A0A077Z4C6_TRITR Loading...

Ubiquitin carboxyl-terminal hydrolase

AlphaFold DB , UniProt , Accession A0A077Z4C6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 459 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	29	Very low	24.9	Very low	243 Å²	243	167.5 Å²	167.5	100%	1.197	85%	0.853	S	S	*	*				0	89.5	0	-98.7	175.9	166.5	0	0	108.3
2	F	23.5	Very low	25.3	Very low	211 Å²	211	161.7 Å²	161.7	93%	0.925	84%	0.835	S	S	*	*			trans	-111.8	106.7	173.6	-92.8	-88.5	0	0	0	107.4
3	R	24.1	Very low	25.5	Very low	231 Å²	231	165.8 Å²	165.8	87%	0.872	83%	0.833	S	S	*	*			trans	-155.3	115.4	163.9	-97.7	-171.3	-172.3	-169.4	1.9	111.5
4	R	22	Very low	25.5	Very low	238 Å²	238	161.9 Å²	161.9	90%	0.898	82%	0.815	S	S	*	*			trans	53.7	116.9	139.7	-65.9	-176.8	176	-179.1	-2.7	119.4
5	S	24.3	Very low	25.6	Very low	120 Å²	120	158.2 Å²	158.2	84%	0.839	80%	0.798	S	S	*	*			trans	-129.8	124.5	143	49.5	0	0	0	0	109
6	S	23.1	Very low	25.8	Very low	118 Å²	118	155.2 Å²	155.2	83%	0.825	79%	0.785	S	S	*	*			trans	-75.5	132.5	178.7	40.7	0	0	0	0	112.2
7	C	24.1	Very low	25.9	Very low	117 Å²	117	148.9 Å²	148.9	79%	0.791	76%	0.762	S	S	*	*			trans	-117.9	115.6	161.9	-79	0	0	0	0	109.5
8	T	23.5	Very low	26	Very low	141 Å²	141	145.6 Å²	145.6	87%	0.865	75%	0.753	S	S	*	*			trans	-78.6	122.7	161.5	46.1	0	0	0	0	108.6
9	L	27.7	Very low	26.3	Very low	142 Å²	142	142.4 Å²	142.4	74%	0.743	73%	0.733	S	S	*	*			trans	-133.6	108.5	173.4	-97.1	153.2	0	0	0	110	E11	L9-E11 PolarHBondContact O-N 3.23Å
10	N	25	Very low	26.7	Very low	167 Å²	167	136 Å²	136	89%	0.893	70%	0.704	S	S	*	*			trans	-69.3	103.4	161.6	-86.1	-26.8	0	0	0	108.4
11	E	27.6	Very low	27.2	Very low	115 Å²	115	131.2 Å²	131.2	54%	0.537	68%	0.679	S	S	.	*			trans	-147	98.7	165.8	-107.5	178.1	179.9	0	0	111.1	L9 R13 L14	L9-E11 PolarHBondContact O-N 3.23Å; E11-R13 VanDerWaalsContact C-N 3.28Å; E11-R13 PolarHBondContact O-N 2.89Å; E11-L14 WeakPolarHBondContact OE2-CD1 3.2Å
12	P	29.2	Very low	27.7	Very low	97 Å²	97	123.3 Å²	123.3	63%	0.63	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-22.8	178	-7.8	17.7	0	0	0	113.8	L14 L15	P12-L14 PolarHBondContact O-N 2.85Å; P12-L15 PolarHBondContact O-N 3.21Å
13	R	28.7	Very low	28.6	Very low	215 Å²	215	115.8 Å²	115.8	81%	0.811	61%	0.611	S	S	*	*	H	α-helix	trans	-74.2	-22.7	-168.7	-65.1	-176.8	-176.8	-174.8	0.4	114.8	E11	E11-R13 VanDerWaalsContact C-N 3.28Å; E11-R13 PolarHBondContact O-N 2.89Å
14	L	25.8	Very low	29.6	Very low	112 Å²	112	104.8 Å²	104.8	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-80.7	-31	178.4	-91.4	152.4	0	0	0	112.6	E11 P12 C18	E11-L14 WeakPolarHBondContact OE2-CD1 3.2Å; P12-L14 PolarHBondContact O-N 2.85Å; L14-C18 PolarHBondContact O-N 3.14Å
15	L	26.6	Very low	30.6	Very low	106 Å²	106	95.6 Å²	95.6	56%	0.555	54%	0.538	S	S	*	.	H	α-helix	trans	-67.2	-44.7	174.5	-87.6	137.8	0	0	0	110.8	P12 A17 C18 F19	P12-L15 PolarHBondContact O-N 3.21Å; L15-A17 VanDerWaalsContact C-N 3.3Å; L15-A17 PolarHBondContact O-N 3.1Å; L15-C18 PolarHBondContact O-N 3.47Å; L15-F19 HydrophobicContact CB-CD2 4.11Å; L15-F19 HydrophobicContact CB-CE2 4.14Å; L15-F19 HydrophobicContact CD2-CD2 4.25Å; L15-F19 HydrophobicContact CD2-CE2 3.53Å; L15-F19 HydrophobicContact CD2-CZ 4.38Å; L15-F19 HydrophobicContact CG-CE2 4.47Å; L15-F19 WeakPolarHBondContact O-CB 3.47Å; L15-F19 WeakPolarHBondContact O-CD2 3.34Å; L15-F19 PolarHBondContact O-N 3.43Å
16	D	28.2	Very low	31.7	Very low	110 Å²	110	90.6 Å²	90.6	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-59.3	-37.9	-179.4	-70.1	-26.1	0	0	0	113.2	F19 G20	D16-F19 PolarHBondContact O-N 2.94Å; D16-G20 PolarHBondContact O-N 3.39Å; D16-G20 VanDerWaalsContact O-N 3.11Å
17	A	28	Very low	32.9	Very low	48 Å²	48	86.1 Å²	86.1	40%	0.397	47%	0.468	S	S	.	.	H	α-helix	trans	-68.3	-43	177.6	0	0	0	0	0	112.5	L15 F19	L15-A17 VanDerWaalsContact C-N 3.3Å; L15-A17 PolarHBondContact O-N 3.1Å; A17-F19 VanDerWaalsContact C-N 3.34Å
18	C	27.6	Very low	34.2	Very low	89 Å²	89	81.1 Å²	81.1	60%	0.601	43%	0.433	S	S	*	.	H	α-helix	trans	-68.3	-33.3	173.8	-71	0	0	0	0	112.4	L14 L15 N21 L22	L14-C18 PolarHBondContact O-N 3.14Å; L15-C18 PolarHBondContact O-N 3.47Å; C18-N21 WeakPolarHBondContact O-CB 3.17Å; C18-N21 PolarHBondContact O-N 3.34Å; C18-L22 PolarHBondContact O-N 2.89Å
19	F	31.2	Very low	35.4	Very low	85 Å²	85	75.1 Å²	75.1	37%	0.373	40%	0.397	S	S	.	.	H	α-helix	trans	-68.5	-45	-179	-92.5	-66.6	0	0	0	113.3	L15 D16 A17 N21 L22 L23 H137	L15-F19 HydrophobicContact CB-CD2 4.11Å; L15-F19 HydrophobicContact CB-CE2 4.14Å; L15-F19 HydrophobicContact CD2-CD2 4.25Å; L15-F19 HydrophobicContact CD2-CE2 3.53Å; L15-F19 HydrophobicContact CD2-CZ 4.38Å; L15-F19 HydrophobicContact CG-CE2 4.47Å; L15-F19 WeakPolarHBondContact O-CB 3.47Å; L15-F19 WeakPolarHBondContact O-CD2 3.34Å; L15-F19 PolarHBondContact O-N 3.43Å; D16-F19 PolarHBondContact O-N 2.94Å; A17-F19 VanDerWaalsContact C-N 3.34Å; F19-N21 PolarHBondContact O-N 3.48Å; F19-L22 PolarHBondContact O-N 3.41Å; F19-L23 PolarHBondContact O-N 2.78Å; F19-H137 AromaticContact CE1-CE1 3.72Å; F19-H137 AromaticContact CE1-NE2 3.53Å; F19-H137 AromaticContact CZ-CE1 3.94Å; F19-H137 AromaticContact CZ-NE2 3.35Å; F19-H137 WeakPolarHBondContact CZ-NE2 3.44Å
20	G	34.4	Very low	36.8	Very low	14 Å²	14	70.3 Å²	70.3	14%	0.144	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-29.1	176.9	0	0	0	0	0	111.6	D16 L22 L23 S24 F156	D16-G20 PolarHBondContact O-N 3.39Å; D16-G20 VanDerWaalsContact O-N 3.11Å; G20-L22 PolarHBondContact O-N 2.91Å; G20-L23 PolarHBondContact O-N 3.39Å; G20-S24 WeakPolarHBondContact O-CB 3.4Å; G20-S24 PolarHBondContact O-N 3.36Å; G20-S24 PolarHBondContact O-OG 3.06Å; G20-F156 VanDerWaalsContact C-CD1 3.45Å; G20-F156 VanDerWaalsContact O-CD1 3.24Å; G20-F156 WeakPolarHBondContact O-CD1 3.32Å; G20-F156 WeakPolarHBondContact O-CE1 3.18Å
21	N	36.7	Very low	38.4	Very low	36 Å²	36	62.6 Å²	62.6	19%	0.193	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-41.3	-178.5	-101.5	-22.1	0	0	0	112.5	C18 F19 S24 I25 F156 T160 L161	C18-N21 WeakPolarHBondContact O-CB 3.17Å; C18-N21 PolarHBondContact O-N 3.34Å; F19-N21 PolarHBondContact O-N 3.48Å; N21-S24 PolarHBondContact O-OG 3.33Å; N21-I25 WeakPolarHBondContact O-CD1 3.39Å; N21-I25 VanDerWaalsContact O-CG1 3.25Å; N21-I25 WeakPolarHBondContact O-CG1 3.45Å; N21-I25 PolarHBondContact O-N 3.38Å; N21-F156 HydrophobicContact CB-CE1 4.37Å; N21-T160 HydrophobicContact CB-CG2 4.36Å; N21-T160 VanDerWaalsContact ND2-CG2 3.26Å; N21-T160 WeakPolarHBondContact ND2-CG2 3.45Å; N21-T160 PolarHBondContact ND2-O 3.42Å; N21-T160 WeakPolarHBondContact OD1-CA 3.48Å; N21-T160 WeakPolarHBondContact OD1-CB 3.45Å; N21-T160 WeakPolarHBondContact OD1-CG2 3.22Å; N21-T160 PolarHBondContact OD1-O 2.87Å; N21-L161 PolarHBondContact OD1-N 2.82Å
22	L	40.6	Very low	39.7	Very low	77 Å²	77	57.8 Å²	57.8	40%	0.403	31%	0.305	S	S	.	.	H	α-helix	trans	-74.8	-39.2	178.2	-163.4	67.1	0	0	0	111	C18 F19 G20 S24 I25 I26 I133	C18-L22 PolarHBondContact O-N 2.89Å; F19-L22 PolarHBondContact O-N 3.41Å; G20-L22 PolarHBondContact O-N 2.91Å; L22-S24 VanDerWaalsContact C-N 3.34Å; L22-I25 PolarHBondContact O-N 3.2Å; L22-I26 HydrophobicContact CG-CD1 4.15Å; L22-I26 WeakPolarHBondContact O-CB 3.39Å; L22-I26 WeakPolarHBondContact O-CD1 3.44Å; L22-I26 WeakPolarHBondContact O-CG1 3.32Å; L22-I26 PolarHBondContact O-N 2.96Å; L22-I133 HydrophobicContact CD2-CD1 3.49Å; L22-I133 VanDerWaalsContact CD2-CD1 3.49Å; L22-I133 HydrophobicContact CG-CD1 4.13Å
23	L	42.9	Very low	41.1	Very low	53 Å²	53	56.7 Å²	56.7	28%	0.277	29%	0.292	S	S	.	.	H	α-helix	trans	-63.7	-40.2	177.5	-179.4	61.1	0	0	0	111.8	F19 G20 L27 F140	F19-L23 PolarHBondContact O-N 2.78Å; G20-L23 PolarHBondContact O-N 3.39Å; L23-L27 HydrophobicContact CD1-CD1 4.05Å; L23-L27 HydrophobicContact CD1-CG 4.25Å; L23-L27 HydrophobicContact CG-CD1 3.96Å; L23-L27 WeakPolarHBondContact O-CB 3.48Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.23Å; L23-L27 PolarHBondContact O-N 2.91Å; L23-F140 HydrophobicContact CD1-CE1 4.26Å; L23-F140 HydrophobicContact CD1-CZ 4.18Å
24	S	44.5	Very low	42.7	Very low	1 Å²	1	47 Å²	47	1%	0.007	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-62.1	174.6	69.2	0	0	0	0	108.7	G20 N21 L22 I26 L27 F28 F157	G20-S24 WeakPolarHBondContact O-CB 3.4Å; G20-S24 PolarHBondContact O-N 3.36Å; G20-S24 PolarHBondContact O-OG 3.06Å; N21-S24 PolarHBondContact O-OG 3.33Å; L22-S24 VanDerWaalsContact C-N 3.34Å; S24-I26 CarbonylContact O-C 3.54Å; S24-I26 PolarHBondContact O-N 3.21Å; S24-L27 WeakPolarHBondContact O-CA 2.99Å; S24-L27 PolarHBondContact O-N 3.32Å; S24-F28 PolarHBondContact O-N 3.49Å; S24-F157 VanDerWaalsContact CA-CE1 3.46Å; S24-F157 VanDerWaalsContact CB-CE1 3.48Å; S24-F157 WeakPolarHBondContact O-CE1 3.49Å; S24-F157 WeakPolarHBondContact O-CZ 3.35Å
25	I	42.7	Very low	44.3	Very low	45 Å²	45	41.8 Å²	41.8	23%	0.231	23%	0.228	C	C	.	.	H	α-helix	trans	-45	-45.8	-179.8	-65.3	163.6	0	0	0	112	N21 L22 F28 S29 L161 F181	N21-I25 WeakPolarHBondContact O-CD1 3.39Å; N21-I25 VanDerWaalsContact O-CG1 3.25Å; N21-I25 WeakPolarHBondContact O-CG1 3.45Å; N21-I25 PolarHBondContact O-N 3.38Å; L22-I25 PolarHBondContact O-N 3.2Å; I25-F28 PolarHBondContact O-N 3.43Å; I25-S29 PolarHBondContact O-N 3.21Å; I25-L161 HydrophobicContact CD1-CD2 3.56Å; I25-L161 HydrophobicContact CG1-CD1 4.04Å; I25-L161 HydrophobicContact CG1-CD2 3.66Å; I25-L161 HydrophobicContact CG1-CG 4.5Å; I25-F181 HydrophobicContact CG1-CE2 4.31Å; I25-F181 HydrophobicContact CG1-CZ 3.86Å; I25-F181 HydrophobicContact CG2-CZ 4.47Å
26	I	46.8	Very low	45.7	Very low	14 Å²	14	37.1 Å²	37.1	7%	0.072	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-49.3	177.9	-76.6	169.1	0	0	0	112.5	L22 S24 F28 S29 Y30 L130 I133	L22-I26 HydrophobicContact CG-CD1 4.15Å; L22-I26 WeakPolarHBondContact O-CB 3.39Å; L22-I26 WeakPolarHBondContact O-CD1 3.44Å; L22-I26 WeakPolarHBondContact O-CG1 3.32Å; L22-I26 PolarHBondContact O-N 2.96Å; S24-I26 CarbonylContact O-C 3.54Å; S24-I26 PolarHBondContact O-N 3.21Å; I26-F28 VanDerWaalsContact C-N 3.26Å; I26-F28 PolarHBondContact O-N 3.09Å; I26-S29 PolarHBondContact O-N 2.95Å; I26-Y30 WeakPolarHBondContact O-CB 3.27Å; I26-Y30 PolarHBondContact O-N 3.42Å; I26-L130 HydrophobicContact CG2-CD1 3.61Å; I26-L130 HydrophobicContact CG2-CD2 3.61Å; I26-L130 HydrophobicContact CG2-CG 3.38Å; I26-I133 HydrophobicContact CD1-CD1 3.5Å; I26-I133 VanDerWaalsContact CD1-CD1 3.5Å
27	L	49.8	Very low	47.3	Very low	24 Å²	24	33.8 Å²	33.8	13%	0.126	19%	0.19	C	C	.	.	H	α-helix	trans	-66	-31	179.4	-71.6	170.3	0	0	0	111.5	L23 S24 M31 M85 V153 F157	L23-L27 HydrophobicContact CD1-CD1 4.05Å; L23-L27 HydrophobicContact CD1-CG 4.25Å; L23-L27 HydrophobicContact CG-CD1 3.96Å; L23-L27 WeakPolarHBondContact O-CB 3.48Å; L23-L27 VanDerWaalsContact O-CG 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.23Å; L23-L27 PolarHBondContact O-N 2.91Å; S24-L27 WeakPolarHBondContact O-CA 2.99Å; S24-L27 PolarHBondContact O-N 3.32Å; L27-M31 WeakPolarHBondContact O-CB 3.09Å; L27-M31 PolarHBondContact O-N 3.48Å; L27-M85 HydrophobicContact CD2-CG 4.06Å; L27-M85 HydrophobicContact CD2-SD 3.42Å; L27-M85 WeakPolarHBondContact CD2-SD 3.47Å; L27-V153 HydrophobicContact CB-CG1 4.09Å; L27-V153 HydrophobicContact CD1-CB 4.22Å; L27-V153 HydrophobicContact CD1-CG1 3.76Å; L27-V153 HydrophobicContact CD1-CG2 3.37Å; L27-F157 HydrophobicContact CB-CZ 3.91Å
28	F	49.8	Very low	48.9	Very low	13 Å²	13	31.5 Å²	31.5	6%	0.057	17%	0.171	C	C	.	.	H	α-helix	trans	-75.1	-43.4	177.1	179.5	-85.7	0	0	0	111.1	S24 I25 I26 Y30 M31 L32 M102 F157 Y180	S24-F28 PolarHBondContact O-N 3.49Å; I25-F28 PolarHBondContact O-N 3.43Å; I26-F28 VanDerWaalsContact C-N 3.26Å; I26-F28 PolarHBondContact O-N 3.09Å; F28-Y30 VanDerWaalsContact C-N 3.26Å; F28-Y30 PolarHBondContact O-N 3.47Å; F28-M31 PolarHBondContact O-N 3.12Å; F28-L32 HydrophobicContact CD1-CB 4.36Å; F28-L32 HydrophobicContact CE1-CB 4.09Å; F28-L32 HydrophobicContact CE1-CD2 3.99Å; F28-L32 HydrophobicContact CE1-CG 4.45Å; F28-L32 WeakPolarHBondContact O-CB 3.22Å; F28-L32 PolarHBondContact O-N 3.03Å; F28-M102 HydrophobicContact CD2-CE 4.07Å; F28-M102 HydrophobicContact CE2-CE 3.45Å; F28-M102 VanDerWaalsContact CE2-CE 3.45Å; F28-M102 HydrophobicContact CE2-SD 3.88Å; F28-M102 HydrophobicContact CZ-CE 4.11Å; F28-M102 HydrophobicContact CZ-SD 3.9Å; F28-F157 HydrophobicContact CB-CD1 4.08Å; F28-F157 HydrophobicContact CB-CE1 3.19Å; F28-F157 HydrophobicContact CB-CE2 4.28Å; F28-F157 HydrophobicContact CB-CZ 3.39Å; F28-F157 HydrophobicContact CD2-CE1 4.4Å; F28-F157 HydrophobicContact CG-CE1 4.2Å; F28-F157 VanDerWaalsContact N-CZ 3.27Å; F28-Y180 HydrophobicContact CD1-CE1 4.43Å; F28-Y180 HydrophobicContact CE1-CD1 4.47Å; F28-Y180 AromaticContact CE1-CE1 3.37Å; F28-Y180 HydrophobicContact CE1-CE1 3.37Å; F28-Y180 AromaticContact CE1-CZ 3.91Å; F28-Y180 AromaticContact CZ-CE1 3.51Å; F28-Y180 HydrophobicContact CZ-CE1 3.51Å; F28-Y180 AromaticContact CZ-CZ 3.97Å
29	S	49.8	Very low	50.3	Low	15 Å²	15	28.9 Å²	28.9	11%	0.105	15%	0.149	C	C	.	.	H	α-helix	trans	-58.5	-44.4	172.9	175.4	0	0	0	0	110.7	I25 I26 L32 H33 E126	I25-S29 PolarHBondContact O-N 3.21Å; I26-S29 PolarHBondContact O-N 2.95Å; S29-L32 PolarHBondContact O-N 3.06Å; S29-H33 WeakPolarHBondContact O-CB 3.48Å; S29-H33 PolarHBondContact O-N 2.98Å; S29-E126 WeakPolarHBondContact CB-OE2 3.04Å; S29-E126 PolarHBondContact OG-OE2 3.2Å
30	Y	57.1	Low	51.2	Low	41 Å²	41	29.5 Å²	29.5	16%	0.161	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-44.7	176.1	-167	-99.4	0	0	0	112	I26 F28 F34 L76 L89 F127	I26-Y30 WeakPolarHBondContact O-CB 3.27Å; I26-Y30 PolarHBondContact O-N 3.42Å; F28-Y30 VanDerWaalsContact C-N 3.26Å; F28-Y30 PolarHBondContact O-N 3.47Å; Y30-F34 WeakPolarHBondContact O-CA 3.16Å; Y30-F34 WeakPolarHBondContact O-CB 3.08Å; Y30-F34 PolarHBondContact O-N 2.93Å; Y30-L76 HydrophobicContact CE1-CD2 4.3Å; Y30-L89 HydrophobicContact CD1-CD1 3.4Å; Y30-L89 HydrophobicContact CD1-CD2 4.49Å; Y30-L89 HydrophobicContact CE1-CD1 3.38Å; Y30-F127 HydrophobicContact CD2-CE2 4.25Å; Y30-F127 HydrophobicContact CD2-CZ 4.42Å; Y30-F127 HydrophobicContact CE2-CE2 4.39Å; Y30-F127 HydrophobicContact CE2-CZ 4.15Å
31	M	59.3	Low	51.6	Low	4 Å²	4	33.3 Å²	33.3	2%	0.02	17%	0.168	C	C	.	.	H	α-helix	trans	-66.1	-46.7	177.9	-176.7	-179.9	173.6	0	0	112	L27 F28 F34 V35 L89 L92 L98 M102	L27-M31 WeakPolarHBondContact O-CB 3.09Å; L27-M31 PolarHBondContact O-N 3.48Å; F28-M31 PolarHBondContact O-N 3.12Å; M31-F34 PolarHBondContact O-N 2.81Å; M31-V35 HydrophobicContact CE-CG2 4.35Å; M31-V35 HydrophobicContact CG-CG2 4.04Å; M31-V35 VanDerWaalsContact O-CB 3.28Å; M31-V35 WeakPolarHBondContact O-CB 3.43Å; M31-V35 WeakPolarHBondContact O-CG2 3.42Å; M31-V35 PolarHBondContact O-N 3.05Å; M31-L89 HydrophobicContact CB-CD2 3.69Å; M31-L89 HydrophobicContact CG-CD2 3.93Å; M31-L92 HydrophobicContact CE-CB 3.46Å; M31-L92 VanDerWaalsContact CE-CB 3.46Å; M31-L92 HydrophobicContact CE-CD1 3.95Å; M31-L92 HydrophobicContact CE-CG 4.29Å; M31-L92 HydrophobicContact SD-CB 4.47Å; M31-L92 HydrophobicContact SD-CD1 4.04Å; M31-L98 HydrophobicContact CE-CD2 3.39Å; M31-L98 HydrophobicContact CE-CG 3.89Å; M31-M102 HydrophobicContact CE-CE 4.13Å; M31-M102 HydrophobicContact SD-CE 4.26Å
32	L	54.5	Low	51.7	Low	14 Å²	14	33.5 Å²	33.5	7%	0.073	17%	0.171	C	C	.	.	H	α-helix	trans	-59.2	-51.4	176.8	-179	70.6	0	0	0	109.4	F28 S29 F34 V36 M102 W106	F28-L32 HydrophobicContact CD1-CB 4.36Å; F28-L32 HydrophobicContact CE1-CB 4.09Å; F28-L32 HydrophobicContact CE1-CD2 3.99Å; F28-L32 HydrophobicContact CE1-CG 4.45Å; F28-L32 WeakPolarHBondContact O-CB 3.22Å; F28-L32 PolarHBondContact O-N 3.03Å; S29-L32 PolarHBondContact O-N 3.06Å; L32-F34 VanDerWaalsContact C-N 3.32Å; L32-F34 PolarHBondContact O-N 3.02Å; L32-V36 HydrophobicContact CD1-CG2 4.22Å; L32-V36 HydrophobicContact CG-CG2 4.46Å; L32-V36 WeakPolarHBondContact O-CB 3.22Å; L32-V36 WeakPolarHBondContact O-CG2 3.32Å; L32-V36 PolarHBondContact O-N 3.25Å; L32-M102 HydrophobicContact CB-SD 4.44Å; L32-M102 HydrophobicContact CD1-CB 4.11Å; L32-M102 HydrophobicContact CD1-CG 4.48Å; L32-M102 HydrophobicContact CD1-SD 3.62Å; L32-W106 HydrophobicContact CD1-CB 4.5Å; L32-W106 HydrophobicContact CD2-CE3 4.08Å; L32-W106 HydrophobicContact CG-CE3 4.01Å
