4.2Å; E385-Q390 PolarHBondContact O-N 3.43Å; E385-V391 HydrophobicContact CB-CB 4.43Å; E385-V391 HydrophobicContact CB-CG1 3.64Å
386	I	96.2	Very high	94.2	Very high	59 Å²	59	80.6 Å²	80.6	30%	0.303	43%	0.425	S	S	.	.	H	α-helix	trans	-63	-46.9	174.7	-69.5	164.1	0	0	0	110.6	M382 E384 H388 G389 V391 P393 A396	M382-I386 WeakPolarHBondContact O-CB 3.46Å; M382-I386 WeakPolarHBondContact O-CD1 3.34Å; M382-I386 WeakPolarHBondContact O-CG1 3.42Å; M382-I386 PolarHBondContact O-N 2.68Å; E384-I386 VanDerWaalsContact C-N 3.28Å; E384-I386 PolarHBondContact O-N 3.06Å; I386-H388 PolarHBondContact O-N 3.24Å; I386-G389 PolarHBondContact O-N 2.85Å; I386-V391 HydrophobicContact CG1-CG1 3.72Å; I386-P393 HydrophobicContact CD1-CB 4.48Å; I386-P393 HydrophobicContact CG2-CG 4.08Å; I386-A396 HydrophobicContact CD1-CB 3.77Å; I386-A396 HydrophobicContact CG1-CB 4.15Å
387	K	96.4	Very high	94.4	Very high	139 Å²	139	78 Å²	78	60%	0.604	42%	0.418	S	S	*	.	H	α-helix	trans	-61.4	-33.7	179.3	-74	170.6	-176.2	172.3	0	112.2	I383 E384 G389	I383-K387 HydrophobicContact CG2-CD 4.46Å; I383-K387 VanDerWaalsContact O-CG 3.31Å; I383-K387 WeakPolarHBondContact O-CG 3.37Å; I383-K387 PolarHBondContact O-N 3.31Å; I383-K387 VanDerWaalsContact O-N 3.1Å; E384-K387 WeakPolarHBondContact O-CB 3.4Å; E384-K387 PolarHBondContact O-N 3.28Å; E384-K387 VanDerWaalsContact O-N 3.11Å; E384-K387 IonicContact OE1-NZ 3.55Å; E384-K387 PolarHBondContact OE1-NZ 3.34Å; E384-K387 IonicContact OE2-NZ 2.85Å; K387-G389 VanDerWaalsContact C-N 3.31Å
388	H	96.3	Very high	94.5	Very high	132 Å²	132	74.3 Å²	74.3	61%	0.611	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	0.7	176.2	-68.6	-57.1	0	0	0	114	E384 E385 I386 Q390	E384-H388 PolarHBondContact O-CD2 2.9Å; E384-H388 PolarHBondContact O-N 3.1Å; E385-H388 CarbonylContact O-C 3.6Å; E385-H388 PolarHBondContact O-N 3.46Å; I386-H388 PolarHBondContact O-N 3.24Å; H388-Q390 VanDerWaalsContact C-N 3.25Å; H388-Q390 HydrophobicContact CB-CG 4.06Å; H388-Q390 PolarHBondContact O-N 2.94Å
389	G	94.5	Very high	94.5	Very high	66 Å²	66	77 Å²	77	68%	0.68	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	19.9	179.2	0	0	0	0	0	114.3	E385 I386 K387	E385-G389 PolarHBondContact O-N 3.41Å; E385-G389 VanDerWaalsContact O-N 3.12Å; I386-G389 PolarHBondContact O-N 2.85Å; K387-G389 VanDerWaalsContact C-N 3.31Å