33	H	58	Low	51.4	Low	75 Å²	75	36.3 Å²	36.3	35%	0.347	18%	0.176	S	C	.	.	H	α-helix	trans	-62	-40.5	177.3	-172.1	-86.8	0	0	0	111.7	S29 S37	S29-H33 WeakPolarHBondContact O-CB 3.48Å; S29-H33 PolarHBondContact O-N 2.98Å; H33-S37 PolarHBondContact CE1-OG 3.17Å; H33-S37 VanDerWaalsContact CE1-OG 3.27Å; H33-S37 PolarHBondContact ND1-OG 3.46Å; H33-S37 WeakPolarHBondContact O-CB 3.34Å; H33-S37 PolarHBondContact O-N 3.36Å; H33-S37 PolarHBondContact O-OG 2.99Å
34	F	63.2	Low	50.9	Low	12 Å²	12	44.7 Å²	44.7	5%	0.053	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-57.7	178.1	175.6	-114.4	0	0	0	111.5	Y30 M31 L32 V36 S37 N38 I74 L76 L89 S93	Y30-F34 WeakPolarHBondContact O-CA 3.16Å; Y30-F34 WeakPolarHBondContact O-CB 3.08Å; Y30-F34 PolarHBondContact O-N 2.93Å; M31-F34 PolarHBondContact O-N 2.81Å; L32-F34 VanDerWaalsContact C-N 3.32Å; L32-F34 PolarHBondContact O-N 3.02Å; F34-V36 VanDerWaalsContact C-N 3.29Å; F34-V36 PolarHBondContact O-N 2.86Å; F34-S37 PolarHBondContact O-N 2.93Å; F34-S37 VanDerWaalsContact O-N 3.12Å; F34-N38 WeakPolarHBondContact CZ-ND2 3.43Å; F34-N38 WeakPolarHBondContact O-CB 3.3Å; F34-N38 PolarHBondContact O-N 3.42Å; F34-I74 HydrophobicContact CE2-CB 4.46Å; F34-I74 HydrophobicContact CE2-CG2 4.42Å; F34-L76 HydrophobicContact CD2-CD1 4.4Å; F34-L76 HydrophobicContact CD2-CD2 3.43Å; F34-L76 VanDerWaalsContact CD2-CD2 3.43Å; F34-L76 HydrophobicContact CD2-CG 4.15Å; F34-L76 HydrophobicContact CE1-CD1 4.16Å; F34-L76 HydrophobicContact CE2-CD1 4.07Å; F34-L76 HydrophobicContact CE2-CD2 3.33Å; F34-L76 HydrophobicContact CE2-CG 3.62Å; F34-L76 HydrophobicContact CG-CD2 4.23Å; F34-L76 HydrophobicContact CZ-CD1 3.93Å; F34-L76 HydrophobicContact CZ-CD2 4.07Å; F34-L76 HydrophobicContact CZ-CG 3.86Å; F34-L89 HydrophobicContact CD1-CB 4.34Å; F34-L89 HydrophobicContact CE1-CB 4.44Å; F34-S93 WeakPolarHBondContact CE1-OG 3.39Å
35	V	58.5	Low	50.2	Low	1 Å²	1	48.8 Å²	48.8	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-51.9	-52.1	177.1	172.2	0	0	0	0	109.3	M31 S37 N38 F39 T99 M102	M31-V35 HydrophobicContact CE-CG2 4.35Å; M31-V35 HydrophobicContact CG-CG2 4.04Å; M31-V35 VanDerWaalsContact O-CB 3.28Å; M31-V35 WeakPolarHBondContact O-CB 3.43Å; M31-V35 WeakPolarHBondContact O-CG2 3.42Å; M31-V35 PolarHBondContact O-N 3.05Å; V35-S37 PolarHBondContact O-N 2.96Å; V35-N38 PolarHBondContact O-N 3.01Å; V35-F39 HydrophobicContact CG1-CD2 4.25Å; V35-F39 VanDerWaalsContact O-CD2 3.22Å; V35-F39 WeakPolarHBondContact O-CD2 3.41Å; V35-F39 PolarHBondContact O-N 2.86Å; V35-T99 HydrophobicContact CG1-CG2 4Å; V35-M102 HydrophobicContact CB-CB 4.37Å; V35-M102 HydrophobicContact CG1-CB 3.76Å; V35-M102 HydrophobicContact CG1-CG 4.35Å
36	V	56.5	Low	49.8	Very low	8 Å²	8	51.9 Å²	51.9	5%	0.048	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-45.6	-179.8	170.1	0	0	0	0	111.6	L32 F34 N38 F39 K40 W106	L32-V36 HydrophobicContact CD1-CG2 4.22Å; L32-V36 HydrophobicContact CG-CG2 4.46Å; L32-V36 WeakPolarHBondContact O-CB 3.22Å; L32-V36 WeakPolarHBondContact O-CG2 3.32Å; L32-V36 PolarHBondContact O-N 3.25Å; F34-V36 VanDerWaalsContact C-N 3.29Å; F34-V36 PolarHBondContact O-N 2.86Å; V36-N38 VanDerWaalsContact C-N 3.26Å; V36-N38 PolarHBondContact O-N 3.49Å; V36-F39 CarbonylContact O-C 3.54Å; V36-F39 PolarHBondContact O-N 3.46Å; V36-K40 HydrophobicContact CG1-CD 3.59Å; V36-K40 HydrophobicContact CG1-CG 3.68Å; V36-K40 WeakPolarHBondContact O-CA 3.41Å; V36-K40 WeakPolarHBondContact O-CB 3.03Å; V36-K40 VanDerWaalsContact O-CG 3.24Å; V36-K40 WeakPolarHBondContact O-CG 3.3Å; V36-K40 PolarHBondContact O-N 3.36Å; V36-W106 HydrophobicContact CB-CB 4.43Å; V36-W106 HydrophobicContact CB-CD2 3.97Å; V36-W106 HydrophobicContact CB-CE3 4.18Å; V36-W106 HydrophobicContact CB-CG 4Å; V36-W106 HydrophobicContact CG1-CB 4.27Å; V36-W106 VanDerWaalsContact CG1-CD1 3.47Å; V36-W106 HydrophobicContact CG1-CD2 3.43Å; V36-W106 VanDerWaalsContact CG1-CD2 3.43Å; V36-W106 HydrophobicContact CG1-CE3 4.06Å; V36-W106 HydrophobicContact CG1-CG 3.43Å; V36-W106 VanDerWaalsContact CG1-CG 3.43Å; V36-W106 HydrophobicContact CG1-CZ2 4.33Å; V36-W106 HydrophobicContact CG2-CB 3.31Å; V36-W106 HydrophobicContact CG2-CD2 3.63Å; V36-W106 HydrophobicContact CG2-CE3 3.79Å; V36-W106 HydrophobicContact CG2-CG 3.37Å
37	S	60.8	Low	48.9	Very low	41 Å²	41	56.9 Å²	56.9	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-35.5	179.6	-61.8	0	0	0	0	111.7	H33 F34 V35 F39	H33-S37 PolarHBondContact CE1-OG 3.17Å; H33-S37 VanDerWaalsContact CE1-OG 3.27Å; H33-S37 PolarHBondContact ND1-OG 3.46Å; H33-S37 WeakPolarHBondContact O-CB 3.34Å; H33-S37 PolarHBondContact O-N 3.36Å; H33-S37 PolarHBondContact O-OG 2.99Å; F34-S37 PolarHBondContact O-N 2.93Å; F34-S37 VanDerWaalsContact O-N 3.12Å; V35-S37 PolarHBondContact O-N 2.96Å; S37-F39 VanDerWaalsContact C-N 3.32Å; S37-F39 PolarHBondContact O-N 2.83Å
38	N	61.6	Low	47.9	Very low	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-69.9	-28.8	179	-150.4	-16.5	0	0	0	112.1	F34 V35 V36 G72 L73 I74	F34-N38 WeakPolarHBondContact CZ-ND2 3.43Å; F34-N38 WeakPolarHBondContact O-CB 3.3Å; F34-N38 PolarHBondContact O-N 3.42Å; V35-N38 PolarHBondContact O-N 3.01Å; V36-N38 VanDerWaalsContact C-N 3.26Å; V36-N38 PolarHBondContact O-N 3.49Å; N38-G72 PolarHBondContact O-N 3.41Å; N38-G72 WeakPolarHBondContact OD1-CA 3.43Å; N38-G72 PolarHBondContact OD1-N 2.9Å; N38-G72 PolarHBondContact OD1-O 2.94Å; N38-L73 PolarHBondContact OD1-N 3.34Å; N38-L73 VanDerWaalsContact OD1-N 3.12Å; N38-I74 HydrophobicContact CB-CD1 4.32Å; N38-I74 WeakPolarHBondContact OD1-CG1 3.43Å; N38-I74 PolarHBondContact OD1-N 3.12Å
39	F	57.4	Low	46.9	Very low	33 Å²	33	67.7 Å²	67.7	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-110	-5.5	179.8	-68.3	-84.4	0	0	0	115.4	V35 V36 S37 L41 V42 V71 S93 T99 L367	V35-F39 HydrophobicContact CG1-CD2 4.25Å; V35-F39 VanDerWaalsContact O-CD2 3.22Å; V35-F39 WeakPolarHBondContact O-CD2 3.41Å; V35-F39 PolarHBondContact O-N 2.86Å; V36-F39 CarbonylContact O-C 3.54Å; V36-F39 PolarHBondContact O-N 3.46Å; S37-F39 VanDerWaalsContact C-N 3.32Å; S37-F39 PolarHBondContact O-N 2.83Å; F39-L41 PolarHBondContact O-N 2.81Å; F39-L41 VanDerWaalsContact O-N 3.08Å; F39-V42 WeakPolarHBondContact O-CG2 3.18Å; F39-V42 PolarHBondContact O-N 2.71Å; F39-V71 HydrophobicContact CB-CG1 4.46Å; F39-V71 HydrophobicContact CD1-CG1 3.61Å; F39-V71 HydrophobicContact CE1-CG1 4.22Å; F39-V71 HydrophobicContact CG-CG1 4.33Å; F39-S93 WeakPolarHBondContact CE2-O 3.49Å; F39-S93 WeakPolarHBondContact CZ-O 3.37Å; F39-T99 HydrophobicContact CD1-CG2 4.06Å; F39-T99 HydrophobicContact CD2-CG2 3.41Å; F39-T99 VanDerWaalsContact CD2-CG2 3.41Å; F39-T99 HydrophobicContact CE1-CG2 4.07Å; F39-T99 HydrophobicContact CE2-CG2 3.46Å; F39-T99 VanDerWaalsContact CE2-CG2 3.46Å; F39-T99 HydrophobicContact CG-CG2 3.76Å; F39-T99 HydrophobicContact CZ-CG2 3.8Å; F39-L367 HydrophobicContact CD1-CD1 4.44Å; F39-L367 HydrophobicContact CE1-CD1 4.21Å
40	K	50.4	Low	45.9	Very low	99 Å²	99	76.3 Å²	76.3	43%	0.43	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-62.8	-15.5	-178.6	-108.2	176.1	-179.7	161.9	0	114.5	V36 V42 R43 W106	V36-K40 HydrophobicContact CG1-CD 3.59Å; V36-K40 HydrophobicContact CG1-CG 3.68Å; V36-K40 WeakPolarHBondContact O-CA 3.41Å; V36-K40 WeakPolarHBondContact O-CB 3.03Å; V36-K40 VanDerWaalsContact O-CG 3.24Å; V36-K40 WeakPolarHBondContact O-CG 3.3Å; V36-K40 PolarHBondContact O-N 3.36Å; K40-V42 PolarHBondContact O-N 3.05Å; K40-V42 VanDerWaalsContact O-N 3.08Å; K40-R43 PolarHBondContact O-N 2.76Å; K40-W106 VanDerWaalsContact NZ-CE2 3.29Å
41	L	42.7	Very low	44.5	Very low	93 Å²	93	81.9 Å²	81.9	49%	0.487	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-60.8	-14.4	175.7	-83.2	161.7	0	0	0	113.5	F39 V71	F39-L41 PolarHBondContact O-N 2.81Å; F39-L41 VanDerWaalsContact O-N 3.08Å; L41-V71 HydrophobicContact CB-CG2 3.79Å; L41-V71 HydrophobicContact CD1-CG2 4.37Å
42	V	39	Very low	43.3	Very low	41 Å²	41	87 Å²	87	25%	0.248	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-79.1	-27.5	-176	178.7	0	0	0	0	113.5	F39 K40 R44 L46 F68 V71	F39-V42 WeakPolarHBondContact O-CG2 3.18Å; F39-V42 PolarHBondContact O-N 2.71Å; K40-V42 PolarHBondContact O-N 3.05Å; K40-V42 VanDerWaalsContact O-N 3.08Å; V42-R44 PolarHBondContact O-N 3.06Å; V42-L46 HydrophobicContact CG1-CD1 3.24Å; V42-L46 WeakPolarHBondContact O-CD1 3.4Å; V42-F68 HydrophobicContact CG1-CE1 4.39Å; V42-F68 HydrophobicContact CG2-CE1 4.09Å; V42-V71 HydrophobicContact CG2-CG1 3.98Å; V42-V71 HydrophobicContact CG2-CG2 4.4Å
43	R	35	Very low	42	Very low	136 Å²	136	94.3 Å²	94.3	51%	0.513	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.9	-169.6	-134.4	179.1	-177.1	-179.7	-3.8	115.1	K40 N107 E111	K40-R43 PolarHBondContact O-N 2.76Å; R43-N107 PolarHBondContact NH1-OD1 2.89Å; R43-E111 IonicContact NH2-OE1 2.82Å; R43-E111 PolarHBondContact NH2-OE1 3.21Å
44	R	31.1	Very low	40.9	Very low	229 Å²	229	97 Å²	97	86%	0.864	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-24.9	-179.3	-102.5	-179.2	167.9	140.2	-1.7	114.6	V42	V42-R44 PolarHBondContact O-N 3.06Å
45	D	31.1	Very low	39.3	Very low	87 Å²	87	107.3 Å²	107.3	47%	0.465	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-14.1	-174.5	-66.6	-29.9	0	0	0	114.3	C47 A67	D45-C47 VanDerWaalsContact C-N 3.31Å; D45-C47 PolarHBondContact O-N 3.31Å; D45-A67 WeakPolarHBondContact OD2-CB 3.4Å
46	L	33.7	Very low	37.7	Very low	109 Å²	109	110.6 Å²	110.6	57%	0.571	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-78.6	-4.3	-179.1	-94.9	147.3	0	0	0	115.2	V42 L48	V42-L46 HydrophobicContact CG1-CD1 3.24Å; V42-L46 WeakPolarHBondContact O-CD1 3.4Å; L46-L48 VanDerWaalsContact C-N 3.27Å; L46-L48 PolarHBondContact O-N 2.88Å
47	C	28.7	Very low	36.4	Very low	119 Å²	119	119 Å²	119	80%	0.804	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-82.3	5.9	174.5	-79.9	0	0	0	0	114.3	D45	D45-C47 VanDerWaalsContact C-N 3.31Å; D45-C47 PolarHBondContact O-N 3.31Å
48	L	28.6	Very low	35	Very low	151 Å²	151	122.8 Å²	122.8	79%	0.791	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-116.9	4.9	-173.9	-74.7	173.1	0	0	0	117	L46	L46-L48 VanDerWaalsContact C-N 3.27Å; L46-L48 PolarHBondContact O-N 2.88Å
49	T	28.3	Very low	33.8	Very low	114 Å²	114	130 Å²	130	70%	0.699	67%	0.665	S	S	*	*			trans	-139.1	83.2	173.7	59.7	0	0	0	0	111.5
50	K	28.5	Very low	32.8	Very low	196 Å²	196	131.6 Å²	131.6	85%	0.852	68%	0.679	S	S	*	*			trans	-71.9	138.6	146.5	-71.8	-179.3	175.4	-178.7	0	106
51	D	28.3	Very low	32.2	Very low	157 Å²	157	133 Å²	133	84%	0.84	69%	0.69	S	S	*	*			trans	101.7	78.5	174.3	-47.3	-23.4	0	0	0	116.2
52	S	32.9	Very low	31.9	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	71%	0.705	S	S	*	*			trans	-174.4	121.5	137.8	54.9	0	0	0	0	111.5
53	E	28.8	Very low	31.8	Very low	168 Å²	168	138.4 Å²	138.4	79%	0.785	73%	0.727	S	S	*	*			trans	-61	142.6	171.7	-64.8	176.7	147.2	0	0	112.3
54	P	34.4	Very low	31.7	Very low	132 Å²	132	140.4 Å²	140.4	86%	0.857	75%	0.748	S	S	*	*			trans	-93.6	114.5	171.1	29.3	-19.2	0	0	0	111.3
55	R	28.4	Very low	32	Very low	229 Å²	229	132 Å²	132	86%	0.864	73%	0.732	S	S	*	*			trans	-84	127.7	162.9	-69.1	-177.3	-163.8	-178.3	5	110.1
56	G	26.2	Very low	32.5	Very low	70 Å²	70	134 Å²	134	72%	0.722	74%	0.743	S	S	*	*	S	Bend	trans	8.5	141.1	160.4	0	0	0	0	0	122.1
57	K	29.5	Very low	32.7	Very low	184 Å²	184	130.7 Å²	130.7	80%	0.8	73%	0.731	S	S	*	*	S	Bend	trans	102.4	121.4	172.8	-60.7	-179.6	-178.6	-178.1	0	113.2	H59	K57-H59 PolarHBondContact O-N 3.32Å
58	T	30.8	Very low	33.6	Very low	121 Å²	121	128.9 Å²	128.9	74%	0.742	71%	0.71	S	S	*	*			trans	-47.5	95.8	172.4	43.4	0	0	0	0	110.7
59	H	36.2	Very low	34.7	Very low	151 Å²	151	129.6 Å²	129.6	70%	0.699	70%	0.702	S	S	*	*			trans	-122.8	128.7	179.6	-96.4	-87.6	0	0	0	109.2	K57 L61	K57-H59 PolarHBondContact O-N 3.32Å; H59-L61 PolarHBondContact O-N 3.2Å
60	C	36.6	Very low	36.3	Very low	67 Å²	67	131 Å²	131	45%	0.453	70%	0.698	S	S	.	*			trans	-46.6	129.3	162.1	-54.7	0	0	0	0	107.8	A62 C369	C60-A62 PolarHBondContact O-N 3.28Å; C60-C369 HydrophobicContact CB-CB 4.28Å; C60-C369 WeakPolarHBondContact CB-SG 3.5Å; C60-C369 WeakPolarHBondContact SG-CB 3.26Å; C60-C369 CovalentContact SG-SG 2.05Å; C60-C369 PolarHBondContact SG-SG 3.11Å
61	L	38.1	Very low	38	Very low	127 Å²	127	121.7 Å²	121.7	67%	0.665	66%	0.658	S	S	*	*			trans	-70.6	68.6	179	-71.3	167.8	0	0	0	110.2	H59 H63	H59-L61 PolarHBondContact O-N 3.2Å; L61-H63 PolarHBondContact O-N 2.9Å
62	A	35.5	Very low	40	Very low	97 Å²	97	114.2 Å²	114.2	80%	0.802	62%	0.618	S	S	*	*			trans	-81	67.6	169.2	0	0	0	0	0	109.2	C60	C60-A62 PolarHBondContact O-N 3.28Å
63	H	37.7	Very low	42.3	Very low	151 Å²	151	110.2 Å²	110.2	70%	0.699	59%	0.588	S	S	*	*			trans	-95	131.2	166.8	-97.3	-89	0	0	0	109.9	L61 G65	L61-H63 PolarHBondContact O-N 2.9Å; H63-G65 PolarHBondContact O-N 3.48Å
64	N	33	Very low	44.7	Very low	179 Å²	179	105.4 Å²	105.4	96%	0.957	57%	0.567	S	S	*	*	S	Bend	trans	-48.5	123.6	-178.4	-83.6	-30.3	0	0	0	113.6
65	G	36.8	Very low	47	Very low	51 Å²	51	100.1 Å²	100.1	53%	0.526	54%	0.537	S	S	.	.			trans	155.5	118.8	165.5	0	0	0	0	0	112.2	H63 A67 F68	H63-G65 PolarHBondContact O-N 3.48Å; G65-A67 PolarHBondContact O-N 3.2Å; G65-F68 PolarHBondContact O-N 2.83Å
66	N	41.6	Very low	49.3	Very low	130 Å²	130	89.7 Å²	89.7	70%	0.695	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-50.5	-10.9	-172.6	-85.4	-31	0	0	0	117
67	A	38.6	Very low	51.9	Low	39 Å²	39	95.3 Å²	95.3	32%	0.322	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-71.7	-33.6	-176.4	0	0	0	0	0	114.3	D45 G65 R69	D45-A67 WeakPolarHBondContact OD2-CB 3.4Å; G65-A67 PolarHBondContact O-N 3.2Å; A67-R69 PolarHBondContact O-N 3.35Å
68	F	47.3	Very low	54.1	Low	81 Å²	81	89 Å²	89	36%	0.355	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-75.6	-11	-178.5	-74.2	-80.6	0	0	0	114	V42 G65 F70 V71	V42-F68 HydrophobicContact CG1-CE1 4.39Å; V42-F68 HydrophobicContact CG2-CE1 4.09Å; G65-F68 PolarHBondContact O-N 2.83Å; F68-F70 PolarHBondContact O-N 2.97Å; F68-F70 VanDerWaalsContact O-N 3.13Å; F68-V71 HydrophobicContact CD1-CG2 4.38Å
69	R	50.8	Low	56.1	Low	167 Å²	167	87.1 Å²	87.1	63%	0.63	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-61.8	-23.8	-173.3	-93.4	-176.7	156.9	-177.4	-6.4	114.6	A67 L73	A67-R69 PolarHBondContact O-N 3.35Å; R69-L73 WeakPolarHBondContact O-CD1 3.47Å
70	F	61.5	Low	57.5	Low	142 Å²	142	81.9 Å²	81.9	62%	0.623	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-119.7	3.5	-171.9	-58.3	-74.9	0	0	0	114.5	F68 G72 L73	F68-F70 PolarHBondContact O-N 2.97Å; F68-F70 VanDerWaalsContact O-N 3.13Å; F70-G72 PolarHBondContact O-N 3.34Å; F70-L73 PolarHBondContact O-N 3.24Å
71	V	64.8	Low	59.1	Low	1 Å²	1	83.4 Å²	83.4	1%	0.006	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	130.3	-179.8	-172.8	0	0	0	0	109.6	F39 L41 V42 F68 L73 N365 L367	F39-V71 HydrophobicContact CB-CG1 4.46Å; F39-V71 HydrophobicContact CD1-CG1 3.61Å; F39-V71 HydrophobicContact CE1-CG1 4.22Å; F39-V71 HydrophobicContact CG-CG1 4.33Å; L41-V71 HydrophobicContact CB-CG2 3.79Å; L41-V71 HydrophobicContact CD1-CG2 4.37Å; V42-V71 HydrophobicContact CG2-CG1 3.98Å; V42-V71 HydrophobicContact CG2-CG2 4.4Å; F68-V71 HydrophobicContact CD1-CG2 4.38Å; V71-L73 VanDerWaalsContact C-N 3.3Å; V71-N365 PolarHBondContact O-ND2 3.26Å; V71-L367 HydrophobicContact CB-CD1 3.59Å; V71-L367 HydrophobicContact CG1-CD1 3.51Å
72	G	69.9	Low	60.7	Low	0 Å²	0	77.8 Å²	77.8	0%	0	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	0.2	-175.1	0	0	0	0	0	114.6	N38 F70 F374	N38-G72 PolarHBondContact O-N 3.41Å; N38-G72 WeakPolarHBondContact OD1-CA 3.43Å; N38-G72 PolarHBondContact OD1-N 2.9Å; N38-G72 PolarHBondContact OD1-O 2.94Å; F70-G72 PolarHBondContact O-N 3.34Å; G72-F374 WeakPolarHBondContact O-CZ 3.09Å
73	L	81.5	Confident	62.8	Low	27 Å²	27	73.6 Å²	73.6	14%	0.141	38%	0.382	C	S	.	.			trans	-111.3	43.1	-171	-55.1	-175.1	0	0	0	113.5	N38 R69 F70 V71 N365 Y372 F374 V379	N38-L73 PolarHBondContact OD1-N 3.34Å; N38-L73 VanDerWaalsContact OD1-N 3.12Å; R69-L73 WeakPolarHBondContact O-CD1 3.47Å; F70-L73 PolarHBondContact O-N 3.24Å; V71-L73 VanDerWaalsContact C-N 3.3Å; L73-N365 HydrophobicContact CD2-CB 4.4Å; L73-N365 VanDerWaalsContact CD2-ND2 3.32Å; L73-N365 WeakPolarHBondContact CD2-ND2 2.97Å; L73-Y372 HydrophobicContact CD1-CD1 4.23Å; L73-Y372 HydrophobicContact CD1-CE1 3.6Å; L73-Y372 HydrophobicContact CD1-CE2 4.08Å; L73-Y372 HydrophobicContact CD2-CD1 3.8Å; L73-Y372 HydrophobicContact CD2-CD2 3.54Å; L73-Y372 HydrophobicContact CD2-CE1 3.95Å; L73-Y372 HydrophobicContact CD2-CE2 3.68Å; L73-Y372 HydrophobicContact CD2-CG 3.6Å; L73-Y372 HydrophobicContact CG-CE1 4.43Å; L73-F374 HydrophobicContact CD2-CZ 4.14Å; L73-V379 HydrophobicContact CB-CG1 4.4Å
74	I	79.2	Confident	64.7	Low	68 Å²	68	68.5 Å²	68.5	35%	0.349	36%	0.357	S	S	.	.			trans	-101.8	123.5	177.4	-58.5	-177.5	0	0	0	110.8	F34 N38 Q90	F34-I74 HydrophobicContact CE2-CB 4.46Å; F34-I74 HydrophobicContact CE2-CG2 4.42Å; N38-I74 HydrophobicContact CB-CD1 4.32Å; N38-I74 WeakPolarHBondContact OD1-CG1 3.43Å; N38-I74 PolarHBondContact OD1-N 3.12Å; I74-Q90 PolarHBondContact O-NE2 3.27Å
75	G	82.6	Confident	66.6	Low	21 Å²	21	61.3 Å²	61.3	22%	0.216	32%	0.318	C	S	.	.			trans	-74.3	156.3	171.9	0	0	0	0	0	112.9	D376 V379	G75-D376 CarbonylContact C-O 3.6Å; G75-D376 WeakPolarHBondContact CA-O 3.23Å; G75-V379 VanDerWaalsContact N-CG2 3.33Å
76	L	76.6	Confident	68.6	Low	10 Å²	10	59 Å²	59	5%	0.052	29%	0.294	C	S	.	.			trans	-113.4	116.5	178.7	-73	177.6	0	0	0	110.6	Y30 F34 N78 N86 L89 Q90 D376 E377	Y30-L76 HydrophobicContact CE1-CD2 4.3Å; F34-L76 HydrophobicContact CD2-CD1 4.4Å; F34-L76 HydrophobicContact CD2-CD2 3.43Å; F34-L76 VanDerWaalsContact CD2-CD2 3.43Å; F34-L76 HydrophobicContact CD2-CG 4.15Å; F34-L76 HydrophobicContact CE1-CD1 4.16Å; F34-L76 HydrophobicContact CE2-CD1 4.07Å; F34-L76 HydrophobicContact CE2-CD2 3.33Å; F34-L76 HydrophobicContact CE2-CG 3.62Å; F34-L76 HydrophobicContact CG-CD2 4.23Å; F34-L76 HydrophobicContact CZ-CD1 3.93Å; F34-L76 HydrophobicContact CZ-CD2 4.07Å; F34-L76 HydrophobicContact CZ-CG 3.86Å; L76-N78 PolarHBondContact O-N 3.07Å; L76-N86 HydrophobicContact CB-CB 4Å; L76-N86 HydrophobicContact CD1-CB 4.14Å; L76-N86 PolarHBondContact O-ND2 3.07Å; L76-N86 VanDerWaalsContact O-ND2 3.11Å; L76-L89 HydrophobicContact CD1-CB 3.89Å; L76-L89 HydrophobicContact CD1-CD1 3.97Å; L76-Q90 HydrophobicContact CD1-CG 4.36Å; L76-D376 PolarHBondContact N-O 3.47Å; L76-D376 CarbonylContact O-C 3.51Å; L76-D376 WeakPolarHBondContact O-CA 3.42Å; L76-D376 WeakPolarHBondContact O-CB 3.33Å; L76-E377 PolarHBondContact O-N 3.05Å; L76-E377 VanDerWaalsContact O-N 3.14Å
77	R	80.2	Confident	70.6	Confident	187 Å²	187	53 Å²	53	71%	0.706	26%	0.262	S	S	*	.			trans	-56.5	128.8	178.7	-170.9	178.4	-177.5	-152.8	-0.1	111.2	M79	R77-M79 PolarHBondContact O-N 3.18Å
78	N	77.4	Confident	72.7	Confident	51 Å²	51	51.6 Å²	51.6	27%	0.273	25%	0.249	S	C	.	.			trans	-65.5	119.8	170.9	-159.9	-49.5	0	0	0	109	L76 G80 N81 T82 D376	L76-N78 PolarHBondContact O-N 3.07Å; N78-G80 VanDerWaalsContact C-N 3.27Å; N78-G80 WeakPolarHBondContact OD1-CA 3.47Å; N78-G80 PolarHBondContact OD1-N 2.91Å; N78-N81 PolarHBondContact OD1-N 3.18Å; N78-N81 VanDerWaalsContact OD1-N 3.17Å; N78-T82 PolarHBondContact OD1-N 3.29Å; N78-T82 PolarHBondContact OD1-OG1 3.08Å; N78-D376 HydrophobicContact CB-CB 4.14Å; N78-D376 VanDerWaalsContact CB-OD2 3.28Å; N78-D376 WeakPolarHBondContact CB-OD2 3.32Å; N78-D376 PolarHBondContact ND2-OD2 3.49Å
79	M	71.6	Confident	74.1	Confident	83 Å²	83	48.1 Å²	48.1	41%	0.409	23%	0.234	S	C	.	.			trans	-87.9	-1.7	-177.6	-103.3	-166.2	-61	0	0	111.7	R77 T82 M85 R134	R77-M79 PolarHBondContact O-N 3.18Å; M79-T82 HydrophobicContact CB-CG2 3.76Å; M79-T82 PolarHBondContact N-OG1 3.24Å; M79-M85 HydrophobicContact CE-CE 4.27Å; M79-R134 PolarHBondContact O-NH1 2.63Å; M79-R134 PolarHBondContact O-NH2 3.39Å
80	G	67.2	Low	75.8	Confident	41 Å²	41	40.3 Å²	40.3	42%	0.423	21%	0.205	S	C	.	.	S	Bend	trans	111.8	101.2	-172.9	0	0	0	0	0	110	N78 T82 R134	N78-G80 VanDerWaalsContact C-N 3.27Å; N78-G80 WeakPolarHBondContact OD1-CA 3.47Å; N78-G80 PolarHBondContact OD1-N 2.91Å; G80-T82 PolarHBondContact O-N 3.04Å; G80-R134 PolarHBondContact O-NH2 2.87Å
81	N	68.9	Low	77	Confident	98 Å²	98	33.5 Å²	33.5	52%	0.524	18%	0.175	S	C	.	.	S	Bend	trans	58.1	27.9	-175.8	-57.7	-36.9	0	0	0	114.4	N78 Y84 H143	N78-N81 PolarHBondContact OD1-N 3.18Å; N78-N81 VanDerWaalsContact OD1-N 3.17Å; N81-Y84 WeakPolarHBondContact O-CD1 3.48Å; N81-Y84 WeakPolarHBondContact O-CE1 3.4Å; N81-H143 PolarHBondContact ND2-CE1 2.9Å; N81-H143 PolarHBondContact ND2-NE2 3.4Å
82	T	71.5	Confident	77.7	Confident	9 Å²	9	34 Å²	34	6%	0.055	18%	0.177	C	C	.	.			trans	-101.9	7.9	-177.9	64.3	0	0	0	0	113.9	N78 M79 G80 Y84 M85 N86	N78-T82 PolarHBondContact OD1-N 3.29Å; N78-T82 PolarHBondContact OD1-OG1 3.08Å; M79-T82 HydrophobicContact CB-CG2 3.76Å; M79-T82 PolarHBondContact N-OG1 3.24Å; G80-T82 PolarHBondContact O-N 3.04Å; T82-Y84 PolarHBondContact O-N 3.41Å; T82-M85 HydrophobicContact CG2-CE 4.46Å; T82-M85 WeakPolarHBondContact O-CB 3.41Å; T82-M85 PolarHBondContact O-N 3.27Å; T82-N86 PolarHBondContact O-N 2.88Å
83	C	80.6	Confident	77.9	Confident	10 Å²	10	34 Å²	34	7%	0.068	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-32.8	-179.1	52.4	0	0	0	0	112.5	M85 N86 S87 H358 D376	C83-M85 VanDerWaalsContact C-N 3.34Å; C83-M85 PolarHBondContact O-N 3.18Å; C83-N86 PolarHBondContact O-N 3.5Å; C83-S87 WeakPolarHBondContact O-CB 3.49Å; C83-S87 PolarHBondContact O-N 3.31Å; C83-S87 PolarHBondContact O-OG 3.43Å; C83-H358 WeakPolarHBondContact CB-ND1 3.43Å; C83-H358 PolarHBondContact SG-ND1 3.33Å; C83-H358 VanDerWaalsContact SG-ND1 3.38Å; C83-D376 WeakPolarHBondContact CA-OD1 3.22Å; C83-D376 WeakPolarHBondContact CB-OD1 3.41Å
84	Y	76.5	Confident	77.8	Confident	43 Å²	43	33 Å²	33	17%	0.169	17%	0.173	C	C	.	.	H	α-helix	trans	-56.5	-47.6	172.6	75.7	-85.1	0	0	0	111.8	N81 T82 S87 V88 Q146	N81-Y84 WeakPolarHBondContact O-CD1 3.48Å; N81-Y84 WeakPolarHBondContact O-CE1 3.4Å; T82-Y84 PolarHBondContact O-N 3.41Å; Y84-S87 PolarHBondContact O-OG 3.08Å; Y84-V88 WeakPolarHBondContact O-CG2 3.5Å; Y84-V88 PolarHBondContact O-N 3.34Å; Y84-Q146 HydrophobicContact CD2-CB 3.78Å; Y84-Q146 HydrophobicContact CE2-CB 3.67Å; Y84-Q146 HydrophobicContact CG-CB 4.4Å; Y84-Q146 PolarHBondContact OH-OE1 3.14Å
85	M	72.9	Confident	77.8	Confident	29 Å²	29	29.8 Å²	29.8	14%	0.143	16%	0.156	C	C	.	.	H	α-helix	trans	-68.3	-44.5	179.4	-177.6	-178.8	72.1	0	0	110.8	L27 M79 T82 C83 S87 V88 L89	L27-M85 HydrophobicContact CD2-CG 4.06Å; L27-M85 HydrophobicContact CD2-SD 3.42Å; L27-M85 WeakPolarHBondContact CD2-SD 3.47Å; M79-M85 HydrophobicContact CE-CE 4.27Å; T82-M85 HydrophobicContact CG2-CE 4.46Å; T82-M85 WeakPolarHBondContact O-CB 3.41Å; T82-M85 PolarHBondContact O-N 3.27Å; C83-M85 VanDerWaalsContact C-N 3.34Å; C83-M85 PolarHBondContact O-N 3.18Å; M85-S87 VanDerWaalsContact C-N 3.33Å; M85-S87 PolarHBondContact O-N 3.14Å; M85-V88 PolarHBondContact O-N 2.91Å; M85-L89 HydrophobicContact CG-CD1 3.91Å; M85-L89 HydrophobicContact CG-CG 4.43Å; M85-L89 VanDerWaalsContact O-CG 3.32Å; M85-L89 WeakPolarHBondContact O-CG 3.4Å; M85-L89 PolarHBondContact O-N 2.85Å
86	N	79.4	Confident	77.5	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-58.1	-46.8	178.5	-69.3	-13.3	0	0	0	110.9	L76 T82 C83 V88 L89 Q90 D376	L76-N86 HydrophobicContact CB-CB 4Å; L76-N86 HydrophobicContact CD1-CB 4.14Å; L76-N86 PolarHBondContact O-ND2 3.07Å; L76-N86 VanDerWaalsContact O-ND2 3.11Å; T82-N86 PolarHBondContact O-N 2.88Å; C83-N86 PolarHBondContact O-N 3.5Å; N86-V88 VanDerWaalsContact C-N 3.34Å; N86-V88 PolarHBondContact O-N 3.3Å; N86-L89 PolarHBondContact O-N 2.93Å; N86-Q90 WeakPolarHBondContact O-CB 3.32Å; N86-Q90 WeakPolarHBondContact O-CG 3.35Å; N86-Q90 PolarHBondContact O-N 3.18Å; N86-D376 PolarHBondContact ND2-OD1 3.08Å
87	S	84.1	Confident	77.3	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-60.5	-40.6	178.8	71.5	0	0	0	0	113.1	C83 Y84 M85 Q90 A91 A361	C83-S87 WeakPolarHBondContact O-CB 3.49Å; C83-S87 PolarHBondContact O-N 3.31Å; C83-S87 PolarHBondContact O-OG 3.43Å; Y84-S87 PolarHBondContact O-OG 3.08Å; M85-S87 VanDerWaalsContact C-N 3.33Å; M85-S87 PolarHBondContact O-N 3.14Å; S87-Q90 PolarHBondContact O-N 2.86Å; S87-A91 PolarHBondContact O-N 2.91Å; S87-A361 WeakPolarHBondContact O-CB 3.39Å
88	V	81.4	Confident	76.9	Confident	10 Å²	10	21.3 Å²	21.3	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-67.9	-45.1	177.8	172.1	0	0	0	0	111	Y84 M85 N86 Q90 A91 L92 V147 I348	Y84-V88 WeakPolarHBondContact O-CG2 3.5Å; Y84-V88 PolarHBondContact O-N 3.34Å; M85-V88 PolarHBondContact O-N 2.91Å; N86-V88 VanDerWaalsContact C-N 3.34Å; N86-V88 PolarHBondContact O-N 3.3Å; V88-Q90 VanDerWaalsContact C-N 3.31Å; V88-Q90 PolarHBondContact O-N 2.82Å; V88-A91 PolarHBondContact O-N 2.76Å; V88-L92 HydrophobicContact CG1-CD1 3.77Å; V88-L92 HydrophobicContact CG1-CG 4.21Å; V88-L92 WeakPolarHBondContact O-CB 3.12Å; V88-L92 WeakPolarHBondContact O-CG 3.46Å; V88-L92 PolarHBondContact O-N 2.76Å; V88-V147 HydrophobicContact CG2-CG1 3.69Å; V88-I348 HydrophobicContact CB-CD1 4.44Å; V88-I348 HydrophobicContact CG2-CD1 3.84Å
89	L	78	Confident	76.5	Confident	9 Å²	9	19.5 Å²	19.5	5%	0.047	11%	0.113	C	C	.	.	H	α-helix	trans	-61.7	-39.7	177.9	-70.4	169.6	0	0	0	112.2	Y30 M31 F34 L76 M85 N86 S93	Y30-L89 HydrophobicContact CD1-CD1 3.4Å; Y30-L89 HydrophobicContact CD1-CD2 4.49Å; Y30-L89 HydrophobicContact CE1-CD1 3.38Å; M31-L89 HydrophobicContact CB-CD2 3.69Å; M31-L89 HydrophobicContact CG-CD2 3.93Å; F34-L89 HydrophobicContact CD1-CB 4.34Å; F34-L89 HydrophobicContact CE1-CB 4.44Å; L76-L89 HydrophobicContact CD1-CB 3.89Å; L76-L89 HydrophobicContact CD1-CD1 3.97Å; M85-L89 HydrophobicContact CG-CD1 3.91Å; M85-L89 HydrophobicContact CG-CG 4.43Å; M85-L89 VanDerWaalsContact O-CG 3.32Å; M85-L89 WeakPolarHBondContact O-CG 3.4Å; M85-L89 PolarHBondContact O-N 2.85Å; N86-L89 PolarHBondContact O-N 2.93Å; L89-S93 VanDerWaalsContact O-CB 3.22Å; L89-S93 WeakPolarHBondContact O-CB 3.19Å; L89-S93 PolarHBondContact O-N 3.24Å; L89-S93 PolarHBondContact O-OG 2.78Å
90	Q	85.3	Confident	76.3	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.009	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-41.7	175.9	-67.4	-71	8.4	0	0	112.1	I74 L76 N86 S87 V88 S93 N94 A361 C363 F374	I74-Q90 PolarHBondContact O-NE2 3.27Å; L76-Q90 HydrophobicContact CD1-CG 4.36Å; N86-Q90 WeakPolarHBondContact O-CB 3.32Å; N86-Q90 WeakPolarHBondContact O-CG 3.35Å; N86-Q90 PolarHBondContact O-N 3.18Å; S87-Q90 PolarHBondContact O-N 2.86Å; V88-Q90 VanDerWaalsContact C-N 3.31Å; V88-Q90 PolarHBondContact O-N 2.82Å; Q90-S93 PolarHBondContact O-OG 3.43Å; Q90-S93 VanDerWaalsContact O-OG 3.09Å; Q90-N94 PolarHBondContact O-N 3.4Å; Q90-N94 PolarHBondContact O-ND2 2.8Å; Q90-A361 HydrophobicContact CB-CB 3.85Å; Q90-C363 PolarHBondContact O-SG 2.9Å; Q90-C363 VanDerWaalsContact O-SG 3.42Å; Q90-F374 HydrophobicContact CB-CB 4.1Å; Q90-F374 HydrophobicContact CB-CG 4.15Å; Q90-F374 HydrophobicContact CG-CB 3.72Å; Q90-F374 HydrophobicContact CG-CD1 4.05Å; Q90-F374 HydrophobicContact CG-CG 3.96Å
91	A	87	Confident	76.2	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64	-50.1	176.2	0	0	0	0	0	111	S87 V88 S93 N94 C95 A346 I348 F396	S87-A91 PolarHBondContact O-N 2.91Å; V88-A91 PolarHBondContact O-N 2.76Å; A91-S93 PolarHBondContact O-N 2.72Å; A91-N94 PolarHBondContact O-N 2.9Å; A91-N94 VanDerWaalsContact O-N 3.15Å; A91-C95 PolarHBondContact O-N 3.12Å; A91-C95 PolarHBondContact O-SG 3.42Å; A91-C95 VanDerWaalsContact O-SG 3.37Å; A91-A346 HydrophobicContact CB-CB 3.79Å; A91-I348 HydrophobicContact CB-CD1 4.05Å; A91-I348 HydrophobicContact CB-CG1 4.16Å; A91-F396 HydrophobicContact CB-CD2 3.8Å; A91-F396 HydrophobicContact CB-CE2 3.51Å; A91-F396 HydrophobicContact CB-CZ 4.15Å
92	L	79.9	Confident	75.8	Confident	10 Å²	10	13.6 Å²	13.6	5%	0.052	7%	0.07	C	C	.	.	H	α-helix	trans	-65.5	-36.4	179.9	-67.8	176.5	0	0	0	113	M31 V88 N94 C95 L98 M154 F192 F396	M31-L92 HydrophobicContact CE-CB 3.46Å; M31-L92 VanDerWaalsContact CE-CB 3.46Å; M31-L92 HydrophobicContact CE-CD1 3.95Å; M31-L92 HydrophobicContact CE-CG 4.29Å; M31-L92 HydrophobicContact SD-CB 4.47Å; M31-L92 HydrophobicContact SD-CD1 4.04Å; V88-L92 HydrophobicContact CG1-CD1 3.77Å; V88-L92 HydrophobicContact CG1-CG 4.21Å; V88-L92 WeakPolarHBondContact O-CB 3.12Å; V88-L92 WeakPolarHBondContact O-CG 3.46Å; V88-L92 PolarHBondContact O-N 2.76Å; L92-N94 PolarHBondContact O-N 3.08Å; L92-C95 WeakPolarHBondContact O-CB 3.48Å; L92-C95 PolarHBondContact O-N 2.7Å; L92-C95 VanDerWaalsContact O-N 3.16Å; L92-L98 HydrophobicContact CB-CD2 4.13Å; L92-L98 HydrophobicContact CD2-CD2 4.07Å; L92-M154 HydrophobicContact CD1-CE 4.48Å; L92-M154 HydrophobicContact CD1-SD 4.45Å; L92-M154 HydrophobicContact CD2-SD 4.2Å; L92-F192 HydrophobicContact CD2-CZ 3.85Å; L92-F396 HydrophobicContact CD2-CE1 3.8Å; L92-F396 HydrophobicContact CD2-CZ 4.22Å
93	S	75	Confident	75.2	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-70.5	-18.5	176.1	71.1	0	0	0	0	113.5	F34 F39 L89 Q90 A91 T99	F34-S93 WeakPolarHBondContact CE1-OG 3.39Å; F39-S93 WeakPolarHBondContact CE2-O 3.49Å; F39-S93 WeakPolarHBondContact CZ-O 3.37Å; L89-S93 VanDerWaalsContact O-CB 3.22Å; L89-S93 WeakPolarHBondContact O-CB 3.19Å; L89-S93 PolarHBondContact O-N 3.24Å; L89-S93 PolarHBondContact O-OG 2.78Å; Q90-S93 PolarHBondContact O-OG 3.43Å; Q90-S93 VanDerWaalsContact O-OG 3.09Å; A91-S93 PolarHBondContact O-N 2.72Å; S93-T99 PolarHBondContact O-OG1 3.15Å
94	N	78.7	Confident	74.1	Confident	7 Å²	7	19 Å²	19	4%	0.037	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	4	174.1	-76.7	-86.2	0	0	0	112.2	Q90 A91 L92 P96 C363	Q90-N94 PolarHBondContact O-N 3.4Å; Q90-N94 PolarHBondContact O-ND2 2.8Å; A91-N94 PolarHBondContact O-N 2.9Å; A91-N94 VanDerWaalsContact O-N 3.15Å; L92-N94 PolarHBondContact O-N 3.08Å; N94-P96 WeakPolarHBondContact O-CD 3.37Å; N94-C363 HydrophobicContact CB-CB 3.62Å
95	C	79.4	Confident	73.1	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.			trans	-79.1	105.5	168.5	-65.6	0	0	0	0	110.1	A91 L92 P97 L98 T99 V304 I345	A91-C95 PolarHBondContact O-N 3.12Å; A91-C95 PolarHBondContact O-SG 3.42Å; A91-C95 VanDerWaalsContact O-SG 3.37Å; L92-C95 WeakPolarHBondContact O-CB 3.48Å; L92-C95 PolarHBondContact O-N 2.7Å; L92-C95 VanDerWaalsContact O-N 3.16Å; C95-P97 VanDerWaalsContact C-CD 3.43Å; C95-L98 HydrophobicContact CB-CB 4.03Å; C95-L98 PolarHBondContact O-N 3.39Å; C95-L98 VanDerWaalsContact O-N 3.11Å; C95-T99 WeakPolarHBondContact O-CB 3.12Å; C95-T99 PolarHBondContact O-N 3.4Å; C95-T99 PolarHBondContact O-OG1 3.17Å; C95-V304 HydrophobicContact CB-CG2 4.48Å; C95-I345 HydrophobicContact CB-CD1 4.11Å; C95-I345 VanDerWaalsContact SG-CD1 3.54Å
96	P	76.9	Confident	72.2	Confident	37 Å²	37	17.5 Å²	17.5	24%	0.24	9%	0.087	C	C	.	.	H	α-helix	trans	-54.2	-43.6	-174.6	-22.8	32.9	0	0	0	115.9	N94 L98 T99 E100 H366	N94-P96 WeakPolarHBondContact O-CD 3.37Å; P96-L98 VanDerWaalsContact C-N 3.31Å; P96-L98 PolarHBondContact O-N 3.32Å; P96-T99 PolarHBondContact O-N 3.13Å; P96-E100 VanDerWaalsContact O-CB 3.31Å; P96-E100 WeakPolarHBondContact O-CB 3.44Å; P96-E100 PolarHBondContact O-N 3.33Å; P96-H366 WeakPolarHBondContact CG-CD2 3.48Å; P96-H366 VanDerWaalsContact CG-NE2 3.28Å; P96-H366 WeakPolarHBondContact CG-NE2 3.35Å