390	Q	95.5	Very high	94.5	Very high	145 Å²	145	77 Å²	77	68%	0.678	42%	0.418	S	S	*	.	S	Bend	trans	-81.5	-30.7	-178.6	-65.6	175.3	-20.6	0	0	112.2	E385 H388	E385-Q390 HydrophobicContact CB-CB 4.2Å; E385-Q390 PolarHBondContact O-N 3.43Å; H388-Q390 VanDerWaalsContact C-N 3.25Å; H388-Q390 HydrophobicContact CB-CG 4.06Å; H388-Q390 PolarHBondContact O-N 2.94Å
391	V	94.5	Very high	94.3	Very high	33 Å²	33	77.2 Å²	77.2	20%	0.2	41%	0.413	C	S	.	.	S	Bend	trans	-135.7	147.9	177.4	73.2	0	0	0	0	110.5	E385 I386 L395 A396	E385-V391 HydrophobicContact CB-CB 4.43Å; E385-V391 HydrophobicContact CB-CG1 3.64Å; I386-V391 HydrophobicContact CG1-CG1 3.72Å; V391-L395 HydrophobicContact CG2-CB 3.69Å; V391-A396 HydrophobicContact CG1-CB 4.04Å; V391-A396 HydrophobicContact CG2-CB 4.44Å
392	T	96	Very high	94.1	Very high	72 Å²	72	76 Å²	76	44%	0.442	40%	0.403	S	S	.	.			trans	-77.7	150.3	173.6	71.8	0	0	0	0	110.4	V394 L395 A396	T392-V394 PolarHBondContact O-N 3.22Å; T392-V394 VanDerWaalsContact O-N 3.16Å; T392-L395 HydrophobicContact CG2-CD1 4.41Å; T392-L395 PolarHBondContact O-N 3.07Å; T392-L395 WeakPolarHBondContact OG1-CB 3.46Å; T392-L395 WeakPolarHBondContact OG1-CG 3.31Å; T392-L395 PolarHBondContact OG1-N 3.49Å; T392-A396 PolarHBondContact O-N 3.03Å
393	P	95.3	Very high	93.9	Very high	85 Å²	85	81.6 Å²	81.6	55%	0.552	42%	0.424	S	S	*	.	H	α-helix	trans	-55.6	-33.1	176.7	-28.1	35.2	0	0	0	114.2	I386 A397	I386-P393 HydrophobicContact CD1-CB 4.48Å; I386-P393 HydrophobicContact CG2-CG 4.08Å; P393-A397 WeakPolarHBondContact O-CB 3.5Å; P393-A397 PolarHBondContact O-N 3.48Å
394	V	95	Very high	93.6	Very high	98 Å²	98	80.5 Å²	80.5	59%	0.594	42%	0.416	S	S	*	.	H	α-helix	trans	-69.6	-47.3	178.8	179	0	0	0	0	110.9	T392 A396 A397 E398	T392-V394 PolarHBondContact O-N 3.22Å; T392-V394 VanDerWaalsContact O-N 3.16Å; V394-A396 PolarHBondContact O-N 3.25Å; V394-A397 PolarHBondContact O-N 3.16Å; V394-E398 WeakPolarHBondContact O-CG 3.49Å; V394-E398 PolarHBondContact O-N 3.38Å
395	L	94.1	Very high	93.1	Very high	96 Å²	96	81.2 Å²	81.2	50%	0.503	42%	0.422	S	S	.	.	H	α-helix	trans	-63.2	-41.8	177.8	-77.1	168.9	0	0	0	112	V391 T392 A397 E398 H399	V391-L395 HydrophobicContact CG2-CB 3.69Å; T392-L395 HydrophobicContact CG2-CD1 4.41Å; T392-L395 PolarHBondContact O-N 3.07Å; T392-L395 WeakPolarHBondContact OG1-CB 3.46Å; T392-L395 WeakPolarHBondContact OG1-CG 3.31Å; T392-L395 PolarHBondContact OG1-N 3.49Å; L395-A397 PolarHBondContact O-N 2.89Å; L395-E398 PolarHBondContact O-N 3.31Å; L395-H399 PolarHBondContact O-N 3.44Å