97	P	72.1	Confident	70.9	Confident	3 Å²	3	18.6 Å²	18.6	2%	0.019	9%	0.093	C	C	.	.	H	α-helix	trans	-58.2	-44.5	177.4	-17.2	23	0	0	0	112.6	C95 F101 I191 S303 V304 L407	C95-P97 VanDerWaalsContact C-CD 3.43Å; P97-F101 WeakPolarHBondContact O-CB 3.47Å; P97-F101 PolarHBondContact O-N 3.35Å; P97-I191 HydrophobicContact CB-CD1 4.13Å; P97-I191 HydrophobicContact CB-CG1 4.03Å; P97-I191 HydrophobicContact CB-CG2 4.44Å; P97-S303 WeakPolarHBondContact CB-OG 3.33Å; P97-S303 VanDerWaalsContact CG-OG 3.27Å; P97-S303 WeakPolarHBondContact CG-OG 3.32Å; P97-V304 HydrophobicContact CG-CG2 4.1Å; P97-L407 HydrophobicContact CB-CD1 3.94Å; P97-L407 HydrophobicContact CB-CD2 3.72Å; P97-L407 HydrophobicContact CG-CD1 3.96Å; P97-L407 HydrophobicContact CG-CD2 4.43Å
98	L	72.2	Confident	69.3	Low	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-72.7	-42.3	-177.9	-174.4	53.5	0	0	0	110.6	M31 L92 C95 P96 E100 F101 M102 L188 I191 F192	M31-L98 HydrophobicContact CE-CD2 3.39Å; M31-L98 HydrophobicContact CE-CG 3.89Å; L92-L98 HydrophobicContact CB-CD2 4.13Å; L92-L98 HydrophobicContact CD2-CD2 4.07Å; C95-L98 HydrophobicContact CB-CB 4.03Å; C95-L98 PolarHBondContact O-N 3.39Å; C95-L98 VanDerWaalsContact O-N 3.11Å; P96-L98 VanDerWaalsContact C-N 3.31Å; P96-L98 PolarHBondContact O-N 3.32Å; L98-E100 VanDerWaalsContact C-N 3.34Å; L98-E100 PolarHBondContact O-N 2.73Å; L98-F101 HydrophobicContact CD1-CD1 4.49Å; L98-F101 PolarHBondContact O-N 3.2Å; L98-M102 HydrophobicContact CD1-CE 3.71Å; L98-M102 HydrophobicContact CD1-CG 4.28Å; L98-M102 HydrophobicContact CG-CE 4.4Å; L98-M102 HydrophobicContact CG-CG 4.48Å; L98-M102 WeakPolarHBondContact O-CB 3.28Å; L98-M102 WeakPolarHBondContact O-CG 3.47Å; L98-M102 PolarHBondContact O-N 2.92Å; L98-L188 HydrophobicContact CD1-CD2 3.66Å; L98-I191 HydrophobicContact CB-CD1 4.21Å; L98-I191 HydrophobicContact CD1-CD1 4.12Å; L98-F192 HydrophobicContact CD2-CE2 4Å; L98-F192 HydrophobicContact CD2-CZ 4.14Å
99	T	67.5	Low	67.7	Low	13 Å²	13	21.2 Å²	21.2	8%	0.08	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-43.2	175.5	-67.2	0	0	0	0	112	V35 F39 S93 C95 P96 M102 R103	V35-T99 HydrophobicContact CG1-CG2 4Å; F39-T99 HydrophobicContact CD1-CG2 4.06Å; F39-T99 HydrophobicContact CD2-CG2 3.41Å; F39-T99 VanDerWaalsContact CD2-CG2 3.41Å; F39-T99 HydrophobicContact CE1-CG2 4.07Å; F39-T99 HydrophobicContact CE2-CG2 3.46Å; F39-T99 VanDerWaalsContact CE2-CG2 3.46Å; F39-T99 HydrophobicContact CG-CG2 3.76Å; F39-T99 HydrophobicContact CZ-CG2 3.8Å; S93-T99 PolarHBondContact O-OG1 3.15Å; C95-T99 WeakPolarHBondContact O-CB 3.12Å; C95-T99 PolarHBondContact O-N 3.4Å; C95-T99 PolarHBondContact O-OG1 3.17Å; P96-T99 PolarHBondContact O-N 3.13Å; T99-M102 PolarHBondContact O-N 3.43Å; T99-R103 VanDerWaalsContact O-CB 3.3Å; T99-R103 WeakPolarHBondContact O-CB 3.18Å; T99-R103 PolarHBondContact O-N 2.77Å
100	E	67	Low	66.2	Low	70 Å²	70	22.4 Å²	22.4	33%	0.327	12%	0.119	S	C	.	.	H	α-helix	trans	-67.4	-44	177.4	-176.8	57.8	-166.4	0	0	111.4	P96 L98 M102 R103 V104	P96-E100 VanDerWaalsContact O-CB 3.31Å; P96-E100 WeakPolarHBondContact O-CB 3.44Å; P96-E100 PolarHBondContact O-N 3.33Å; L98-E100 VanDerWaalsContact C-N 3.34Å; L98-E100 PolarHBondContact O-N 2.73Å; E100-M102 PolarHBondContact O-N 2.82Å; E100-R103 WeakPolarHBondContact O-CB 3.49Å; E100-R103 PolarHBondContact O-N 3.13Å; E100-R103 IonicContact OE1-CZ 3.72Å; E100-R103 IonicContact OE1-NE 3.46Å; E100-R103 PolarHBondContact OE1-NE 3.07Å; E100-R103 IonicContact OE1-NH2 3.63Å; E100-R103 PolarHBondContact OE1-NH2 3.4Å; E100-R103 IonicContact OE2-CZ 3.62Å; E100-R103 IonicContact OE2-NE 2.63Å; E100-R103 PolarHBondContact OE2-NE 3.47Å; E100-R103 IonicContact OE2-NH2 3.32Å; E100-V104 WeakPolarHBondContact O-CG2 3.25Å; E100-V104 PolarHBondContact O-N 3.47Å
101	F	65.2	Low	64.4	Low	28 Å²	28	26.9 Å²	26.9	12%	0.123	14%	0.141	C	C	.	.	H	α-helix	trans	-55.6	-51.4	173.3	175.2	-102.5	0	0	0	111.6	P97 L98 R103 V104 C105 A187	P97-F101 WeakPolarHBondContact O-CB 3.47Å; P97-F101 PolarHBondContact O-N 3.35Å; L98-F101 HydrophobicContact CD1-CD1 4.49Å; L98-F101 PolarHBondContact O-N 3.2Å; F101-R103 VanDerWaalsContact C-N 3.3Å; F101-R103 PolarHBondContact O-N 3.38Å; F101-V104 PolarHBondContact O-N 3.44Å; F101-C105 WeakPolarHBondContact CZ-SG 3.37Å; F101-C105 PolarHBondContact O-N 3.45Å; F101-C105 PolarHBondContact O-SG 3.17Å; F101-A187 HydrophobicContact CD1-CB 3.96Å; F101-A187 HydrophobicContact CD2-CB 3.5Å; F101-A187 VanDerWaalsContact CD2-CB 3.5Å; F101-A187 HydrophobicContact CE1-CB 3.75Å; F101-A187 HydrophobicContact CE2-CB 3.27Å; F101-A187 HydrophobicContact CG-CB 3.85Å; F101-A187 HydrophobicContact CZ-CB 3.4Å; F101-A187 VanDerWaalsContact CZ-CB 3.4Å
102	M	61.7	Low	62.3	Low	1 Å²	1	32 Å²	32	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-38.3	178.6	-68.9	-71.4	179.8	0	0	112.2	F28 M31 L32 V35 L98 T99 E100 C105 W106	F28-M102 HydrophobicContact CD2-CE 4.07Å; F28-M102 HydrophobicContact CE2-CE 3.45Å; F28-M102 VanDerWaalsContact CE2-CE 3.45Å; F28-M102 HydrophobicContact CE2-SD 3.88Å; F28-M102 HydrophobicContact CZ-CE 4.11Å; F28-M102 HydrophobicContact CZ-SD 3.9Å; M31-M102 HydrophobicContact CE-CE 4.13Å; M31-M102 HydrophobicContact SD-CE 4.26Å; L32-M102 HydrophobicContact CB-SD 4.44Å; L32-M102 HydrophobicContact CD1-CB 4.11Å; L32-M102 HydrophobicContact CD1-CG 4.48Å; L32-M102 HydrophobicContact CD1-SD 3.62Å; V35-M102 HydrophobicContact CB-CB 4.37Å; V35-M102 HydrophobicContact CG1-CB 3.76Å; V35-M102 HydrophobicContact CG1-CG 4.35Å; L98-M102 HydrophobicContact CD1-CE 3.71Å; L98-M102 HydrophobicContact CD1-CG 4.28Å; L98-M102 HydrophobicContact CG-CE 4.4Å; L98-M102 HydrophobicContact CG-CG 4.48Å; L98-M102 WeakPolarHBondContact O-CB 3.28Å; L98-M102 WeakPolarHBondContact O-CG 3.47Å; L98-M102 PolarHBondContact O-N 2.92Å; T99-M102 PolarHBondContact O-N 3.43Å; E100-M102 PolarHBondContact O-N 2.82Å; M102-C105 PolarHBondContact O-N 2.68Å; M102-W106 VanDerWaalsContact O-CB 3.32Å; M102-W106 WeakPolarHBondContact O-CB 3.32Å; M102-W106 PolarHBondContact O-N 3.32Å
103	R	59.4	Low	60.3	Low	96 Å²	96	35.7 Å²	35.7	36%	0.362	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-43.8	176.2	-169.8	-170.1	73.5	77.4	5.6	111.5	T99 E100 F101 W106 N107	T99-R103 VanDerWaalsContact O-CB 3.3Å; T99-R103 WeakPolarHBondContact O-CB 3.18Å; T99-R103 PolarHBondContact O-N 2.77Å; E100-R103 WeakPolarHBondContact O-CB 3.49Å; E100-R103 PolarHBondContact O-N 3.13Å; E100-R103 IonicContact OE1-CZ 3.72Å; E100-R103 IonicContact OE1-NE 3.46Å; E100-R103 PolarHBondContact OE1-NE 3.07Å; E100-R103 IonicContact OE1-NH2 3.63Å; E100-R103 PolarHBondContact OE1-NH2 3.4Å; E100-R103 IonicContact OE2-CZ 3.62Å; E100-R103 IonicContact OE2-NE 2.63Å; E100-R103 PolarHBondContact OE2-NE 3.47Å; E100-R103 IonicContact OE2-NH2 3.32Å; F101-R103 VanDerWaalsContact C-N 3.3Å; F101-R103 PolarHBondContact O-N 3.38Å; R103-W106 PolarHBondContact O-N 2.85Å; R103-N107 PolarHBondContact NH1-ND2 3.34Å; R103-N107 VanDerWaalsContact O-CG 3.29Å; R103-N107 PolarHBondContact O-N 3.42Å; R103-N107 VanDerWaalsContact O-N 3.11Å; R103-N107 PolarHBondContact O-ND2 3.25Å; R103-N107 VanDerWaalsContact O-ND2 3.11Å
104	V	57.5	Low	58.8	Low	37 Å²	37	43 Å²	43	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-49.4	176.2	171.4	0	0	0	0	110.3	E100 F101 W106 N107 A108	E100-V104 WeakPolarHBondContact O-CG2 3.25Å; E100-V104 PolarHBondContact O-N 3.47Å; F101-V104 PolarHBondContact O-N 3.44Å; V104-W106 VanDerWaalsContact C-N 3.33Å; V104-W106 PolarHBondContact O-N 3.24Å; V104-N107 PolarHBondContact O-N 2.95Å; V104-A108 PolarHBondContact O-N 3.28Å
105	C	54.1	Low	57	Low	19 Å²	19	47.4 Å²	47.4	13%	0.128	24%	0.235	C	C	.	.	H	α-helix	trans	-57.4	-44.9	177.2	-68	0	0	0	0	112.2	F101 M102 N107 A108 C109 Y180	F101-C105 WeakPolarHBondContact CZ-SG 3.37Å; F101-C105 PolarHBondContact O-N 3.45Å; F101-C105 PolarHBondContact O-SG 3.17Å; M102-C105 PolarHBondContact O-N 2.68Å; C105-N107 PolarHBondContact O-N 2.94Å; C105-A108 PolarHBondContact O-N 2.65Å; C105-C109 PolarHBondContact O-N 3.07Å; C105-C109 VanDerWaalsContact O-N 3.12Å; C105-C109 PolarHBondContact O-SG 3.38Å; C105-C109 VanDerWaalsContact O-SG 3.37Å; C105-Y180 HydrophobicContact CB-CE2 4.28Å
106	W	53.5	Low	55.1	Low	21 Å²	21	51.1 Å²	51.1	8%	0.08	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-43.8	179	178.1	-89.4	0	0	0	113.5	L32 V36 K40 M102 R103 V104 A108 C109 V110 I123	L32-W106 HydrophobicContact CD1-CB 4.5Å; L32-W106 HydrophobicContact CD2-CE3 4.08Å; L32-W106 HydrophobicContact CG-CE3 4.01Å; V36-W106 HydrophobicContact CB-CB 4.43Å; V36-W106 HydrophobicContact CB-CD2 3.97Å; V36-W106 HydrophobicContact CB-CE3 4.18Å; V36-W106 HydrophobicContact CB-CG 4Å; V36-W106 HydrophobicContact CG1-CB 4.27Å; V36-W106 VanDerWaalsContact CG1-CD1 3.47Å; V36-W106 HydrophobicContact CG1-CD2 3.43Å; V36-W106 VanDerWaalsContact CG1-CD2 3.43Å; V36-W106 HydrophobicContact CG1-CE3 4.06Å; V36-W106 HydrophobicContact CG1-CG 3.43Å; V36-W106 VanDerWaalsContact CG1-CG 3.43Å; V36-W106 HydrophobicContact CG1-CZ2 4.33Å; V36-W106 HydrophobicContact CG2-CB 3.31Å; V36-W106 HydrophobicContact CG2-CD2 3.63Å; V36-W106 HydrophobicContact CG2-CE3 3.79Å; V36-W106 HydrophobicContact CG2-CG 3.37Å; K40-W106 VanDerWaalsContact NZ-CE2 3.29Å; M102-W106 VanDerWaalsContact O-CB 3.32Å; M102-W106 WeakPolarHBondContact O-CB 3.32Å; M102-W106 PolarHBondContact O-N 3.32Å; R103-W106 PolarHBondContact O-N 2.85Å; V104-W106 VanDerWaalsContact C-N 3.33Å; V104-W106 PolarHBondContact O-N 3.24Å; W106-A108 VanDerWaalsContact C-N 3.27Å; W106-A108 PolarHBondContact O-N 3.36Å; W106-C109 WeakPolarHBondContact O-CB 3.26Å; W106-C109 PolarHBondContact O-N 3.26Å; W106-V110 HydrophobicContact CD2-CG2 4.29Å; W106-V110 HydrophobicContact CZ2-CG2 3.6Å; W106-V110 PolarHBondContact O-N 2.92Å; W106-I123 HydrophobicContact CH2-CD1 3.73Å; W106-I123 HydrophobicContact CZ3-CD1 3.56Å
107	N	53	Low	53.3	Low	25 Å²	25	58.1 Å²	58.1	13%	0.134	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-39.1	179.5	-69.3	-32.7	0	0	0	111	R43 R103 V104 C105 C109 V110 E111	R43-N107 PolarHBondContact NH1-OD1 2.89Å; R103-N107 PolarHBondContact NH1-ND2 3.34Å; R103-N107 VanDerWaalsContact O-CG 3.29Å; R103-N107 PolarHBondContact O-N 3.42Å; R103-N107 VanDerWaalsContact O-N 3.11Å; R103-N107 PolarHBondContact O-ND2 3.25Å; R103-N107 VanDerWaalsContact O-ND2 3.11Å; V104-N107 PolarHBondContact O-N 2.95Å; C105-N107 PolarHBondContact O-N 2.94Å; N107-C109 VanDerWaalsContact C-N 3.26Å; N107-C109 PolarHBondContact O-N 2.71Å; N107-V110 PolarHBondContact O-N 2.87Å; N107-E111 WeakPolarHBondContact O-CG 3.42Å; N107-E111 PolarHBondContact O-N 3.33Å; N107-E111 VanDerWaalsContact O-N 3.12Å
108	A	50.3	Low	51.7	Low	18 Å²	18	65.2 Å²	65.2	15%	0.149	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-29.7	173.8	0	0	0	0	0	113.2	V104 C105 W106 F418	V104-A108 PolarHBondContact O-N 3.28Å; C105-A108 PolarHBondContact O-N 2.65Å; W106-A108 VanDerWaalsContact C-N 3.27Å; W106-A108 PolarHBondContact O-N 3.36Å; A108-F418 HydrophobicContact CB-CE1 3.96Å; A108-F418 HydrophobicContact CB-CZ 4.36Å
109	C	47.6	Very low	49.9	Very low	50 Å²	50	73.2 Å²	73.2	34%	0.338	35%	0.35	S	S	.	.	H	α-helix	trans	-74.7	-45.9	173.7	-68.2	0	0	0	0	112.5	C105 W106 N107 K112 E113	C105-C109 PolarHBondContact O-N 3.07Å; C105-C109 VanDerWaalsContact O-N 3.12Å; C105-C109 PolarHBondContact O-SG 3.38Å; C105-C109 VanDerWaalsContact O-SG 3.37Å; W106-C109 WeakPolarHBondContact O-CB 3.26Å; W106-C109 PolarHBondContact O-N 3.26Å; N107-C109 VanDerWaalsContact C-N 3.26Å; N107-C109 PolarHBondContact O-N 2.71Å; C109-K112 WeakPolarHBondContact O-CB 3.44Å; C109-K112 PolarHBondContact O-N 3.25Å; C109-K112 VanDerWaalsContact O-N 3.15Å; C109-E113 PolarHBondContact O-N 2.8Å
110	V	46.8	Very low	48.1	Very low	33 Å²	33	77 Å²	77	20%	0.2	38%	0.377	C	S	.	.	H	α-helix	trans	-67.6	-37.8	-176.7	170.7	0	0	0	0	112.7	W106 N107 K112 E113 E114	W106-V110 HydrophobicContact CD2-CG2 4.29Å; W106-V110 HydrophobicContact CZ2-CG2 3.6Å; W106-V110 PolarHBondContact O-N 2.92Å; N107-V110 PolarHBondContact O-N 2.87Å; V110-K112 PolarHBondContact O-N 2.68Å; V110-K112 VanDerWaalsContact O-N 3.1Å; V110-E113 PolarHBondContact O-N 2.85Å; V110-E114 PolarHBondContact O-N 3.32Å
111	E	47	Very low	46.2	Very low	97 Å²	97	78.5 Å²	78.5	45%	0.453	39%	0.391	S	S	.	.	H	α-helix	trans	-62.5	-18.9	176.8	-73	167.8	-163.9	0	0	112.1	R43 N107	R43-E111 IonicContact NH2-OE1 2.82Å; R43-E111 PolarHBondContact NH2-OE1 3.21Å; N107-E111 WeakPolarHBondContact O-CG 3.42Å; N107-E111 PolarHBondContact O-N 3.33Å; N107-E111 VanDerWaalsContact O-N 3.12Å
112	K	42.9	Very low	44.7	Very low	106 Å²	106	80.3 Å²	80.3	46%	0.461	41%	0.406	S	S	.	.	H	α-helix	trans	-85.4	-34.3	170.5	-67.2	-179.5	178.5	-179.1	0	113.5	C109 V110 M115 D116	C109-K112 WeakPolarHBondContact O-CB 3.44Å; C109-K112 PolarHBondContact O-N 3.25Å; C109-K112 VanDerWaalsContact O-N 3.15Å; V110-K112 PolarHBondContact O-N 2.68Å; V110-K112 VanDerWaalsContact O-N 3.1Å; K112-M115 PolarHBondContact O-N 2.65Å; K112-D116 PolarHBondContact O-N 3.01Å
113	E	39.5	Very low	43.3	Very low	88 Å²	88	82.4 Å²	82.4	41%	0.411	42%	0.417	S	S	.	.	H	α-helix	trans	-67.3	-34.8	178.3	-73.9	-170.6	151.4	0	0	112.8	C109 V110 M115 D116	C109-E113 PolarHBondContact O-N 2.8Å; V110-E113 PolarHBondContact O-N 2.85Å; E113-M115 PolarHBondContact O-N 3.42Å; E113-D116 PolarHBondContact O-N 2.83Å
114	E	43	Very low	41.8	Very low	155 Å²	155	81.7 Å²	81.7	72%	0.724	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.4	175.4	-77.7	-169	155.3	0	0	113.3	V110	V110-E114 PolarHBondContact O-N 3.32Å
115	M	40.8	Very low	40.5	Very low	98 Å²	98	82.3 Å²	82.3	48%	0.483	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-19	175.8	-96.8	-175.4	57	0	0	114.1	K112 E113 K455	K112-M115 PolarHBondContact O-N 2.65Å; E113-M115 PolarHBondContact O-N 3.42Å; M115-K455 PolarHBondContact SD-NZ 2.96Å
116	D	39.5	Very low	39.6	Very low	78 Å²	78	83.9 Å²	83.9	42%	0.417	44%	0.443	S	S	.	.			trans	-130.5	74.3	-173.8	-155.7	-1.1	0	0	0	111.2	K112 E113 N118 R119	K112-D116 PolarHBondContact O-N 3.01Å; E113-D116 PolarHBondContact O-N 2.83Å; D116-N118 PolarHBondContact O-N 2.87Å; D116-R119 PolarHBondContact O-N 2.72Å; D116-R119 VanDerWaalsContact O-N 3.13Å; D116-R119 WeakPolarHBondContact OD2-CD 3.34Å
117	K	39.7	Very low	38.5	Very low	184 Å²	184	87.6 Å²	87.6	80%	0.8	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-3.3	-174.3	-72.7	-177.7	177.4	176.4	0	115.4
118	N	37.2	Very low	37.2	Very low	153 Å²	153	96.5 Å²	96.5	82%	0.818	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	6.3	-179.6	-88.1	-8.3	0	0	0	115.1	D116	D116-N118 PolarHBondContact O-N 2.87Å
119	R	35.1	Very low	36.3	Very low	167 Å²	167	98.4 Å²	98.4	63%	0.63	50%	0.502	S	S	*	.			trans	-119	15.4	-180	-97.3	-173.1	-172.1	-169.4	4.2	115.6	D116 V121	D116-R119 PolarHBondContact O-N 2.72Å; D116-R119 VanDerWaalsContact O-N 3.13Å; D116-R119 WeakPolarHBondContact OD2-CD 3.34Å; R119-V121 PolarHBondContact O-N 3.23Å
120	S	28.6	Very low	35.6	Very low	93 Å²	93	98.3 Å²	98.3	65%	0.65	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	31	178.1	46.1	0	0	0	0	115.5
121	V	27.3	Very low	34.6	Very low	101 Å²	101	102 Å²	102	61%	0.612	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-14.4	-170.8	173.5	0	0	0	0	113.4	R119 S125	R119-V121 PolarHBondContact O-N 3.23Å; V121-S125 VanDerWaalsContact O-CB 3.28Å; V121-S125 WeakPolarHBondContact O-CB 3.4Å; V121-S125 PolarHBondContact O-OG 2.9Å
122	C	35	Very low	33.6	Very low	66 Å²	66	100.3 Å²	100.3	45%	0.446	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-9	-148.6	-142.2	0	0	0	0	119.6	E126	C122-E126 WeakPolarHBondContact O-CG 3.28Å
123	I	31.2	Very low	33.1	Very low	45 Å²	45	96.8 Å²	96.8	23%	0.231	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-33.7	175.6	-61.7	175.4	0	0	0	112.3	W106 S125 E126 F127	W106-I123 HydrophobicContact CH2-CD1 3.73Å; W106-I123 HydrophobicContact CZ3-CD1 3.56Å; I123-S125 VanDerWaalsContact C-N 3.33Å; I123-S125 PolarHBondContact O-N 2.83Å; I123-E126 PolarHBondContact O-N 2.89Å; I123-F127 PolarHBondContact O-N 2.81Å
124	A	27.4	Very low	32.6	Very low	82 Å²	82	97.5 Å²	97.5	68%	0.678	50%	0.499	S	S	*	.	H	α-helix	trans	-71.5	-26.3	174.7	0	0	0	0	0	113.1	F127	A124-F127 WeakPolarHBondContact O-CB 3.33Å
125	S	30	Very low	32	Very low	49 Å²	49	97.1 Å²	97.1	34%	0.343	50%	0.501	S	S	.	.	H	α-helix	trans	-73.8	-35	173.6	58.5	0	0	0	0	112.3	V121 I123 F127 R128 T129	V121-S125 VanDerWaalsContact O-CB 3.28Å; V121-S125 WeakPolarHBondContact O-CB 3.4Å; V121-S125 PolarHBondContact O-OG 2.9Å; I123-S125 VanDerWaalsContact C-N 3.33Å; I123-S125 PolarHBondContact O-N 2.83Å; S125-F127 PolarHBondContact O-N 3.3Å; S125-R128 PolarHBondContact O-N 2.95Å; S125-R128 VanDerWaalsContact O-N 3.14Å; S125-T129 PolarHBondContact O-N 3.31Å; S125-T129 PolarHBondContact O-OG1 2.88Å
126	E	37.2	Very low	31.6	Very low	52 Å²	52	96.1 Å²	96.1	24%	0.243	50%	0.504	C	S	.	.	H	α-helix	trans	-61.3	-33.6	173.5	-67.1	172.7	160.5	0	0	111.5	S29 C122 I123 R128 T129 L130	S29-E126 WeakPolarHBondContact CB-OE2 3.04Å; S29-E126 PolarHBondContact OG-OE2 3.2Å; C122-E126 WeakPolarHBondContact O-CG 3.28Å; I123-E126 PolarHBondContact O-N 2.89Å; E126-R128 PolarHBondContact O-N 3.44Å; E126-T129 PolarHBondContact O-N 3.22Å; E126-L130 PolarHBondContact O-N 3.46Å
127	F	28.5	Very low	31.4	Very low	99 Å²	99	95.9 Å²	95.9	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-64.7	-33.5	174.6	-120.5	-92.7	0	0	0	114.2	Y30 I123 A124 S125 L130 L131	Y30-F127 HydrophobicContact CD2-CE2 4.25Å; Y30-F127 HydrophobicContact CD2-CZ 4.42Å; Y30-F127 HydrophobicContact CE2-CE2 4.39Å; Y30-F127 HydrophobicContact CE2-CZ 4.15Å; I123-F127 PolarHBondContact O-N 2.81Å; A124-F127 WeakPolarHBondContact O-CB 3.33Å; S125-F127 PolarHBondContact O-N 3.3Å; F127-L130 WeakPolarHBondContact O-CB 3.39Å; F127-L131 PolarHBondContact O-N 3.05Å
128	R	27	Very low	31	Very low	212 Å²	212	91.7 Å²	91.7	80%	0.8	49%	0.492	S	S	*	.	H	α-helix	trans	-71.3	-36.7	174.9	-100.7	-177.4	-178.2	161.7	2	111.9	S125 E126 L130 L131 S132	S125-R128 PolarHBondContact O-N 2.95Å; S125-R128 VanDerWaalsContact O-N 3.14Å; E126-R128 PolarHBondContact O-N 3.44Å; R128-L130 VanDerWaalsContact C-N 3.34Å; R128-L131 PolarHBondContact O-N 2.8Å; R128-S132 PolarHBondContact O-N 2.83Å
129	T	30.4	Very low	30.9	Very low	59 Å²	59	86.8 Å²	86.8	36%	0.362	48%	0.477	S	S	.	.	H	α-helix	trans	-67.8	-35.9	175.4	-53.7	0	0	0	0	111.5	S125 E126 L131 S132 I133	S125-T129 PolarHBondContact O-N 3.31Å; S125-T129 PolarHBondContact O-OG1 2.88Å; E126-T129 PolarHBondContact O-N 3.22Å; T129-L131 PolarHBondContact O-N 3.23Å; T129-S132 PolarHBondContact O-N 3.21Å; T129-S132 PolarHBondContact O-OG 3.41Å; T129-I133 HydrophobicContact CG2-CD1 3.78Å; T129-I133 HydrophobicContact CG2-CG1 4.47Å; T129-I133 WeakPolarHBondContact O-CD1 3.48Å; T129-I133 WeakPolarHBondContact O-CG1 3.26Å; T129-I133 PolarHBondContact O-N 3.49Å
130	L	32.5	Very low	31	Very low	47 Å²	47	82.7 Å²	82.7	25%	0.246	46%	0.464	C	S	.	.	H	α-helix	trans	-57.4	-45.1	172.4	-115	156.2	0	0	0	113.1	I26 E126 F127 R128 R134	I26-L130 HydrophobicContact CG2-CD1 3.61Å; I26-L130 HydrophobicContact CG2-CD2 3.61Å; I26-L130 HydrophobicContact CG2-CG 3.38Å; E126-L130 PolarHBondContact O-N 3.46Å; F127-L130 WeakPolarHBondContact O-CB 3.39Å; R128-L130 VanDerWaalsContact C-N 3.34Å; L130-R134 WeakPolarHBondContact O-CB 3.47Å; L130-R134 PolarHBondContact O-N 2.79Å
131	L	27	Very low	31.3	Very low	112 Å²	112	87.7 Å²	87.7	59%	0.586	47%	0.469	S	S	*	.	H	α-helix	trans	-68.9	-35.2	178.2	-96.3	144.9	0	0	0	112.6	F127 R128 T129 L135	F127-L131 PolarHBondContact O-N 3.05Å; R128-L131 PolarHBondContact O-N 2.8Å; T129-L131 PolarHBondContact O-N 3.23Å; L131-L135 WeakPolarHBondContact O-CD1 3.11Å; L131-L135 WeakPolarHBondContact O-CG 3.45Å; L131-L135 PolarHBondContact O-N 3.4Å
132	S	26.8	Very low	31.7	Very low	61 Å²	61	87.6 Å²	87.6	43%	0.427	47%	0.468	S	S	.	.	H	α-helix	trans	-73.5	-39.8	178.9	64.5	0	0	0	0	112.5	R128 T129 L135 S136	R128-S132 PolarHBondContact O-N 2.83Å; T129-S132 PolarHBondContact O-N 3.21Å; T129-S132 PolarHBondContact O-OG 3.41Å; S132-L135 PolarHBondContact O-N 3.16Å; S132-S136 WeakPolarHBondContact O-CB 3.36Å; S132-S136 PolarHBondContact O-N 3.3Å; S132-S136 PolarHBondContact O-OG 3.44Å
133	I	31.8	Very low	32.2	Very low	32 Å²	32	88.7 Å²	88.7	16%	0.164	47%	0.467	C	S	.	.	H	α-helix	trans	-67	-40.9	179.9	-67.7	164.2	0	0	0	111.2	L22 I26 T129 L135 S136 H137 F140	L22-I133 HydrophobicContact CD2-CD1 3.49Å; L22-I133 VanDerWaalsContact CD2-CD1 3.49Å; L22-I133 HydrophobicContact CG-CD1 4.13Å; I26-I133 HydrophobicContact CD1-CD1 3.5Å; I26-I133 VanDerWaalsContact CD1-CD1 3.5Å; T129-I133 HydrophobicContact CG2-CD1 3.78Å; T129-I133 HydrophobicContact CG2-CG1 4.47Å; T129-I133 WeakPolarHBondContact O-CD1 3.48Å; T129-I133 WeakPolarHBondContact O-CG1 3.26Å; T129-I133 PolarHBondContact O-N 3.49Å; I133-L135 VanDerWaalsContact C-N 3.28Å; I133-L135 PolarHBondContact O-N 3.23Å; I133-S136 PolarHBondContact O-N 3.4Å; I133-S136 VanDerWaalsContact O-N 3.07Å; I133-H137 PolarHBondContact O-N 3.37Å; I133-H137 PolarHBondContact O-ND1 3.05Å; I133-F140 HydrophobicContact CG2-CE2 4.08Å; I133-F140 HydrophobicContact CG2-CZ 4.45Å
134	R	28.7	Very low	32.8	Very low	103 Å²	103	88.7 Å²	88.7	39%	0.389	47%	0.465	S	S	.	.	H	α-helix	trans	-63.7	-32.1	179	-165.7	173.9	-170.4	-138.4	-8.5	113.5	M79 G80 L130 S136	M79-R134 PolarHBondContact O-NH1 2.63Å; M79-R134 PolarHBondContact O-NH2 3.39Å; G80-R134 PolarHBondContact O-NH2 2.87Å; L130-R134 WeakPolarHBondContact O-CB 3.47Å; L130-R134 PolarHBondContact O-N 2.79Å; R134-S136 VanDerWaalsContact C-N 3.35Å
135	L	29.9	Very low	33.4	Very low	147 Å²	147	90.9 Å²	90.9	77%	0.77	46%	0.462	S	S	*	.	H	α-helix	trans	-80.7	-17.2	175.7	-68.9	171.1	0	0	0	112.9	L131 S132 I133	L131-L135 WeakPolarHBondContact O-CD1 3.11Å; L131-L135 WeakPolarHBondContact O-CG 3.45Å; L131-L135 PolarHBondContact O-N 3.4Å; S132-L135 PolarHBondContact O-N 3.16Å; I133-L135 VanDerWaalsContact C-N 3.28Å; I133-L135 PolarHBondContact O-N 3.23Å
136	S	32.8	Very low	34.2	Very low	76 Å²	76	90.1 Å²	90.1	53%	0.531	45%	0.453	S	S	.	.	H	α-helix	trans	-96.7	-15.4	-170.1	-56.5	0	0	0	0	114.8	S132 I133 R134	S132-S136 WeakPolarHBondContact O-CB 3.36Å; S132-S136 PolarHBondContact O-N 3.3Å; S132-S136 PolarHBondContact O-OG 3.44Å; I133-S136 PolarHBondContact O-N 3.4Å; I133-S136 VanDerWaalsContact O-N 3.07Å; R134-S136 VanDerWaalsContact C-N 3.35Å
137	H	34.2	Very low	34.5	Very low	73 Å²	73	87.7 Å²	87.7	34%	0.338	44%	0.442	S	S	.	.			trans	-130.1	112.4	-168.6	-67.2	85.8	0	0	0	114.4	F19 I133 G139 F140	F19-H137 AromaticContact CE1-CE1 3.72Å; F19-H137 AromaticContact CE1-NE2 3.53Å; F19-H137 AromaticContact CZ-CE1 3.94Å; F19-H137 AromaticContact CZ-NE2 3.35Å; F19-H137 WeakPolarHBondContact CZ-NE2 3.44Å; I133-H137 PolarHBondContact O-N 3.37Å; I133-H137 PolarHBondContact O-ND1 3.05Å; H137-G139 PolarHBondContact O-N 3.45Å; H137-F140 HydrophobicContact CB-CD2 4Å; H137-F140 HydrophobicContact CB-CE2 4.19Å; H137-F140 PolarHBondContact O-N 3.29Å
138	P	32.6	Very low	35	Very low	97 Å²	97	84.5 Å²	84.5	63%	0.63	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-61.2	-19.8	175.3	-22	32.3	0	0	0	114.6	F140 R141	P138-F140 PolarHBondContact O-N 3.11Å; P138-R141 WeakPolarHBondContact O-CB 3.23Å; P138-R141 WeakPolarHBondContact O-CG 3.19Å; P138-R141 PolarHBondContact O-N 3.18Å
139	G	35.6	Very low	35.8	Very low	50 Å²	50	77.9 Å²	77.9	52%	0.515	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-62.2	-24	-179.9	0	0	0	0	0	114.4	H137 R141 V142	H137-G139 PolarHBondContact O-N 3.45Å; G139-R141 PolarHBondContact O-N 3.31Å; G139-V142 PolarHBondContact O-N 3.19Å
140	F	37.1	Very low	36.4	Very low	81 Å²	81	75.7 Å²	75.7	36%	0.355	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-68.9	-6.6	170.7	-72.3	-78.1	0	0	0	113.5	L23 I133 H137 P138	L23-F140 HydrophobicContact CD1-CE1 4.26Å; L23-F140 HydrophobicContact CD1-CZ 4.18Å; I133-F140 HydrophobicContact CG2-CE2 4.08Å; I133-F140 HydrophobicContact CG2-CZ 4.45Å; H137-F140 HydrophobicContact CB-CD2 4Å; H137-F140 HydrophobicContact CB-CE2 4.19Å; H137-F140 PolarHBondContact O-N 3.29Å; P138-F140 PolarHBondContact O-N 3.11Å
141	R	35	Very low	36.9	Very low	198 Å²	198	74 Å²	74	75%	0.747	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-88.7	-2.3	175.2	-59	-176	175.5	-150.9	-0.7	113.8	P138 G139 H143	P138-R141 WeakPolarHBondContact O-CB 3.23Å; P138-R141 WeakPolarHBondContact O-CG 3.19Å; P138-R141 PolarHBondContact O-N 3.18Å; G139-R141 PolarHBondContact O-N 3.31Å; R141-H143 PolarHBondContact O-CD2 2.8Å
142	V	35.5	Very low	37.8	Very low	98 Å²	98	75.8 Å²	75.8	59%	0.594	39%	0.393	S	S	*	.			trans	-97.1	107.8	-175.8	-165.9	0	0	0	0	110.4	G139 Q144 Q146	G139-V142 PolarHBondContact O-N 3.19Å; V142-Q144 PolarHBondContact O-N 2.93Å; V142-Q146 PolarHBondContact O-NE2 3.22Å
143	H	44.6	Very low	38.7	Very low	90 Å²	90	73.8 Å²	73.8	42%	0.417	38%	0.378	S	S	.	.			trans	-79.1	-0.6	-156.8	-82.6	-91	0	0	0	117.9	N81 R141	N81-H143 PolarHBondContact ND2-CE1 2.9Å; N81-H143 PolarHBondContact ND2-NE2 3.4Å; R141-H143 PolarHBondContact O-CD2 2.8Å
144	Q	43.8	Very low	39.3	Very low	44 Å²	44	72.7 Å²	72.7	21%	0.206	37%	0.373	C	S	.	.	S	Bend	trans	-113.4	-12.2	-151.7	-54.1	-156.4	-37.3	0	0	117.7	V142 S319 T354 E355	V142-Q144 PolarHBondContact O-N 2.93Å; Q144-S319 PolarHBondContact OE1-OG 2.8Å; Q144-T354 HydrophobicContact CB-CG2 4.25Å; Q144-T354 HydrophobicContact CG-CG2 4.18Å; Q144-T354 VanDerWaalsContact CG-O 3.27Å; Q144-T354 WeakPolarHBondContact CG-O 3.24Å; Q144-T354 PolarHBondContact NE2-O 3.22Å; Q144-E355 VanDerWaalsContact NE2-CA 3.32Å
145	Q	40.8	Very low	39.8	Very low	129 Å²	129	70.5 Å²	70.5	60%	0.603	37%	0.369	S	S	*	.	S	Bend	trans	-133.7	8.9	-170.9	-68.4	-179.5	-10.8	0	0	115.2	V147 H314	Q145-V147 PolarHBondContact O-N 3.46Å; Q145-H314 PolarHBondContact NE2-NE2 3.12Å
146	Q	45.8	Very low	40.1	Very low	33 Å²	33	66.2 Å²	66.2	15%	0.154	34%	0.344	C	S	.	.	H	α-helix	trans	-84.6	-3.5	-162.8	-62.2	-174.3	10.5	0	0	116.5	Y84 V142 I149 G150	Y84-Q146 HydrophobicContact CD2-CB 3.78Å; Y84-Q146 HydrophobicContact CE2-CB 3.67Å; Y84-Q146 HydrophobicContact CG-CB 4.4Å; Y84-Q146 PolarHBondContact OH-OE1 3.14Å; V142-Q146 PolarHBondContact O-NE2 3.22Å; Q146-I149 HydrophobicContact CB-CB 4.5Å; Q146-I149 HydrophobicContact CB-CD1 4.44Å; Q146-I149 HydrophobicContact CG-CD1 4.09Å; Q146-I149 WeakPolarHBondContact O-CA 3.37Å; Q146-I149 VanDerWaalsContact O-CB 3.25Å; Q146-I149 WeakPolarHBondContact O-CB 3.37Å; Q146-I149 PolarHBondContact O-N 3.04Å; Q146-G150 PolarHBondContact O-N 2.65Å
147	V	43.1	Very low	40.4	Very low	1 Å²	1	63.1 Å²	63.1	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-88	-33.2	178.9	-157	0	0	0	0	112	V88 Q145 I149 G150 Y359 Y393 I394	V88-V147 HydrophobicContact CG2-CG1 3.69Å; Q145-V147 PolarHBondContact O-N 3.46Å; V147-I149 PolarHBondContact O-N 2.75Å; V147-G150 PolarHBondContact O-N 3.11Å; V147-Y359 HydrophobicContact CG2-CD1 4.16Å; V147-Y359 HydrophobicContact CG2-CE1 3.42Å; V147-Y359 VanDerWaalsContact CG2-CE1 3.42Å; V147-Y359 HydrophobicContact CG2-CE2 3.94Å; V147-Y359 VanDerWaalsContact CG2-OH 3.3Å; V147-Y359 WeakPolarHBondContact CG2-OH 3.42Å; V147-Y393 HydrophobicContact CB-CE1 3.55Å; V147-Y393 HydrophobicContact CG1-CD1 4.41Å; V147-Y393 HydrophobicContact CG1-CE1 3.81Å; V147-Y393 HydrophobicContact CG2-CE1 3.67Å; V147-I394 HydrophobicContact CB-CD1 4.28Å; V147-I394 HydrophobicContact CG1-CD1 3.37Å
148	A	40.4	Very low	40.6	Very low	31 Å²	31	60 Å²	60	26%	0.256	31%	0.308	S	S	.	.	H	α-helix	trans	-56.9	-37.5	161.1	0	0	0	0	0	109.2	G150 I151 Y152	A148-G150 PolarHBondContact O-N 3.35Å; A148-I151 PolarHBondContact O-N 2.78Å; A148-Y152 HydrophobicContact CB-CD2 4.25Å; A148-Y152 HydrophobicContact CB-CE2 4.34Å; A148-Y152 VanDerWaalsContact O-CD2 3.24Å; A148-Y152 WeakPolarHBondContact O-CD2 3.33Å; A148-Y152 PolarHBondContact O-N 2.97Å
149	I	43.5	Very low	40.7	Very low	73 Å²	73	61.2 Å²	61.2	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-58.8	-27.5	172.2	-73.6	161.1	0	0	0	112.9	Q146 V147 I151 Y152 V153	Q146-I149 HydrophobicContact CB-CB 4.5Å; Q146-I149 HydrophobicContact CB-CD1 4.44Å; Q146-I149 HydrophobicContact CG-CD1 4.09Å; Q146-I149 WeakPolarHBondContact O-CA 3.37Å; Q146-I149 VanDerWaalsContact O-CB 3.25Å; Q146-I149 WeakPolarHBondContact O-CB 3.37Å; Q146-I149 PolarHBondContact O-N 3.04Å; V147-I149 PolarHBondContact O-N 2.75Å; I149-I151 VanDerWaalsContact C-N 3.34Å; I149-I151 PolarHBondContact O-N 3.28Å; I149-Y152 CarbonylContact O-C 3.59Å; I149-V153 HydrophobicContact CG2-CG2 4.01Å; I149-V153 WeakPolarHBondContact O-CA 3.41Å; I149-V153 WeakPolarHBondContact O-CB 3.07Å; I149-V153 WeakPolarHBondContact O-CG2 3.44Å; I149-V153 PolarHBondContact O-N 3.14Å
150	G	41.8	Very low	40.6	Very low	13 Å²	13	60.3 Å²	60.3	13%	0.134	29%	0.292	C	S	.	.	H	α-helix	trans	-66.8	-31.7	173.3	0	0	0	0	0	114.2	Q146 V147 A148 V153	Q146-G150 PolarHBondContact O-N 2.65Å; V147-G150 PolarHBondContact O-N 3.11Å; A148-G150 PolarHBondContact O-N 3.35Å; G150-V153 WeakPolarHBondContact O-CB 3.41Å
151	I	43.7	Very low	40.5	Very low	13 Å²	13	57.8 Å²	57.8	7%	0.067	28%	0.282	C	S	.	.	H	α-helix	trans	-87.8	-38.4	175	-60.2	168.9	0	0	0	110.4	A148 I149 V153 M154 N155 D217 C306 I394	A148-I151 PolarHBondContact O-N 2.78Å; I149-I151 VanDerWaalsContact C-N 3.34Å; I149-I151 PolarHBondContact O-N 3.28Å; I151-V153 PolarHBondContact O-N 2.88Å; I151-M154 VanDerWaalsContact O-CA 3.29Å; I151-M154 WeakPolarHBondContact O-CA 2.94Å; I151-M154 WeakPolarHBondContact O-CB 3.4Å; I151-M154 PolarHBondContact O-N 3.42Å; I151-N155 PolarHBondContact O-N 2.97Å; I151-N155 VanDerWaalsContact O-N 3.09Å; I151-D217 HydrophobicContact CD1-CB 4.04Å; I151-D217 HydrophobicContact CG2-CB 4.04Å; I151-D217 WeakPolarHBondContact CG2-OD1 3.47Å; I151-C306 VanDerWaalsContact CD1-SG 3.53Å; I151-I394 HydrophobicContact CD1-CD1 4.19Å; I151-I394 HydrophobicContact CD1-CG2 4.43Å
152	Y	46.2	Very low	40.3	Very low	149 Å²	149	54.8 Å²	54.8	58%	0.584	28%	0.281	S	S	*	.	H	α-helix	trans	-61.3	-24	164.8	-79.8	-80.8	0	0	0	111.2	A148 I149 M154 N155 F156	A148-Y152 HydrophobicContact CB-CD2 4.25Å; A148-Y152 HydrophobicContact CB-CE2 4.34Å; A148-Y152 VanDerWaalsContact O-CD2 3.24Å; A148-Y152 WeakPolarHBondContact O-CD2 3.33Å; A148-Y152 PolarHBondContact O-N 2.97Å; I149-Y152 CarbonylContact O-C 3.59Å; Y152-M154 VanDerWaalsContact C-N 3.28Å; Y152-N155 CarbonylContact O-C 3.5Å; Y152-N155 PolarHBondContact O-N 3.34Å; Y152-N155 VanDerWaalsContact O-N 3.14Å; Y152-F156 WeakPolarHBondContact O-CA 3.24Å; Y152-F156 WeakPolarHBondContact O-CB 3.32Å; Y152-F156 PolarHBondContact O-N 2.85Å
153	V	44.9	Very low	40.3	Very low	18 Å²	18	53.7 Å²	53.7	11%	0.109	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-41.2	170.6	154.4	0	0	0	0	107.7	L27 I149 G150 I151 N155 F157	L27-V153 HydrophobicContact CB-CG1 4.09Å; L27-V153 HydrophobicContact CD1-CB 4.22Å; L27-V153 HydrophobicContact CD1-CG1 3.76Å; L27-V153 HydrophobicContact CD1-CG2 3.37Å; I149-V153 HydrophobicContact CG2-CG2 4.01Å; I149-V153 WeakPolarHBondContact O-CA 3.41Å; I149-V153 WeakPolarHBondContact O-CB 3.07Å; I149-V153 WeakPolarHBondContact O-CG2 3.44Å; I149-V153 PolarHBondContact O-N 3.14Å; G150-V153 WeakPolarHBondContact O-CB 3.41Å; I151-V153 PolarHBondContact O-N 2.88Å; V153-N155 PolarHBondContact O-N 3.26Å; V153-F157 HydrophobicContact CB-CE2 4.28Å; V153-F157 HydrophobicContact CG1-CD2 3.64Å; V153-F157 HydrophobicContact CG1-CE2 3.02Å; V153-F157 HydrophobicContact CG1-CZ 3.68Å; V153-F157 WeakPolarHBondContact O-CA 3.4Å; V153-F157 WeakPolarHBondContact O-CB 3.28Å; V153-F157 WeakPolarHBondContact O-CD2 3.32Å; V153-F157 WeakPolarHBondContact O-CG 3.42Å; V153-F157 PolarHBondContact O-N 2.87Å