396	A	93.7	Very high	92.4	Very high	4 Å²	4	85 Å²	85	3%	0.033	43%	0.434	C	S	.	.	H	α-helix	trans	-59.8	-45.9	173.9	0	0	0	0	0	111.5	M382 I386 V391 T392 V394 E398 H399 L400	M382-A396 HydrophobicContact CB-CB 4.2Å; M382-A396 HydrophobicContact CG-CB 4.49Å; M382-A396 HydrophobicContact SD-CB 4.05Å; M382-A396 VanDerWaalsContact SD-O 3.4Å; I386-A396 HydrophobicContact CD1-CB 3.77Å; I386-A396 HydrophobicContact CG1-CB 4.15Å; V391-A396 HydrophobicContact CG1-CB 4.04Å; V391-A396 HydrophobicContact CG2-CB 4.44Å; T392-A396 PolarHBondContact O-N 3.03Å; V394-A396 PolarHBondContact O-N 3.25Å; A396-E398 PolarHBondContact O-N 3.47Å; A396-H399 PolarHBondContact O-N 2.97Å; A396-L400 WeakPolarHBondContact O-CG 3.49Å; A396-L400 PolarHBondContact O-N 3.02Å
397	A	93.5	Very high	91.4	Very high	47 Å²	47	86.7 Å²	86.7	39%	0.388	44%	0.442	S	S	.	.	H	α-helix	trans	-61.1	-43.6	176.6	0	0	0	0	0	112.1	P393 V394 L395 H399 L400 M401	P393-A397 WeakPolarHBondContact O-CB 3.5Å; P393-A397 PolarHBondContact O-N 3.48Å; V394-A397 PolarHBondContact O-N 3.16Å; L395-A397 PolarHBondContact O-N 2.89Å; A397-H399 VanDerWaalsContact C-N 3.32Å; A397-H399 PolarHBondContact O-N 2.95Å; A397-L400 PolarHBondContact O-N 3.32Å; A397-M401 WeakPolarHBondContact O-CB 3.43Å; A397-M401 VanDerWaalsContact O-CG 3.28Å; A397-M401 WeakPolarHBondContact O-CG 3.35Å; A397-M401 PolarHBondContact O-N 2.96Å
398	E	93	Very high	89.6	Confident	98 Å²	98	86.1 Å²	86.1	46%	0.458	45%	0.45	S	S	.	.	H	α-helix	trans	-60.4	-40.6	175.3	-75.2	-177.8	-177.4	0	0	112.3	V394 L395 A396 M401 R402	V394-E398 WeakPolarHBondContact O-CG 3.49Å; V394-E398 PolarHBondContact O-N 3.38Å; L395-E398 PolarHBondContact O-N 3.31Å; A396-E398 PolarHBondContact O-N 3.47Å; E398-M401 WeakPolarHBondContact O-CB 3.14Å; E398-M401 PolarHBondContact O-N 3.11Å; E398-R402 WeakPolarHBondContact O-CG 3.44Å; E398-R402 PolarHBondContact O-N 3.23Å
399	H	91.3	Very high	87.6	Confident	89 Å²	89	86.3 Å²	86.3	41%	0.412	45%	0.451	S	S	.	.	H	α-helix	trans	-65.5	-45.5	176.6	-167	110.4	0	0	0	111.5	Q378 M382 L395 A396 A397 M401 R402 R403	Q378-H399 PolarHBondContact NE2-CD2 3.35Å; Q378-H399 PolarHBondContact NE2-NE2 3.42Å; Q378-H399 PolarHBondContact OE1-CD2 2.84Å; M382-H399 HydrophobicContact CE-CB 3.43Å; M382-H399 VanDerWaalsContact CE-CB 3.43Å; M382-H399 WeakPolarHBondContact CE-CD2 3.31Å; M382-H399 HydrophobicContact SD-CB 4.33Å; L395-H399 PolarHBondContact O-N 3.44Å; A396-H399 PolarHBondContact O-N 2.97Å; A397-H399 VanDerWaalsContact C-N 3.32Å; A397-H399 PolarHBondContact O-N 2.95Å; H399-M401 PolarHBondContact O-N 3.15Å; H399-R402 PolarHBondContact O-N 2.84Å; H399-R403 WeakPolarHBondContact O-CB 3.46Å; H399-R403 PolarHBondContact O-N 3.35Å