154	M	44.9	Very low	39.8	Very low	9 Å²	9	57 Å²	57	4%	0.044	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-37.6	167.9	-55.5	-109.4	86.7	0	0	114.3	L92 I151 Y152 F157 C158 L188 F192	L92-M154 HydrophobicContact CD1-CE 4.48Å; L92-M154 HydrophobicContact CD1-SD 4.45Å; L92-M154 HydrophobicContact CD2-SD 4.2Å; I151-M154 VanDerWaalsContact O-CA 3.29Å; I151-M154 WeakPolarHBondContact O-CA 2.94Å; I151-M154 WeakPolarHBondContact O-CB 3.4Å; I151-M154 PolarHBondContact O-N 3.42Å; Y152-M154 VanDerWaalsContact C-N 3.28Å; M154-F157 HydrophobicContact CE-CD2 4.43Å; M154-F157 WeakPolarHBondContact O-CB 3.08Å; M154-C158 PolarHBondContact O-SG 3.04Å; M154-L188 HydrophobicContact CE-CD1 3.59Å; M154-L188 HydrophobicContact CE-CD2 3.34Å; M154-L188 HydrophobicContact CE-CG 4.1Å; M154-L188 HydrophobicContact SD-CD1 4.43Å; M154-L188 HydrophobicContact SD-CD2 3.77Å; M154-F192 HydrophobicContact SD-CD2 4Å; M154-F192 HydrophobicContact SD-CE2 3.61Å; M154-F192 HydrophobicContact SD-CZ 4.26Å
155	N	39.4	Very low	39.2	Very low	57 Å²	57	66.6 Å²	66.6	31%	0.305	33%	0.33	S	S	.	.	H	α-helix	trans	-87.6	-30.5	-176.8	-123.6	-12.6	0	0	0	113.8	I151 Y152 V153 C158 L159 Q216	I151-N155 PolarHBondContact O-N 2.97Å; I151-N155 VanDerWaalsContact O-N 3.09Å; Y152-N155 CarbonylContact O-C 3.5Å; Y152-N155 PolarHBondContact O-N 3.34Å; Y152-N155 VanDerWaalsContact O-N 3.14Å; V153-N155 PolarHBondContact O-N 3.26Å; N155-C158 WeakPolarHBondContact O-CB 3.4Å; N155-C158 PolarHBondContact O-N 3.42Å; N155-L159 PolarHBondContact O-N 3.08Å; N155-L159 VanDerWaalsContact O-N 3.11Å; N155-Q216 VanDerWaalsContact CB-OE1 3.3Å; N155-Q216 VanDerWaalsContact CG-CD 3.49Å; N155-Q216 PolarHBondContact ND2-OE1 3.28Å; N155-Q216 VanDerWaalsContact OD1-CD 3.29Å; N155-Q216 PolarHBondContact OD1-NE2 2.79Å; N155-Q216 PolarHBondContact OD1-OE1 2.82Å
156	F	36.7	Very low	38.7	Very low	58 Å²	58	63.5 Å²	63.5	25%	0.254	33%	0.334	S	S	.	.	H	α-helix	trans	-76.6	-33.7	173.4	-164.2	-68	0	0	0	110	G20 N21 Y152 C158 T160	G20-F156 VanDerWaalsContact C-CD1 3.45Å; G20-F156 VanDerWaalsContact O-CD1 3.24Å; G20-F156 WeakPolarHBondContact O-CD1 3.32Å; G20-F156 WeakPolarHBondContact O-CE1 3.18Å; N21-F156 HydrophobicContact CB-CE1 4.37Å; Y152-F156 WeakPolarHBondContact O-CA 3.24Å; Y152-F156 WeakPolarHBondContact O-CB 3.32Å; Y152-F156 PolarHBondContact O-N 2.85Å; F156-C158 PolarHBondContact O-N 3.49Å; F156-T160 HydrophobicContact CD1-CG2 4.45Å; F156-T160 WeakPolarHBondContact CD1-OG1 3.45Å; F156-T160 HydrophobicContact CE1-CG2 3.41Å; F156-T160 VanDerWaalsContact CE1-CG2 3.41Å; F156-T160 WeakPolarHBondContact CE1-OG1 3.39Å; F156-T160 HydrophobicContact CE2-CG2 4.13Å; F156-T160 HydrophobicContact CZ-CG2 3.24Å; F156-T160 VanDerWaalsContact CZ-OG1 3.28Å; F156-T160 WeakPolarHBondContact CZ-OG1 3.11Å; F156-T160 PolarHBondContact O-N 2.75Å; F156-T160 PolarHBondContact O-OG1 3.04Å
157	F	38.8	Very low	37.8	Very low	11 Å²	11	69.9 Å²	69.9	5%	0.048	37%	0.368	C	S	.	.	H	α-helix	trans	-51.1	-34.8	163.3	-89.3	-51	0	0	0	112.3	S24 L27 F28 V153 M154	S24-F157 VanDerWaalsContact CA-CE1 3.46Å; S24-F157 VanDerWaalsContact CB-CE1 3.48Å; S24-F157 WeakPolarHBondContact O-CE1 3.49Å; S24-F157 WeakPolarHBondContact O-CZ 3.35Å; L27-F157 HydrophobicContact CB-CZ 3.91Å; F28-F157 HydrophobicContact CB-CD1 4.08Å; F28-F157 HydrophobicContact CB-CE1 3.19Å; F28-F157 HydrophobicContact CB-CE2 4.28Å; F28-F157 HydrophobicContact CB-CZ 3.39Å; F28-F157 HydrophobicContact CD2-CE1 4.4Å; F28-F157 HydrophobicContact CG-CE1 4.2Å; F28-F157 VanDerWaalsContact N-CZ 3.27Å; V153-F157 HydrophobicContact CB-CE2 4.28Å; V153-F157 HydrophobicContact CG1-CD2 3.64Å; V153-F157 HydrophobicContact CG1-CE2 3.02Å; V153-F157 HydrophobicContact CG1-CZ 3.68Å; V153-F157 WeakPolarHBondContact O-CA 3.4Å; V153-F157 WeakPolarHBondContact O-CB 3.28Å; V153-F157 WeakPolarHBondContact O-CD2 3.32Å; V153-F157 WeakPolarHBondContact O-CG 3.42Å; V153-F157 PolarHBondContact O-N 2.87Å; M154-F157 HydrophobicContact CE-CD2 4.43Å; M154-F157 WeakPolarHBondContact O-CB 3.08Å
158	C	37.6	Very low	37.1	Very low	8 Å²	8	75 Å²	75	5%	0.054	40%	0.404	C	S	.	.	H	α-helix	trans	-89.8	-42.5	-168	-86	0	0	0	0	112.2	M154 N155 F156 F185	M154-C158 PolarHBondContact O-SG 3.04Å; N155-C158 WeakPolarHBondContact O-CB 3.4Å; N155-C158 PolarHBondContact O-N 3.42Å; F156-C158 PolarHBondContact O-N 3.49Å; C158-F185 VanDerWaalsContact C-CD2 3.45Å; C158-F185 VanDerWaalsContact C-CE2 3.43Å; C158-F185 HydrophobicContact CB-CD2 3.22Å; C158-F185 HydrophobicContact CB-CE2 3.21Å; C158-F185 HydrophobicContact CB-CG 4.25Å; C158-F185 HydrophobicContact CB-CZ 4.25Å; C158-F185 WeakPolarHBondContact O-CD2 3.06Å; C158-F185 WeakPolarHBondContact O-CE2 2.89Å; C158-F185 WeakPolarHBondContact SG-CD2 3.26Å
159	L	34.4	Very low	36.7	Very low	121 Å²	121	80.4 Å²	80.4	63%	0.634	43%	0.434	S	S	*	.	H	α-helix	trans	-96.1	-21.2	-171.2	-74.5	164.4	0	0	0	115.5	N155	N155-L159 PolarHBondContact O-N 3.08Å; N155-L159 VanDerWaalsContact O-N 3.11Å
160	T	34.2	Very low	36.5	Very low	31 Å²	31	80.6 Å²	80.6	19%	0.19	44%	0.438	C	S	.	.	S	Bend	trans	-101.2	-14.9	-162.7	-35	0	0	0	0	113.1	N21 F156 L162	N21-T160 HydrophobicContact CB-CG2 4.36Å; N21-T160 VanDerWaalsContact ND2-CG2 3.26Å; N21-T160 WeakPolarHBondContact ND2-CG2 3.45Å; N21-T160 PolarHBondContact ND2-O 3.42Å; N21-T160 WeakPolarHBondContact OD1-CA 3.48Å; N21-T160 WeakPolarHBondContact OD1-CB 3.45Å; N21-T160 WeakPolarHBondContact OD1-CG2 3.22Å; N21-T160 PolarHBondContact OD1-O 2.87Å; F156-T160 HydrophobicContact CD1-CG2 4.45Å; F156-T160 WeakPolarHBondContact CD1-OG1 3.45Å; F156-T160 HydrophobicContact CE1-CG2 3.41Å; F156-T160 VanDerWaalsContact CE1-CG2 3.41Å; F156-T160 WeakPolarHBondContact CE1-OG1 3.39Å; F156-T160 HydrophobicContact CE2-CG2 4.13Å; F156-T160 HydrophobicContact CZ-CG2 3.24Å; F156-T160 VanDerWaalsContact CZ-OG1 3.28Å; F156-T160 WeakPolarHBondContact CZ-OG1 3.11Å; F156-T160 PolarHBondContact O-N 2.75Å; F156-T160 PolarHBondContact O-OG1 3.04Å; T160-L162 VanDerWaalsContact C-N 3.3Å; T160-L162 PolarHBondContact O-N 3.39Å
161	L	34.3	Very low	36.1	Very low	29 Å²	29	83.8 Å²	83.8	15%	0.152	46%	0.458	C	S	.	.			trans	-87.8	12.3	178.9	-67.4	165.8	0	0	0	114.7	N21 I25 P163 F181	N21-L161 PolarHBondContact OD1-N 2.82Å; I25-L161 HydrophobicContact CD1-CD2 3.56Å; I25-L161 HydrophobicContact CG1-CD1 4.04Å; I25-L161 HydrophobicContact CG1-CD2 3.66Å; I25-L161 HydrophobicContact CG1-CG 4.5Å; L161-P163 WeakPolarHBondContact O-CD 3.31Å; L161-F181 HydrophobicContact CB-CB 4.41Å; L161-F181 HydrophobicContact CB-CD2 4.22Å; L161-F181 HydrophobicContact CB-CG 4.28Å; L161-F181 HydrophobicContact CD1-CB 4.43Å; L161-F181 HydrophobicContact CD1-CD1 3.47Å; L161-F181 VanDerWaalsContact CD1-CD1 3.47Å; L161-F181 HydrophobicContact CD1-CD2 3.77Å; L161-F181 HydrophobicContact CD1-CE1 3.53Å; L161-F181 HydrophobicContact CD1-CE2 3.84Å; L161-F181 HydrophobicContact CD1-CG 3.64Å; L161-F181 HydrophobicContact CD1-CZ 3.74Å; L161-F181 HydrophobicContact CD2-CE2 4.38Å; L161-F181 HydrophobicContact CG-CD2 4.4Å
162	L	31.7	Very low	35.6	Very low	135 Å²	135	89.2 Å²	89.2	71%	0.707	48%	0.484	S	S	*	.	S	Bend	trans	-77.8	116.2	162.7	-70.8	171.4	0	0	0	108.2	T160 D164	T160-L162 VanDerWaalsContact C-N 3.3Å; T160-L162 PolarHBondContact O-N 3.39Å; L162-D164 PolarHBondContact O-N 3.49Å; L162-D164 VanDerWaalsContact O-N 3.13Å
163	P	34.6	Very low	35	Very low	75 Å²	75	87 Å²	87	49%	0.487	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-68.1	116.6	178.8	-7.1	21.5	0	0	0	108.8	L161 R165 I174 C178	L161-P163 WeakPolarHBondContact O-CD 3.31Å; P163-R165 PolarHBondContact O-N 2.92Å; P163-I174 HydrophobicContact CG-CG2 3.89Å; P163-C178 VanDerWaalsContact CD-SG 3.6Å; P163-C178 WeakPolarHBondContact CG-SG 3.23Å
164	D	35.3	Very low	34.6	Very low	160 Å²	160	88.9 Å²	88.9	86%	0.856	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-63	133.8	155.6	-161.2	2.4	0	0	0	107.8	L162 G166	L162-D164 PolarHBondContact O-N 3.49Å; L162-D164 VanDerWaalsContact O-N 3.13Å; D164-G166 PolarHBondContact O-N 3.49Å; D164-G166 VanDerWaalsContact O-N 3.14Å
165	R	31.7	Very low	34.4	Very low	244 Å²	244	92.6 Å²	92.6	92%	0.921	51%	0.51	S	S	*	.	S	Bend	trans	-67.7	113	-159.8	-65.9	179.7	179.8	-177.4	0.1	110.9	P163	P163-R165 PolarHBondContact O-N 2.92Å
166	G	28.7	Very low	34.5	Very low	65 Å²	65	94.7 Å²	94.7	67%	0.67	52%	0.521	S	S	*	.			trans	144.3	92.3	151.1	0	0	0	0	0	115.3	D164	D164-G166 PolarHBondContact O-N 3.49Å; D164-G166 VanDerWaalsContact O-N 3.14Å
167	L	28.1	Very low	34.5	Very low	167 Å²	167	95.5 Å²	95.5	87%	0.874	53%	0.527	S	S	*	.			trans	-160.5	118.2	142.7	-112.5	111.9	0	0	0	109.3
168	S	29	Very low	34.6	Very low	109 Å²	109	96.6 Å²	96.6	76%	0.762	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	108.3	-178.4	52.3	0	0	0	0	110.9
169	T	31.5	Very low	35.1	Very low	144 Å²	144	99.2 Å²	99.2	88%	0.883	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.4	13.5	147.7	31.7	0	0	0	0	113.9
170	T	38	Very low	35.6	Very low	76 Å²	76	95.5 Å²	95.5	47%	0.466	53%	0.527	S	S	.	.			trans	-137.5	35.5	178	48.6	0	0	0	0	113.5	E172 I174	T170-E172 PolarHBondContact O-N 2.79Å; T170-I174 WeakPolarHBondContact O-CB 3.49Å; T170-I174 WeakPolarHBondContact O-CD1 3.45Å; T170-I174 VanDerWaalsContact O-CG1 3.23Å; T170-I174 WeakPolarHBondContact O-CG1 3.27Å; T170-I174 PolarHBondContact O-N 2.88Å; T170-I174 VanDerWaalsContact O-N 3.15Å; T170-I174 WeakPolarHBondContact OG1-CD1 3.35Å
171	S	33.9	Very low	36.1	Very low	80 Å²	80	95 Å²	95	56%	0.559	52%	0.522	S	S	*	.	H	α-helix	trans	-62.7	-45.4	-169.8	124.4	0	0	0	0	113.9	L173 I174 D175	S171-L173 PolarHBondContact O-N 2.8Å; S171-I174 PolarHBondContact O-N 2.81Å; S171-D175 WeakPolarHBondContact O-CB 3.12Å; S171-D175 PolarHBondContact O-N 2.82Å; S171-D175 VanDerWaalsContact O-OD2 3.07Å; S171-D175 PolarHBondContact OG-OD2 2.89Å
172	E	34.3	Very low	36.6	Very low	127 Å²	127	96.5 Å²	96.5	59%	0.593	54%	0.535	S	S	*	.	H	α-helix	trans	-66.3	-39.9	-175.7	-69.4	179.1	165.1	0	0	113.6	T170 D175 I176	T170-E172 PolarHBondContact O-N 2.79Å; E172-D175 PolarHBondContact O-N 3.2Å; E172-I176 WeakPolarHBondContact O-CB 3.47Å; E172-I176 WeakPolarHBondContact O-CD1 3.49Å; E172-I176 WeakPolarHBondContact O-CG1 3.37Å; E172-I176 PolarHBondContact O-N 2.74Å
173	L	33.3	Very low	37.3	Very low	102 Å²	102	92.2 Å²	92.2	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-69.5	-38.8	176.8	-99.4	161.1	0	0	0	111.3	S171 I176 L177	S171-L173 PolarHBondContact O-N 2.8Å; L173-I176 PolarHBondContact O-N 2.8Å; L173-L177 VanDerWaalsContact O-CB 3.26Å; L173-L177 WeakPolarHBondContact O-CB 3.44Å; L173-L177 WeakPolarHBondContact O-CG 3.48Å; L173-L177 PolarHBondContact O-N 2.82Å
174	I	35.5	Very low	37.9	Very low	58 Å²	58	88.9 Å²	88.9	30%	0.297	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-44.9	174	-69.5	170.4	0	0	0	109.7	P163 T170 S171 I176 L177 C178	P163-I174 HydrophobicContact CG-CG2 3.89Å; T170-I174 WeakPolarHBondContact O-CB 3.49Å; T170-I174 WeakPolarHBondContact O-CD1 3.45Å; T170-I174 VanDerWaalsContact O-CG1 3.23Å; T170-I174 WeakPolarHBondContact O-CG1 3.27Å; T170-I174 PolarHBondContact O-N 2.88Å; T170-I174 VanDerWaalsContact O-N 3.15Å; T170-I174 WeakPolarHBondContact OG1-CD1 3.35Å; S171-I174 PolarHBondContact O-N 2.81Å; I174-I176 PolarHBondContact O-N 2.81Å; I174-L177 PolarHBondContact O-N 2.62Å; I174-C178 WeakPolarHBondContact O-CB 3.5Å; I174-C178 PolarHBondContact O-N 3.01Å; I174-C178 PolarHBondContact O-SG 3.29Å
175	D	41.7	Very low	38.7	Very low	87 Å²	87	85 Å²	85	47%	0.465	47%	0.465	S	S	.	.	H	α-helix	trans	-63.9	-40.7	179.2	-66.6	-31	0	0	0	111.8	S171 E172 N179	S171-D175 WeakPolarHBondContact O-CB 3.12Å; S171-D175 PolarHBondContact O-N 2.82Å; S171-D175 VanDerWaalsContact O-OD2 3.07Å; S171-D175 PolarHBondContact OG-OD2 2.89Å; E172-D175 PolarHBondContact O-N 3.2Å; D175-N179 VanDerWaalsContact O-CB 3.3Å; D175-N179 WeakPolarHBondContact O-CB 3.38Å; D175-N179 PolarHBondContact O-N 3.17Å
176	I	41	Very low	40.1	Very low	102 Å²	102	75.6 Å²	75.6	52%	0.523	44%	0.436	S	S	.	.	H	α-helix	trans	-64.7	-46.8	175.1	-70.4	164.4	0	0	0	111	E172 L173 I174 N179 Y180	E172-I176 WeakPolarHBondContact O-CB 3.47Å; E172-I176 WeakPolarHBondContact O-CD1 3.49Å; E172-I176 WeakPolarHBondContact O-CG1 3.37Å; E172-I176 PolarHBondContact O-N 2.74Å; L173-I176 PolarHBondContact O-N 2.8Å; I174-I176 PolarHBondContact O-N 2.81Å; I176-N179 PolarHBondContact O-N 3.15Å; I176-Y180 VanDerWaalsContact O-CB 3.23Å; I176-Y180 WeakPolarHBondContact O-CB 3.4Å; I176-Y180 PolarHBondContact O-N 2.96Å
177	L	37.9	Very low	41.7	Very low	74 Å²	74	72.7 Å²	72.7	39%	0.387	41%	0.406	S	S	.	.	H	α-helix	trans	-65.5	-43.8	178.5	-72.5	172.4	0	0	0	110.5	L173 I174 N179 Y180 F181	L173-L177 VanDerWaalsContact O-CB 3.26Å; L173-L177 WeakPolarHBondContact O-CB 3.44Å; L173-L177 WeakPolarHBondContact O-CG 3.48Å; L173-L177 PolarHBondContact O-N 2.82Å; I174-L177 PolarHBondContact O-N 2.62Å; L177-N179 PolarHBondContact O-N 2.59Å; L177-Y180 PolarHBondContact O-N 3.11Å; L177-Y180 VanDerWaalsContact O-N 3.17Å; L177-F181 HydrophobicContact CB-CD2 4Å; L177-F181 HydrophobicContact CB-CE2 3.88Å; L177-F181 HydrophobicContact CD2-CE2 3.94Å; L177-F181 HydrophobicContact CD2-CZ 4.49Å; L177-F181 HydrophobicContact CG-CE2 4.4Å; L177-F181 VanDerWaalsContact O-CB 3.29Å; L177-F181 WeakPolarHBondContact O-CB 3.37Å; L177-F181 WeakPolarHBondContact O-CD2 3.24Å; L177-F181 WeakPolarHBondContact O-CG 3.33Å; L177-F181 PolarHBondContact O-N 2.93Å
178	C	40.8	Very low	43.4	Very low	34 Å²	34	64.9 Å²	64.9	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-42.3	175.9	-73.3	0	0	0	0	111.9	P163 I174 Y180 S182	P163-C178 VanDerWaalsContact CD-SG 3.6Å; P163-C178 WeakPolarHBondContact CG-SG 3.23Å; I174-C178 WeakPolarHBondContact O-CB 3.5Å; I174-C178 PolarHBondContact O-N 3.01Å; I174-C178 PolarHBondContact O-SG 3.29Å; C178-Y180 VanDerWaalsContact C-N 3.34Å; C178-S182 VanDerWaalsContact O-CB 3.23Å; C178-S182 WeakPolarHBondContact O-CB 3.39Å; C178-S182 PolarHBondContact O-N 3.47Å; C178-S182 PolarHBondContact O-OG 3.02Å
179	N	46.4	Very low	45.3	Very low	63 Å²	63	61.7 Å²	61.7	34%	0.337	34%	0.341	S	S	.	.	H	α-helix	trans	-68	-33.7	174.6	-80.7	-18.6	0	0	0	112.8	D175 I176 L177 S182 K183	D175-N179 VanDerWaalsContact O-CB 3.3Å; D175-N179 WeakPolarHBondContact O-CB 3.38Å; D175-N179 PolarHBondContact O-N 3.17Å; I176-N179 PolarHBondContact O-N 3.15Å; L177-N179 PolarHBondContact O-N 2.59Å; N179-S182 WeakPolarHBondContact CA-OG 3.2Å; N179-S182 PolarHBondContact O-OG 2.85Å; N179-K183 WeakPolarHBondContact O-CG 3.38Å; N179-K183 PolarHBondContact O-N 2.91Å
180	Y	45.7	Very low	47.2	Very low	43 Å²	43	57.9 Å²	57.9	17%	0.169	31%	0.313	C	S	.	.	H	α-helix	trans	-73.5	-41.6	176.8	-174	-85.5	0	0	0	111.6	F28 C105 I176 L177 C178 K183 S184	F28-Y180 HydrophobicContact CD1-CE1 4.43Å; F28-Y180 HydrophobicContact CE1-CD1 4.47Å; F28-Y180 AromaticContact CE1-CE1 3.37Å; F28-Y180 HydrophobicContact CE1-CE1 3.37Å; F28-Y180 AromaticContact CE1-CZ 3.91Å; F28-Y180 AromaticContact CZ-CE1 3.51Å; F28-Y180 HydrophobicContact CZ-CE1 3.51Å; F28-Y180 AromaticContact CZ-CZ 3.97Å; C105-Y180 HydrophobicContact CB-CE2 4.28Å; I176-Y180 VanDerWaalsContact O-CB 3.23Å; I176-Y180 WeakPolarHBondContact O-CB 3.4Å; I176-Y180 PolarHBondContact O-N 2.96Å; L177-Y180 PolarHBondContact O-N 3.11Å; L177-Y180 VanDerWaalsContact O-N 3.17Å; C178-Y180 VanDerWaalsContact C-N 3.34Å; Y180-K183 PolarHBondContact O-N 3.39Å; Y180-S184 WeakPolarHBondContact O-CB 3.25Å; Y180-S184 PolarHBondContact O-N 3.36Å; Y180-S184 PolarHBondContact O-OG 3.24Å