400	L	92.4	Very high	84.7	Confident	22 Å²	22	92 Å²	92	12%	0.115	48%	0.481	C	S	.	.	H	α-helix	trans	-60.6	-36.7	173.7	-65	177.4	0	0	0	111.6	F369 V375 Q378 A379 M382 A396 A397 R403 F404	F369-L400 HydrophobicContact CE1-CB 4.48Å; F369-L400 HydrophobicContact CE2-CB 4.37Å; F369-L400 HydrophobicContact CZ-CB 3.61Å; V375-L400 HydrophobicContact CG1-CD1 4.41Å; V375-L400 HydrophobicContact CG1-CD2 4.37Å; Q378-L400 HydrophobicContact CB-CD2 3.93Å; Q378-L400 HydrophobicContact CG-CD2 4.05Å; A379-L400 HydrophobicContact CB-CD1 4.25Å; A379-L400 HydrophobicContact CB-CD2 4.41Å; M382-L400 HydrophobicContact CE-CD2 4.2Å; M382-L400 HydrophobicContact CE-CG 4.45Å; M382-L400 HydrophobicContact SD-CD1 4.19Å; M382-L400 HydrophobicContact SD-CD2 3.52Å; M382-L400 VanDerWaalsContact SD-CD2 3.52Å; M382-L400 HydrophobicContact SD-CG 3.49Å; M382-L400 WeakPolarHBondContact SD-CG 3.49Å; A396-L400 WeakPolarHBondContact O-CG 3.49Å; A396-L400 PolarHBondContact O-N 3.02Å; A397-L400 PolarHBondContact O-N 3.32Å; L400-R403 WeakPolarHBondContact O-CB 3.2Å; L400-R403 PolarHBondContact O-N 2.91Å; L400-F404 WeakPolarHBondContact O-CB 3.49Å; L400-F404 PolarHBondContact O-N 2.95Å
401	M	91.7	Very high	84.2	Confident	79 Å²	79	89.4 Å²	89.4	39%	0.389	47%	0.471	S	S	.	.	H	α-helix	trans	-64.5	-46	174.4	-76.5	-59.5	-58.1	0	0	112.1	F369 A397 E398 H399 R403 F404 L405	F369-M401 HydrophobicContact CD2-SD 3.71Å; F369-M401 HydrophobicContact CE2-CG 4.16Å; F369-M401 HydrophobicContact CE2-SD 3.31Å; F369-M401 WeakPolarHBondContact CE2-SD 3.31Å; F369-M401 HydrophobicContact CZ-CG 4.33Å; F369-M401 HydrophobicContact CZ-SD 3.86Å; A397-M401 WeakPolarHBondContact O-CB 3.43Å; A397-M401 VanDerWaalsContact O-CG 3.28Å; A397-M401 WeakPolarHBondContact O-CG 3.35Å; A397-M401 PolarHBondContact O-N 2.96Å; E398-M401 WeakPolarHBondContact O-CB 3.14Å; E398-M401 PolarHBondContact O-N 3.11Å; H399-M401 PolarHBondContact O-N 3.15Å; M401-R403 VanDerWaalsContact C-N 3.26Å; M401-R403 PolarHBondContact O-N 2.94Å; M401-F404 HydrophobicContact CE-CD1 4.49Å; M401-F404 WeakPolarHBondContact O-CB 3.35Å; M401-F404 PolarHBondContact O-N 3.03Å; M401-L405 HydrophobicContact CE-CD1 4.2Å; M401-L405 HydrophobicContact CE-CG 4.46Å; M401-L405 WeakPolarHBondContact O-CB 3.35Å; M401-L405 WeakPolarHBondContact O-CG 3.43Å; M401-L405 PolarHBondContact O-N 3.12Å