181	F	44.1	Very low	48.9	Very low	21 Å²	21	54.6 Å²	54.6	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-71.8	-35.3	177.3	-72.6	-57.5	0	0	0	111.9	I25 L161 L177 K183 S184 F185	I25-F181 HydrophobicContact CG1-CE2 4.31Å; I25-F181 HydrophobicContact CG1-CZ 3.86Å; I25-F181 HydrophobicContact CG2-CZ 4.47Å; L161-F181 HydrophobicContact CB-CB 4.41Å; L161-F181 HydrophobicContact CB-CD2 4.22Å; L161-F181 HydrophobicContact CB-CG 4.28Å; L161-F181 HydrophobicContact CD1-CB 4.43Å; L161-F181 HydrophobicContact CD1-CD1 3.47Å; L161-F181 VanDerWaalsContact CD1-CD1 3.47Å; L161-F181 HydrophobicContact CD1-CD2 3.77Å; L161-F181 HydrophobicContact CD1-CE1 3.53Å; L161-F181 HydrophobicContact CD1-CE2 3.84Å; L161-F181 HydrophobicContact CD1-CG 3.64Å; L161-F181 HydrophobicContact CD1-CZ 3.74Å; L161-F181 HydrophobicContact CD2-CE2 4.38Å; L161-F181 HydrophobicContact CG-CD2 4.4Å; L177-F181 HydrophobicContact CB-CD2 4Å; L177-F181 HydrophobicContact CB-CE2 3.88Å; L177-F181 HydrophobicContact CD2-CE2 3.94Å; L177-F181 HydrophobicContact CD2-CZ 4.49Å; L177-F181 HydrophobicContact CG-CE2 4.4Å; L177-F181 VanDerWaalsContact O-CB 3.29Å; L177-F181 WeakPolarHBondContact O-CB 3.37Å; L177-F181 WeakPolarHBondContact O-CD2 3.24Å; L177-F181 WeakPolarHBondContact O-CG 3.33Å; L177-F181 PolarHBondContact O-N 2.93Å; F181-K183 VanDerWaalsContact C-N 3.34Å; F181-K183 PolarHBondContact O-N 3.31Å; F181-S184 PolarHBondContact O-N 3.42Å; F181-F185 VanDerWaalsContact O-CB 3.22Å; F181-F185 WeakPolarHBondContact O-CB 3.38Å; F181-F185 PolarHBondContact O-N 3.35Å
182	S	45.6	Very low	51.1	Low	61 Å²	61	51.1 Å²	51.1	43%	0.427	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-37.1	173.6	68.5	0	0	0	0	112.3	C178 N179 F185 S186	C178-S182 VanDerWaalsContact O-CB 3.23Å; C178-S182 WeakPolarHBondContact O-CB 3.39Å; C178-S182 PolarHBondContact O-N 3.47Å; C178-S182 PolarHBondContact O-OG 3.02Å; N179-S182 WeakPolarHBondContact CA-OG 3.2Å; N179-S182 PolarHBondContact O-OG 2.85Å; S182-F185 WeakPolarHBondContact O-CB 3.13Å; S182-S186 PolarHBondContact O-N 2.89Å; S182-S186 VanDerWaalsContact O-N 3.11Å
183	K	46.6	Very low	53.4	Low	45 Å²	45	46.8 Å²	46.8	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-75.3	-34.5	174.9	-69.7	178.6	-173.9	-176.3	0	112.8	N179 Y180 F181 F185 S186 A187 F418 E421	N179-K183 WeakPolarHBondContact O-CG 3.38Å; N179-K183 PolarHBondContact O-N 2.91Å; Y180-K183 PolarHBondContact O-N 3.39Å; F181-K183 VanDerWaalsContact C-N 3.34Å; F181-K183 PolarHBondContact O-N 3.31Å; K183-F185 VanDerWaalsContact C-N 3.33Å; K183-S186 PolarHBondContact O-N 3Å; K183-S186 PolarHBondContact O-OG 3.29Å; K183-A187 PolarHBondContact O-N 3.37Å; K183-F418 HydrophobicContact CD-CD2 3.93Å; K183-E421 WeakPolarHBondContact CE-OE2 3.37Å; K183-E421 IonicContact NZ-OE2 3.52Å; K183-E421 PolarHBondContact NZ-OE2 3.06Å
184	S	47.9	Very low	55.8	Low	5 Å²	5	42.1 Å²	42.1	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-38.2	171.7	-58.8	0	0	0	0	111.2	Y180 F181 A187 L188	Y180-S184 WeakPolarHBondContact O-CB 3.25Å; Y180-S184 PolarHBondContact O-N 3.36Å; Y180-S184 PolarHBondContact O-OG 3.24Å; F181-S184 PolarHBondContact O-N 3.42Å; S184-A187 PolarHBondContact O-N 3.48Å; S184-L188 WeakPolarHBondContact O-CG 3.04Å; S184-L188 PolarHBondContact O-N 3.37Å
185	F	50.2	Low	58.3	Low	79 Å²	79	43.1 Å²	43.1	35%	0.346	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-46.5	173.9	-178.1	-75.4	0	0	0	111.6	C158 F181 S182 K183 A187 T189	C158-F185 VanDerWaalsContact C-CD2 3.45Å; C158-F185 VanDerWaalsContact C-CE2 3.43Å; C158-F185 HydrophobicContact CB-CD2 3.22Å; C158-F185 HydrophobicContact CB-CE2 3.21Å; C158-F185 HydrophobicContact CB-CG 4.25Å; C158-F185 HydrophobicContact CB-CZ 4.25Å; C158-F185 WeakPolarHBondContact O-CD2 3.06Å; C158-F185 WeakPolarHBondContact O-CE2 2.89Å; C158-F185 WeakPolarHBondContact SG-CD2 3.26Å; F181-F185 VanDerWaalsContact O-CB 3.22Å; F181-F185 WeakPolarHBondContact O-CB 3.38Å; F181-F185 PolarHBondContact O-N 3.35Å; S182-F185 WeakPolarHBondContact O-CB 3.13Å; K183-F185 VanDerWaalsContact C-N 3.33Å; F185-A187 PolarHBondContact O-N 3.49Å; F185-T189 WeakPolarHBondContact CE1-OG1 2.91Å; F185-T189 WeakPolarHBondContact O-CB 3.43Å; F185-T189 PolarHBondContact O-N 3.27Å; F185-T189 PolarHBondContact O-OG1 3.01Å
186	S	61.5	Low	60.6	Low	45 Å²	45	39.4 Å²	39.4	32%	0.315	21%	0.205	S	C	.	.	H	α-helix	trans	-64.6	-40.5	-179.5	65.7	0	0	0	0	111.7	S182 K183 T189 E190	S182-S186 PolarHBondContact O-N 2.89Å; S182-S186 VanDerWaalsContact O-N 3.11Å; K183-S186 PolarHBondContact O-N 3Å; K183-S186 PolarHBondContact O-OG 3.29Å; S186-T189 WeakPolarHBondContact O-CB 2.78Å; S186-T189 PolarHBondContact O-N 3.38Å; S186-E190 WeakPolarHBondContact O-CB 3.35Å; S186-E190 PolarHBondContact O-N 2.97Å
187	A	62.3	Low	63	Low	4 Å²	4	36.2 Å²	36.2	3%	0.033	19%	0.189	C	C	.	.	H	α-helix	trans	-68.2	-44.6	177.8	0	0	0	0	0	112.9	F101 K183 S184 F185 T189 E190 I191	F101-A187 HydrophobicContact CD1-CB 3.96Å; F101-A187 HydrophobicContact CD2-CB 3.5Å; F101-A187 VanDerWaalsContact CD2-CB 3.5Å; F101-A187 HydrophobicContact CE1-CB 3.75Å; F101-A187 HydrophobicContact CE2-CB 3.27Å; F101-A187 HydrophobicContact CG-CB 3.85Å; F101-A187 HydrophobicContact CZ-CB 3.4Å; F101-A187 VanDerWaalsContact CZ-CB 3.4Å; K183-A187 PolarHBondContact O-N 3.37Å; S184-A187 PolarHBondContact O-N 3.48Å; F185-A187 PolarHBondContact O-N 3.49Å; A187-T189 VanDerWaalsContact C-N 3.28Å; A187-T189 PolarHBondContact O-N 2.82Å; A187-E190 PolarHBondContact O-N 2.95Å; A187-I191 WeakPolarHBondContact O-CB 3.35Å; A187-I191 WeakPolarHBondContact O-CD1 3.49Å; A187-I191 WeakPolarHBondContact O-CG1 3.3Å; A187-I191 PolarHBondContact O-N 3.3Å
188	L	64.8	Low	65.6	Low	4 Å²	4	32.9 Å²	32.9	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-39.3	175.7	-68.5	178.7	0	0	0	111.7	L98 M154 S184 I191 F192	L98-L188 HydrophobicContact CD1-CD2 3.66Å; M154-L188 HydrophobicContact CE-CD1 3.59Å; M154-L188 HydrophobicContact CE-CD2 3.34Å; M154-L188 HydrophobicContact CE-CG 4.1Å; M154-L188 HydrophobicContact SD-CD1 4.43Å; M154-L188 HydrophobicContact SD-CD2 3.77Å; S184-L188 WeakPolarHBondContact O-CG 3.04Å; S184-L188 PolarHBondContact O-N 3.37Å; L188-I191 PolarHBondContact O-N 2.85Å; L188-F192 HydrophobicContact CD2-CD2 4.27Å; L188-F192 HydrophobicContact CD2-CE2 4.11Å; L188-F192 PolarHBondContact O-N 3.23Å
189	T	68.7	Low	68.2	Low	42 Å²	42	32 Å²	32	26%	0.258	17%	0.166	S	C	.	.	H	α-helix	trans	-59.6	-48.2	173	-65.5	0	0	0	0	110.8	F185 S186 A187 I191 N193	F185-T189 WeakPolarHBondContact CE1-OG1 2.91Å; F185-T189 WeakPolarHBondContact O-CB 3.43Å; F185-T189 PolarHBondContact O-N 3.27Å; F185-T189 PolarHBondContact O-OG1 3.01Å; S186-T189 WeakPolarHBondContact O-CB 2.78Å; S186-T189 PolarHBondContact O-N 3.38Å; A187-T189 VanDerWaalsContact C-N 3.28Å; A187-T189 PolarHBondContact O-N 2.82Å; T189-I191 VanDerWaalsContact C-N 3.32Å; T189-I191 PolarHBondContact O-N 2.76Å; T189-N193 WeakPolarHBondContact CB-ND2 2.92Å; T189-N193 HydrophobicContact CG2-CB 4.27Å; T189-N193 WeakPolarHBondContact CG2-ND2 3.37Å; T189-N193 WeakPolarHBondContact O-CB 3.47Å; T189-N193 PolarHBondContact O-N 3.38Å; T189-N193 PolarHBondContact OG1-ND2 2.84Å
190	E	71.7	Confident	70.6	Confident	63 Å²	63	30 Å²	30	29%	0.294	16%	0.156	S	C	.	.	H	α-helix	trans	-65.8	-33	178.5	-170.7	179.1	172.2	0	0	112.8	S186 A187 V302 S410	S186-E190 WeakPolarHBondContact O-CB 3.35Å; S186-E190 PolarHBondContact O-N 2.97Å; A187-E190 PolarHBondContact O-N 2.95Å; E190-V302 HydrophobicContact CG-CB 4.18Å; E190-V302 HydrophobicContact CG-CG1 4.46Å; E190-V302 HydrophobicContact CG-CG2 3.88Å; E190-S410 VanDerWaalsContact OE1-CB 3.3Å; E190-S410 WeakPolarHBondContact OE1-CB 3.37Å; E190-S410 PolarHBondContact OE1-OG 3.1Å
191	I	73.5	Confident	73	Confident	8 Å²	8	32 Å²	32	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-77.6	-45.8	-177.3	-69.3	166.6	0	0	0	112	P97 L98 A187 L188 T189 S303 V304	P97-I191 HydrophobicContact CB-CD1 4.13Å; P97-I191 HydrophobicContact CB-CG1 4.03Å; P97-I191 HydrophobicContact CB-CG2 4.44Å; L98-I191 HydrophobicContact CB-CD1 4.21Å; L98-I191 HydrophobicContact CD1-CD1 4.12Å; A187-I191 WeakPolarHBondContact O-CB 3.35Å; A187-I191 WeakPolarHBondContact O-CD1 3.49Å; A187-I191 WeakPolarHBondContact O-CG1 3.3Å; A187-I191 PolarHBondContact O-N 3.3Å; L188-I191 PolarHBondContact O-N 2.85Å; T189-I191 VanDerWaalsContact C-N 3.32Å; T189-I191 PolarHBondContact O-N 2.76Å; I191-S303 WeakPolarHBondContact CG2-OG 3.35Å; I191-S303 PolarHBondContact O-OG 2.78Å; I191-V304 HydrophobicContact CG2-CB 4.25Å; I191-V304 HydrophobicContact CG2-CG2 4.16Å; I191-V304 PolarHBondContact O-N 3.19Å
192	F	80.4	Confident	75.6	Confident	7 Å²	7	31 Å²	31	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-115.1	-20.2	-166.6	-67.3	-74.8	0	0	0	115.3	L92 L98 M154 L188 G194 Q216 P300 V304 F396	L92-F192 HydrophobicContact CD2-CZ 3.85Å; L98-F192 HydrophobicContact CD2-CE2 4Å; L98-F192 HydrophobicContact CD2-CZ 4.14Å; M154-F192 HydrophobicContact SD-CD2 4Å; M154-F192 HydrophobicContact SD-CE2 3.61Å; M154-F192 HydrophobicContact SD-CZ 4.26Å; L188-F192 HydrophobicContact CD2-CD2 4.27Å; L188-F192 HydrophobicContact CD2-CE2 4.11Å; L188-F192 PolarHBondContact O-N 3.23Å; F192-G194 PolarHBondContact O-N 2.63Å; F192-Q216 HydrophobicContact CB-CB 4.42Å; F192-Q216 HydrophobicContact CB-CG 4.38Å; F192-P300 WeakPolarHBondContact O-CG 2.72Å; F192-V304 HydrophobicContact CD1-CB 4.03Å; F192-V304 HydrophobicContact CD1-CG1 4.15Å; F192-V304 HydrophobicContact CE1-CB 3.76Å; F192-V304 HydrophobicContact CE1-CG1 3.62Å; F192-F396 HydrophobicContact CE1-CD1 4.33Å; F192-F396 HydrophobicContact CE1-CE1 4.33Å
193	N	80.8	Confident	77.9	Confident	36 Å²	36	31.9 Å²	31.9	19%	0.193	16%	0.16	C	C	.	.			trans	-73.8	127.1	-173.4	-69.1	3.5	0	0	0	111.4	T189 V214 F215 Q216 P300	T189-N193 WeakPolarHBondContact CB-ND2 2.92Å; T189-N193 HydrophobicContact CG2-CB 4.27Å; T189-N193 WeakPolarHBondContact CG2-ND2 3.37Å; T189-N193 WeakPolarHBondContact O-CB 3.47Å; T189-N193 PolarHBondContact O-N 3.38Å; T189-N193 PolarHBondContact OG1-ND2 2.84Å; N193-V214 HydrophobicContact CB-CG1 3.77Å; N193-V214 WeakPolarHBondContact ND2-CG1 3.22Å; N193-F215 CarbonylContact C-O 3.53Å; N193-F215 VanDerWaalsContact CA-O 3.29Å; N193-F215 WeakPolarHBondContact CA-O 3.45Å; N193-Q216 WeakPolarHBondContact OD1-CG 3.46Å; N193-Q216 PolarHBondContact OD1-NE2 2.9Å; N193-P300 WeakPolarHBondContact O-CA 3.44Å
194	G	83.8	Confident	80.3	Confident	3 Å²	3	35.5 Å²	35.5	3%	0.031	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-178.3	158.7	0	0	0	0	0	110.7	F192 V214 F215 E298	F192-G194 PolarHBondContact O-N 2.63Å; G194-V214 WeakPolarHBondContact O-CA 3.49Å; G194-F215 VanDerWaalsContact CA-CE1 3.47Å; G194-F215 PolarHBondContact N-O 2.85Å; G194-F215 WeakPolarHBondContact O-CD1 3.38Å; G194-F215 PolarHBondContact O-N 3.15Å; G194-E298 CarbonylContact C-O 3.55Å; G194-E298 WeakPolarHBondContact CA-O 3.43Å
195	R	87.9	Confident	82.6	Confident	79 Å²	79	37.2 Å²	37.2	30%	0.298	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	139.6	177.5	-70.7	167.5	64.1	-161.6	4.3	112.5	D212 E213 V214 F215 L297 E298	R195-D212 IonicContact CZ-OD1 3.64Å; R195-D212 IonicContact CZ-OD2 2.74Å; R195-D212 IonicContact NE-OD1 3.43Å; R195-D212 PolarHBondContact NE-OD1 3.25Å; R195-D212 IonicContact NE-OD2 2.68Å; R195-D212 IonicContact NH2-OD1 3.01Å; R195-D212 IonicContact NH2-OD2 3.49Å; R195-D212 PolarHBondContact NH2-OD2 3.09Å; R195-E213 CarbonylContact C-O 3.52Å; R195-E213 WeakPolarHBondContact CA-O 3.36Å; R195-V214 HydrophobicContact CG-CG2 4.2Å; R195-F215 VanDerWaalsContact N-CE1 3.28Å; R195-L297 HydrophobicContact CB-CB 4.09Å; R195-L297 HydrophobicContact CB-CD1 4.5Å; R195-L297 WeakPolarHBondContact O-CB 3.29Å; R195-L297 PolarHBondContact O-N 3.11Å; R195-E298 HydrophobicContact CB-CB 4.16Å; R195-E298 VanDerWaalsContact CD-OE2 3.28Å; R195-E298 WeakPolarHBondContact CD-OE2 3.01Å; R195-E298 IonicContact CZ-OE1 3.76Å; R195-E298 IonicContact CZ-OE2 3.73Å; R195-E298 PolarHBondContact N-O 3.36Å; R195-E298 IonicContact NH1-OE1 2.72Å; R195-E298 PolarHBondContact NH1-OE1 3.48Å; R195-E298 IonicContact NH1-OE2 3.65Å; R195-E298 PolarHBondContact NH1-OE2 2.85Å; R195-E298 VanDerWaalsContact NH1-OE2 3.13Å; R195-E298 PolarHBondContact O-N 3.21Å; R195-E298 VanDerWaalsContact O-N 3.15Å
196	L	90	Very high	84.8	Confident	10 Å²	10	38.3 Å²	38.3	5%	0.052	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.6	174.9	-73	162.1	0	0	0	109.6	E213 F215 L218 F267 F268 K295 L296	L196-E213 HydrophobicContact CB-CB 4.44Å; L196-E213 PolarHBondContact N-O 3.42Å; L196-E213 PolarHBondContact O-N 2.81Å; L196-F215 HydrophobicContact CB-CD1 4.43Å; L196-F215 HydrophobicContact CD1-CB 4.21Å; L196-F215 HydrophobicContact CD1-CD1 3.7Å; L196-F215 HydrophobicContact CD1-CE1 4.37Å; L196-F215 HydrophobicContact CD1-CG 4.12Å; L196-F215 HydrophobicContact CG-CD1 3.55Å; L196-F215 HydrophobicContact CG-CE1 3.87Å; L196-F215 HydrophobicContact CG-CG 4.44Å; L196-L218 HydrophobicContact CD1-CD2 3.69Å; L196-L218 HydrophobicContact CD2-CD2 4.32Å; L196-L218 HydrophobicContact CG-CD2 4.32Å; L196-F267 HydrophobicContact CD1-CE1 4.42Å; L196-F267 HydrophobicContact CD1-CZ 4.23Å; L196-F267 HydrophobicContact CD2-CE1 4.12Å; L196-F268 HydrophobicContact CD2-CE1 3.99Å; L196-K295 CarbonylContact C-O 3.57Å; L196-K295 VanDerWaalsContact CA-O 3.31Å; L196-K295 WeakPolarHBondContact CA-O 3.4Å; L196-L296 HydrophobicContact CD2-CB 4.38Å; L196-L296 HydrophobicContact CD2-CD1 3.71Å; L196-L296 HydrophobicContact CG-CD1 4.28Å
197	L	92.9	Very high	86.4	Confident	34 Å²	34	43.2 Å²	43.2	18%	0.178	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	111.8	162.8	-172.4	68	0	0	0	108.3	E210 C294 K295 L297	L197-E210 HydrophobicContact CD1-CB 4.04Å; L197-C294 CarbonylContact O-C 3.56Å; L197-C294 WeakPolarHBondContact O-CA 2.93Å; L197-K295 HydrophobicContact CB-CB 4.42Å; L197-K295 PolarHBondContact N-O 2.82Å; L197-K295 PolarHBondContact O-N 2.5Å; L197-L297 HydrophobicContact CB-CD1 3.9Å; L197-L297 HydrophobicContact CB-CD2 3.87Å; L197-L297 HydrophobicContact CB-CG 3.8Å
198	S	92.8	Very high	88	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.028	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	112.2	171.7	-85.6	0	0	0	0	109.3	E210 M211 E213 K292	S198-E210 CarbonylContact O-C 3.58Å; S198-E210 WeakPolarHBondContact O-CA 3.07Å; S198-M211 PolarHBondContact N-O 3.25Å; S198-M211 PolarHBondContact O-N 3.4Å; S198-E213 VanDerWaalsContact CB-CD 3.46Å; S198-E213 VanDerWaalsContact CB-OE1 3.26Å; S198-E213 WeakPolarHBondContact CB-OE1 3.16Å; S198-E213 PolarHBondContact OG-OE1 3.41Å; S198-E213 PolarHBondContact OG-OE2 3.09Å; S198-K292 WeakPolarHBondContact OG-CE 3.4Å
199	S	95.4	Very high	89.4	Confident	15 Å²	15	49.3 Å²	49.3	11%	0.105	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.7	176.7	-55	0	0	0	0	109.9	S209 E210 K292 V293	S199-S209 CarbonylContact C-O 3.57Å; S199-S209 WeakPolarHBondContact CA-O 3.16Å; S199-E210 PolarHBondContact OG-OE1 3.23Å; S199-K292 CarbonylContact O-C 3.49Å; S199-K292 WeakPolarHBondContact O-CA 3.03Å; S199-V293 PolarHBondContact N-O 2.74Å; S199-V293 PolarHBondContact O-N 3.17Å
200	V	95.8	Very high	90.6	Very high	21 Å²	21	53.3 Å²	53.3	13%	0.127	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.5	177.2	-175.7	0	0	0	0	110.1	V208 S209 L273 Y279 V291 K292	V200-V208 WeakPolarHBondContact O-CA 3.11Å; V200-S209 PolarHBondContact N-O 2.87Å; V200-S209 PolarHBondContact O-N 3.17Å; V200-S209 PolarHBondContact O-OG 2.96Å; V200-L273 HydrophobicContact CG1-CD1 3.88Å; V200-Y279 HydrophobicContact CB-CE2 4.42Å; V200-Y279 HydrophobicContact CG1-CD1 4.05Å; V200-Y279 HydrophobicContact CG1-CD2 3.88Å; V200-Y279 HydrophobicContact CG1-CE1 3.81Å; V200-Y279 HydrophobicContact CG1-CE2 3.57Å; V200-Y279 HydrophobicContact CG1-CG 4.09Å; V200-V291 CarbonylContact C-O 3.56Å; V200-V291 WeakPolarHBondContact CA-O 3.34Å; V200-K292 HydrophobicContact CG2-CB 4.24Å; V200-K292 HydrophobicContact CG2-CG 4.08Å
201	K	97.1	Very high	91.6	Very high	85 Å²	85	55.9 Å²	55.9	37%	0.37	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.8	175.3	-175.5	177.8	178	-171.8	0	110.7	L203 V208 G290 V291	K201-L203 PolarHBondContact O-N 2.88Å; K201-V208 HydrophobicContact CB-CG2 4.11Å; K201-V208 HydrophobicContact CD-CG2 4.41Å; K201-V208 HydrophobicContact CG-CG2 4Å; K201-G290 CarbonylContact O-C 3.4Å; K201-G290 WeakPolarHBondContact O-CA 3.46Å; K201-V291 PolarHBondContact N-O 3.22Å; K201-V291 PolarHBondContact O-N 3.45Å