402	R	89.3	Confident	83.6	Confident	96 Å²	96	92.4 Å²	92.4	36%	0.362	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-40.7	173.8	-72.1	169.3	-177.7	-122	13.9	111	E398 H399 L405 R406 I407 E409	E398-R402 WeakPolarHBondContact O-CG 3.44Å; E398-R402 PolarHBondContact O-N 3.23Å; H399-R402 PolarHBondContact O-N 2.84Å; R402-L405 CarbonylContact O-C 3.55Å; R402-L405 PolarHBondContact O-N 3.33Å; R402-R406 WeakPolarHBondContact O-CA 3.5Å; R402-R406 PolarHBondContact O-N 2.86Å; R402-I407 HydrophobicContact CB-CB 4.49Å; R402-I407 PolarHBondContact O-N 2.66Å; R402-E409 IonicContact CZ-OE1 3.33Å; R402-E409 IonicContact NH1-OE1 2.66Å; R402-E409 PolarHBondContact NH1-OE1 3.38Å; R402-E409 IonicContact NH2-OE1 3.73Å
403	R	87.9	Confident	82.9	Confident	126 Å²	126	93.5 Å²	93.5	48%	0.475	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-42.2	175.7	-171	62	169.7	174.1	-3.1	112.5	H399 L400 M401 R406	H399-R403 WeakPolarHBondContact O-CB 3.46Å; H399-R403 PolarHBondContact O-N 3.35Å; L400-R403 WeakPolarHBondContact O-CB 3.2Å; L400-R403 PolarHBondContact O-N 2.91Å; M401-R403 VanDerWaalsContact C-N 3.26Å; M401-R403 PolarHBondContact O-N 2.94Å; R403-R406 PolarHBondContact O-N 3.32Å
404	F	87.2	Confident	82.2	Confident	62 Å²	62	94 Å²	94	27%	0.272	48%	0.484	S	S	.	.	H	α-helix	trans	-64.2	-45	175.3	175.2	-105.9	0	0	0	112	F369 H372 V375 L400 M401 R406	F369-F404 HydrophobicContact CD2-CB 3.71Å; F369-F404 AromaticContact CD2-CD1 3.92Å; F369-F404 HydrophobicContact CD2-CD1 3.92Å; F369-F404 AromaticContact CD2-CD2 3.85Å; F369-F404 HydrophobicContact CD2-CD2 3.85Å; F369-F404 HydrophobicContact CD2-CE2 4.46Å; F369-F404 AromaticContact CD2-CG 3.55Å; F369-F404 HydrophobicContact CD2-CG 3.55Å; F369-F404 HydrophobicContact CE2-CB 3.6Å; F369-F404 HydrophobicContact CE2-CD1 4.47Å; F369-F404 AromaticContact CE2-CG 4Å; F369-F404 HydrophobicContact CE2-CG 4Å; H372-F404 HydrophobicContact CB-CD2 3.74Å; H372-F404 HydrophobicContact CB-CE2 4.07Å; H372-F404 AromaticContact CG-CD2 3.69Å; V375-F404 HydrophobicContact CG2-CB 3.97Å; V375-F404 HydrophobicContact CG2-CD2 4.47Å; L400-F404 WeakPolarHBondContact O-CB 3.49Å; L400-F404 PolarHBondContact O-N 2.95Å; M401-F404 HydrophobicContact CE-CD1 4.49Å; M401-F404 WeakPolarHBondContact O-CB 3.35Å; M401-F404 PolarHBondContact O-N 3.03Å; F404-R406 VanDerWaalsContact C-N 3.26Å; F404-R406 PolarHBondContact O-N 3.3Å
405	L	86.9	Confident	81.4	Confident	97 Å²	97	93.8 Å²	93.8	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-79.8	-5.8	179.6	-63.5	175.5	0	0	0	113.5	M401 R402 I407	M401-L405 HydrophobicContact CE-CD1 4.2Å; M401-L405 HydrophobicContact CE-CG 4.46Å; M401-L405 WeakPolarHBondContact O-CB 3.35Å; M401-L405 WeakPolarHBondContact O-CG 3.43Å; M401-L405 PolarHBondContact O-N 3.12Å; R402-L405 CarbonylContact O-C 3.55Å; R402-L405 PolarHBondContact O-N 3.33Å; L405-I407 HydrophobicContact CB-CD1 3.76Å; L405-I407 HydrophobicContact CB-CG1 3.77Å; L405-I407 HydrophobicContact CD1-CD1 3.79Å; L405-I407 HydrophobicContact CG-CD1 4.44Å; L405-I407 PolarHBondContact O-N 3.39Å
406	R	79.8	Confident	80.6	Confident	139 Å²	139	93.6 Å²	93.6	53%	0.525	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	34.7	-173.2	-56.5	-178.2	178.2	-164.9	-4.7	113.1	N52 R402 R403 F404 V408	N52-R406 VanDerWaalsContact CG-CZ 3.43Å; N52-R406 PolarHBondContact ND2-NH2 2.94Å; N52-R406 PolarHBondContact OD1-NH2 2.93Å; R402-R406 WeakPolarHBondContact O-CA 3.5Å; R402-R406 PolarHBondContact O-N 2.86Å; R403-R406 PolarHBondContact O-N 3.32Å; F404-R406 VanDerWaalsContact C-N 3.26Å; F404-R406 PolarHBondContact O-N 3.3Å; R406-V408 PolarHBondContact O-N 3.19Å; R406-V408 VanDerWaalsContact O-N 3.11Å
407	I	75	Confident	79.7	Confident	95 Å²	95	100 Å²	100	49%	0.487	51%	0.507	S	S	.	.			trans	-77	101	172.9	-61	169.9	0	0	0	106.2	R402 L405	R402-I407 HydrophobicContact CB-CB 4.49Å; R402-I407 PolarHBondContact O-N 2.66Å; L405-I407 HydrophobicContact CB-CD1 3.76Å; L405-I407 HydrophobicContact CB-CG1 3.77Å; L405-I407 HydrophobicContact CD1-CD1 3.79Å; L405-I407 HydrophobicContact CG-CD1 4.44Å; L405-I407 PolarHBondContact O-N 3.39Å
408	V	58.7	Low	78.6	Confident	127 Å²	127	104.1 Å²	104.1	77%	0.77	52%	0.517	S	S	*	.			trans	-74.8	126.2	172.4	-174.1	0	0	0	0	107.2	R406 S410	R406-V408 PolarHBondContact O-N 3.19Å; R406-V408 VanDerWaalsContact O-N 3.11Å; V408-S410 PolarHBondContact O-N 3.21Å
409	E	53.5	Low	77.4	Confident	136 Å²	136	104.6 Å²	104.6	64%	0.636	52%	0.522	S	S	*	.			trans	-65.6	114.7	164.5	-72.6	-175.5	154	0	0	107.3	R402	R402-E409 IonicContact CZ-OE1 3.33Å; R402-E409 IonicContact NH1-OE1 2.66Å; R402-E409 PolarHBondContact NH1-OE1 3.38Å; R402-E409 IonicContact NH2-OE1 3.73Å
410	S	34.9	Very low	76.1	Confident	187 Å²	187	106 Å²	106	100%	1.308	53%	0.531	S	S	*	.			trans	-63	0	171.2	55.9	0	0	0	0	111.7	V408	V408-S410 PolarHBondContact O-N 3.21Å

Retrieved 410 of 410 residues in 409.6 ms (Link to these results)

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