202	C	96.9	Very high	92.5	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	123.2	172.7	-171.2	0	0	0	0	110.3	H204 C205 Q206 R207 Y279 C281	C202-H204 PolarHBondContact O-N 2.81Å; C202-H204 PolarHBondContact SG-N 3.31Å; C202-C205 WeakPolarHBondContact CB-SG 3.29Å; C202-C205 PolarHBondContact SG-N 3.33Å; C202-Q206 WeakPolarHBondContact O-CA 3.37Å; C202-Q206 PolarHBondContact O-N 2.97Å; C202-R207 PolarHBondContact N-O 3.42Å; C202-Y279 WeakPolarHBondContact CA-OH 3.2Å; C202-Y279 WeakPolarHBondContact CB-OH 3.42Å; C202-Y279 PolarHBondContact N-OH 3.36Å; C202-Y279 VanDerWaalsContact N-OH 3.14Å; C202-C281 VanDerWaalsContact SG-SG 3.68Å
203	L	95.8	Very high	92.8	Very high	80 Å²	80	61.3 Å²	61.3	42%	0.419	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-13.3	176.9	-65.5	-178	0	0	0	113.2	K201 Q206 N289 V291	K201-L203 PolarHBondContact O-N 2.88Å; L203-Q206 PolarHBondContact O-NE2 2.94Å; L203-N289 HydrophobicContact CB-CB 4.5Å; L203-N289 HydrophobicContact CD1-CB 4.17Å; L203-N289 PolarHBondContact N-O 3.48Å; L203-V291 HydrophobicContact CD1-CG2 4.16Å; L203-V291 HydrophobicContact CD2-CG2 3.89Å; L203-V291 HydrophobicContact CG-CG2 4.23Å
204	H	95.5	Very high	93	Very high	122 Å²	122	63.9 Å²	63.9	57%	0.565	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-54.3	177.3	-176.6	67	0	0	0	113.2	C202 R288	C202-H204 PolarHBondContact O-N 2.81Å; C202-H204 PolarHBondContact SG-N 3.31Å; H204-R288 HydrophobicContact CB-CG 4.47Å; H204-R288 PolarHBondContact NE2-NH2 3.4Å
205	C	96.2	Very high	93	Very high	41 Å²	41	64.5 Å²	64.5	28%	0.277	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.2	-178.3	71.1	0	0	0	0	114.1	C202 R207	C202-C205 WeakPolarHBondContact CB-SG 3.29Å; C202-C205 PolarHBondContact SG-N 3.33Å; C205-R207 PolarHBondContact O-N 2.63Å
206	Q	96.2	Very high	92.7	Very high	102 Å²	102	61.1 Å²	61.1	48%	0.477	31%	0.31	S	S	.	.			trans	62.5	-0.4	179.2	-57	-64.5	-49.2	0	0	115.8	C202 L203 V208	C202-Q206 WeakPolarHBondContact O-CA 3.37Å; C202-Q206 PolarHBondContact O-N 2.97Å; L203-Q206 PolarHBondContact O-NE2 2.94Å; Q206-V208 PolarHBondContact O-N 2.8Å
207	R	95.7	Very high	92.5	Very high	147 Å²	147	62.4 Å²	62.4	56%	0.555	32%	0.317	S	S	*	.			trans	-64.4	134.1	175.1	-174.9	177	-69.4	-103	1.3	110.4	C202 C205 H283	C202-R207 PolarHBondContact N-O 3.42Å; C205-R207 PolarHBondContact O-N 2.63Å; R207-H283 PolarHBondContact NE-CD2 3.39Å; R207-H283 PolarHBondContact NH2-CD2 3.38Å; R207-H283 VanDerWaalsContact NH2-CD2 3.33Å
208	V	95.7	Very high	92.2	Very high	77 Å²	77	60.8 Å²	60.8	47%	0.467	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.8	169.8	-176.7	0	0	0	0	108.3	V200 K201 Q206 E210	V200-V208 WeakPolarHBondContact O-CA 3.11Å; K201-V208 HydrophobicContact CB-CG2 4.11Å; K201-V208 HydrophobicContact CD-CG2 4.41Å; K201-V208 HydrophobicContact CG-CG2 4Å; Q206-V208 PolarHBondContact O-N 2.8Å; V208-E210 HydrophobicContact CG1-CG 4.05Å
209	S	94.2	Very high	92.1	Very high	60 Å²	60	62.2 Å²	62.2	42%	0.42	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.2	169	50.9	0	0	0	0	108.6	S199 V200	S199-S209 CarbonylContact C-O 3.57Å; S199-S209 WeakPolarHBondContact CA-O 3.16Å; V200-S209 PolarHBondContact N-O 2.87Å; V200-S209 PolarHBondContact O-N 3.17Å; V200-S209 PolarHBondContact O-OG 2.96Å
210	E	95.2	Very high	91.9	Very high	125 Å²	125	61.5 Å²	61.5	58%	0.584	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.6	179.2	-54.3	-166.4	131.7	0	0	109.8	L197 S198 S199 V208	L197-E210 HydrophobicContact CD1-CB 4.04Å; S198-E210 CarbonylContact O-C 3.58Å; S198-E210 WeakPolarHBondContact O-CA 3.07Å; S199-E210 PolarHBondContact OG-OE1 3.23Å; V208-E210 HydrophobicContact CG1-CG 4.05Å
211	M	92.5	Very high	91.7	Very high	117 Å²	117	62.1 Å²	62.1	58%	0.576	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.1	178.9	-174	170	174.8	0	0	109.4	S198 E213	S198-M211 PolarHBondContact N-O 3.25Å; S198-M211 PolarHBondContact O-N 3.4Å; M211-E213 HydrophobicContact CB-CG 4.39Å; M211-E213 HydrophobicContact CE-CG 4.35Å; M211-E213 HydrophobicContact CG-CG 3.88Å; M211-E213 HydrophobicContact SD-CG 4.27Å
212	D	92.5	Very high	91.5	Very high	73 Å²	73	58.3 Å²	58.3	39%	0.39	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116.8	170.5	-161	-41	0	0	0	108.6	R195	R195-D212 IonicContact CZ-OD1 3.64Å; R195-D212 IonicContact CZ-OD2 2.74Å; R195-D212 IonicContact NE-OD1 3.43Å; R195-D212 PolarHBondContact NE-OD1 3.25Å; R195-D212 IonicContact NE-OD2 2.68Å; R195-D212 IonicContact NH2-OD1 3.01Å; R195-D212 IonicContact NH2-OD2 3.49Å; R195-D212 PolarHBondContact NH2-OD2 3.09Å
213	E	86.8	Confident	91.2	Very high	56 Å²	56	58.8 Å²	58.8	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124	-172.5	-66	176.1	175.4	0	0	109.4	R195 L196 S198 M211	R195-E213 CarbonylContact C-O 3.52Å; R195-E213 WeakPolarHBondContact CA-O 3.36Å; L196-E213 HydrophobicContact CB-CB 4.44Å; L196-E213 PolarHBondContact N-O 3.42Å; L196-E213 PolarHBondContact O-N 2.81Å; S198-E213 VanDerWaalsContact CB-CD 3.46Å; S198-E213 VanDerWaalsContact CB-OE1 3.26Å; S198-E213 WeakPolarHBondContact CB-OE1 3.16Å; S198-E213 PolarHBondContact OG-OE1 3.41Å; S198-E213 PolarHBondContact OG-OE2 3.09Å; M211-E213 HydrophobicContact CB-CG 4.39Å; M211-E213 HydrophobicContact CE-CG 4.35Å; M211-E213 HydrophobicContact CG-CG 3.88Å; M211-E213 HydrophobicContact SD-CG 4.27Å
214	V	84.6	Confident	90.8	Very high	91 Å²	91	57.1 Å²	57.1	55%	0.552	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.3	169.5	179.7	0	0	0	0	108.9	N193 G194 R195	N193-V214 HydrophobicContact CB-CG1 3.77Å; N193-V214 WeakPolarHBondContact ND2-CG1 3.22Å; G194-V214 WeakPolarHBondContact O-CA 3.49Å; R195-V214 HydrophobicContact CG-CG2 4.2Å
215	F	84	Confident	90.2	Very high	16 Å²	16	58.3 Å²	58.3	7%	0.07	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.9	176.1	73.5	-92	0	0	0	111.2	N193 G194 R195 L196 L218 L296 L305	N193-F215 CarbonylContact C-O 3.53Å; N193-F215 VanDerWaalsContact CA-O 3.29Å; N193-F215 WeakPolarHBondContact CA-O 3.45Å; G194-F215 VanDerWaalsContact CA-CE1 3.47Å; G194-F215 PolarHBondContact N-O 2.85Å; G194-F215 WeakPolarHBondContact O-CD1 3.38Å; G194-F215 PolarHBondContact O-N 3.15Å; R195-F215 VanDerWaalsContact N-CE1 3.28Å; L196-F215 HydrophobicContact CB-CD1 4.43Å; L196-F215 HydrophobicContact CD1-CB 4.21Å; L196-F215 HydrophobicContact CD1-CD1 3.7Å; L196-F215 HydrophobicContact CD1-CE1 4.37Å; L196-F215 HydrophobicContact CD1-CG 4.12Å; L196-F215 HydrophobicContact CG-CD1 3.55Å; L196-F215 HydrophobicContact CG-CE1 3.87Å; L196-F215 HydrophobicContact CG-CG 4.44Å; F215-L218 HydrophobicContact CB-CD2 4.49Å; F215-L218 HydrophobicContact CD1-CD2 4.05Å; F215-L218 HydrophobicContact CD2-CD2 3.57Å; F215-L218 HydrophobicContact CD2-CG 3.81Å; F215-L218 HydrophobicContact CE1-CD2 4.12Å; F215-L218 HydrophobicContact CE2-CD1 4.12Å; F215-L218 HydrophobicContact CE2-CD2 3.69Å; F215-L218 HydrophobicContact CE2-CG 3.61Å; F215-L218 HydrophobicContact CG-CD2 3.77Å; F215-L218 HydrophobicContact CZ-CD1 4.24Å; F215-L218 HydrophobicContact CZ-CD2 3.96Å; F215-L218 HydrophobicContact CZ-CG 4.12Å; F215-L296 HydrophobicContact CE1-CD1 3.45Å; F215-L296 VanDerWaalsContact CE1-CD1 3.45Å; F215-L296 HydrophobicContact CZ-CD1 3.65Å; F215-L305 HydrophobicContact CE2-CD1 4.04Å
216	Q	80.2	Confident	89.6	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.033	30%	0.302	C	S	.	.	S	Bend	trans	-105.2	-23.3	170.8	-74.8	178	-13.2	0	0	112.2	N155 F192 N193	N155-Q216 VanDerWaalsContact CB-OE1 3.3Å; N155-Q216 VanDerWaalsContact CG-CD 3.49Å; N155-Q216 PolarHBondContact ND2-OE1 3.28Å; N155-Q216 VanDerWaalsContact OD1-CD 3.29Å; N155-Q216 PolarHBondContact OD1-NE2 2.79Å; N155-Q216 PolarHBondContact OD1-OE1 2.82Å; F192-Q216 HydrophobicContact CB-CB 4.42Å; F192-Q216 HydrophobicContact CB-CG 4.38Å; N193-Q216 WeakPolarHBondContact OD1-CG 3.46Å; N193-Q216 PolarHBondContact OD1-NE2 2.9Å
217	D	86	Confident	89.1	Confident	37 Å²	37	58.4 Å²	58.4	20%	0.198	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	155	171.3	70.6	-75.7	0	0	0	110.8	I151 S219 C306	I151-D217 HydrophobicContact CD1-CB 4.04Å; I151-D217 HydrophobicContact CG2-CB 4.04Å; I151-D217 WeakPolarHBondContact CG2-OD1 3.47Å; D217-S219 PolarHBondContact OD2-OG 3.37Å; D217-C306 CarbonylContact C-O 3.44Å; D217-C306 VanDerWaalsContact CA-O 3.23Å; D217-C306 WeakPolarHBondContact CA-O 3.17Å; D217-C306 HydrophobicContact CB-CB 4.04Å
218	L	87.6	Confident	88.6	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	112.3	166.2	-62.5	176.9	0	0	0	109.1	L196 F215 L220 F264 F267 L305 C306 L307 H308	L196-L218 HydrophobicContact CD1-CD2 3.69Å; L196-L218 HydrophobicContact CD2-CD2 4.32Å; L196-L218 HydrophobicContact CG-CD2 4.32Å; F215-L218 HydrophobicContact CB-CD2 4.49Å; F215-L218 HydrophobicContact CD1-CD2 4.05Å; F215-L218 HydrophobicContact CD2-CD2 3.57Å; F215-L218 HydrophobicContact CD2-CG 3.81Å; F215-L218 HydrophobicContact CE1-CD2 4.12Å; F215-L218 HydrophobicContact CE2-CD1 4.12Å; F215-L218 HydrophobicContact CE2-CD2 3.69Å; F215-L218 HydrophobicContact CE2-CG 3.61Å; F215-L218 HydrophobicContact CG-CD2 3.77Å; F215-L218 HydrophobicContact CZ-CD1 4.24Å; F215-L218 HydrophobicContact CZ-CD2 3.96Å; F215-L218 HydrophobicContact CZ-CG 4.12Å; L218-L220 HydrophobicContact CB-CD2 4.07Å; L218-L220 PolarHBondContact O-N 3.15Å; L218-F264 HydrophobicContact CD1-CE1 3.91Å; L218-F267 HydrophobicContact CD2-CE1 4.25Å; L218-F267 HydrophobicContact CD2-CZ 4.15Å; L218-L305 HydrophobicContact CD1-CD1 4.14Å; L218-L305 HydrophobicContact CG-CD1 4.48Å; L218-C306 PolarHBondContact N-O 3.46Å; L218-L307 HydrophobicContact CB-CD2 3.85Å; L218-L307 HydrophobicContact CD1-CD2 4.15Å; L218-L307 HydrophobicContact CG-CD2 4.39Å; L218-H308 PolarHBondContact O-N 2.98Å
219	S	90	Very high	88.1	Confident	33 Å²	33	52.7 Å²	52.7	23%	0.231	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	91.6	175.1	-74.1	0	0	0	0	110.7	D217 H308 K310	D217-S219 PolarHBondContact OD2-OG 3.37Å; S219-H308 CarbonylContact C-O 3.6Å; S219-H308 VanDerWaalsContact CA-O 3.28Å; S219-H308 WeakPolarHBondContact CA-O 3.22Å; S219-H308 PolarHBondContact OG-ND1 3.34Å; S219-K310 VanDerWaalsContact O-CE 3.22Å; S219-K310 WeakPolarHBondContact O-CE 3.37Å
220	L	91.6	Very high	87.5	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.4	-174.1	-56.2	-179.1	0	0	0	112.2	L218 L260 C263 F264 F267 L307 H308 K310	L218-L220 HydrophobicContact CB-CD2 4.07Å; L218-L220 PolarHBondContact O-N 3.15Å; L220-L260 HydrophobicContact CD1-CD1 3.7Å; L220-C263 HydrophobicContact CB-CB 4.11Å; L220-C263 HydrophobicContact CD1-CB 4.22Å; L220-F264 HydrophobicContact CD1-CD1 4.3Å; L220-F264 HydrophobicContact CD1-CD2 4.38Å; L220-F264 HydrophobicContact CD1-CE1 4.04Å; L220-F264 HydrophobicContact CD1-CE2 4.1Å; L220-F264 HydrophobicContact CD1-CG 4.46Å; L220-F264 HydrophobicContact CD1-CZ 3.94Å; L220-F264 HydrophobicContact CD2-CD1 3.77Å; L220-F264 HydrophobicContact CD2-CE1 3.82Å; L220-F264 HydrophobicContact CD2-CG 4.47Å; L220-F267 HydrophobicContact CD2-CB 3.96Å; L220-F267 HydrophobicContact CD2-CD2 4.14Å; L220-F267 HydrophobicContact CD2-CG 3.97Å; L220-L307 HydrophobicContact CD1-CB 4.37Å; L220-L307 HydrophobicContact CD1-CD1 4.37Å; L220-L307 HydrophobicContact CD1-CD2 4.33Å; L220-H308 PolarHBondContact N-O 3.4Å; L220-K310 PolarHBondContact O-N 2.88Å
221	P	92	Very high	86.8	Confident	33 Å²	33	52 Å²	52	21%	0.214	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-71	147.2	170	31.8	-34.5	0	0	0	110.7	T266 F267	P221-T266 HydrophobicContact CB-CG2 4.37Å; P221-T266 HydrophobicContact CG-CG2 3.73Å; P221-F267 HydrophobicContact CG-CB 4.46Å
222	I	92.3	Very high	86.2	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-84.3	120.8	167.3	-56.5	-179.2	0	0	0	107.3	V309 R311 I322 T324 I326	I222-V309 HydrophobicContact CD1-CG1 3.62Å; I222-V309 HydrophobicContact CG1-CG1 3.58Å; I222-R311 HydrophobicContact CD1-CG 3.9Å; I222-I322 HydrophobicContact CB-CD1 4.46Å; I222-I322 HydrophobicContact CB-CG2 4.48Å; I222-I322 HydrophobicContact CD1-CB 3.93Å; I222-I322 HydrophobicContact CD1-CD1 4.25Å; I222-I322 HydrophobicContact CD1-CG2 3.63Å; I222-I322 HydrophobicContact CG2-CG2 4.25Å; I222-T324 HydrophobicContact CG2-CG2 4.28Å; I222-I326 HydrophobicContact CD1-CD1 4.12Å; I222-I326 HydrophobicContact CG1-CD1 3.97Å
223	P	91.6	Very high	85.4	Confident	10 Å²	10	46.4 Å²	46.4	7%	0.065	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-62.1	138.8	-179.1	21.7	-30.9	0	0	0	111.9	Q227 L228 V258 D262 T266	P223-Q227 HydrophobicContact CB-CB 4.15Å; P223-L228 HydrophobicContact CB-CD2 3.82Å; P223-L228 HydrophobicContact CB-CG 3.94Å; P223-L228 HydrophobicContact CG-CD2 3.62Å; P223-L228 HydrophobicContact CG-CG 4.11Å; P223-V258 HydrophobicContact CG-CG1 3.71Å; P223-D262 HydrophobicContact CG-CB 4.14Å; P223-T266 HydrophobicContact CB-CG2 4.48Å; P223-T266 WeakPolarHBondContact CB-OG1 3.32Å
224	S	86.9	Confident	84.7	Confident	46 Å²	46	47 Å²	47	32%	0.322	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-71.3	163.9	164.2	78.7	0	0	0	0	110.6	Q226 Q227 L228	S224-Q226 VanDerWaalsContact C-N 3.27Å; S224-Q226 PolarHBondContact O-N 2.87Å; S224-Q226 PolarHBondContact OG-N 3.35Å; S224-Q227 WeakPolarHBondContact O-CB 3.48Å; S224-Q227 PolarHBondContact O-N 2.87Å; S224-Q227 VanDerWaalsContact O-N 3.09Å; S224-Q227 WeakPolarHBondContact OG-CG 3.34Å; S224-Q227 PolarHBondContact OG-N 2.84Å; S224-L228 PolarHBondContact O-N 3.45Å
225	R	83.2	Confident	83.8	Confident	147 Å²	147	46.8 Å²	46.8	56%	0.555	26%	0.257	S	S	*	.	H	α-helix	trans	-54.7	-44	174.4	-178.2	-179.6	173.9	139.6	3.4	112.3	Q227 L228 E229	R225-Q227 VanDerWaalsContact C-N 3.31Å; R225-Q227 PolarHBondContact O-N 2.87Å; R225-L228 WeakPolarHBondContact O-CB 3.5Å; R225-L228 PolarHBondContact O-N 3.15Å; R225-E229 WeakPolarHBondContact CG-OE1 3.49Å; R225-E229 IonicContact CZ-OE1 3.79Å; R225-E229 IonicContact NE-OE1 2.94Å; R225-E229 PolarHBondContact NE-OE1 2.98Å; R225-E229 IonicContact NH2-OE1 3.72Å; R225-E229 WeakPolarHBondContact O-CG 3.49Å; R225-E229 PolarHBondContact O-N 2.86Å
226	Q	83.1	Confident	82.7	Confident	71 Å²	71	52.5 Å²	52.5	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-38	177.9	-68.6	172.5	-11.3	0	0	111.9	S224 E229 Y230 Q243	S224-Q226 VanDerWaalsContact C-N 3.27Å; S224-Q226 PolarHBondContact O-N 2.87Å; S224-Q226 PolarHBondContact OG-N 3.35Å; Q226-E229 PolarHBondContact O-N 3.36Å; Q226-Y230 WeakPolarHBondContact O-CB 3.21Å; Q226-Y230 PolarHBondContact O-N 2.74Å; Q226-Q243 PolarHBondContact NE2-O 3.46Å; Q226-Q243 VanDerWaalsContact NE2-O 3.1Å
227	Q	85.7	Confident	81.1	Confident	74 Å²	74	55.8 Å²	55.8	35%	0.346	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-40.9	175.3	-71.5	174.7	-54.3	0	0	111.3	P223 S224 R225 Y230 L231	P223-Q227 HydrophobicContact CB-CB 4.15Å; S224-Q227 WeakPolarHBondContact O-CB 3.48Å; S224-Q227 PolarHBondContact O-N 2.87Å; S224-Q227 VanDerWaalsContact O-N 3.09Å; S224-Q227 WeakPolarHBondContact OG-CG 3.34Å; S224-Q227 PolarHBondContact OG-N 2.84Å; R225-Q227 VanDerWaalsContact C-N 3.31Å; R225-Q227 PolarHBondContact O-N 2.87Å; Q227-Y230 PolarHBondContact O-N 2.77Å; Q227-L231 WeakPolarHBondContact O-CB 3.2Å; Q227-L231 WeakPolarHBondContact O-CG 3.33Å; Q227-L231 PolarHBondContact O-N 2.96Å
228	L	85.9	Confident	78.9	Confident	27 Å²	27	58.6 Å²	58.6	14%	0.141	34%	0.343	C	S	.	.	H	α-helix	trans	-61.8	-44.3	174.1	-66.8	171.6	0	0	0	111.8	P223 S224 R225 Y230 L231 A232 V256 V258 D262	P223-L228 HydrophobicContact CB-CD2 3.82Å; P223-L228 HydrophobicContact CB-CG 3.94Å; P223-L228 HydrophobicContact CG-CD2 3.62Å; P223-L228 HydrophobicContact CG-CG 4.11Å; S224-L228 PolarHBondContact O-N 3.45Å; R225-L228 WeakPolarHBondContact O-CB 3.5Å; R225-L228 PolarHBondContact O-N 3.15Å; L228-Y230 VanDerWaalsContact C-N 3.34Å; L228-Y230 PolarHBondContact O-N 2.75Å; L228-L231 PolarHBondContact O-N 2.96Å; L228-A232 WeakPolarHBondContact O-CB 3.33Å; L228-A232 PolarHBondContact O-N 2.83Å; L228-V256 HydrophobicContact CD1-CG1 3.66Å; L228-V258 HydrophobicContact CD1-CG2 3.97Å; L228-D262 HydrophobicContact CD2-CB 3.83Å
229	E	84.6	Confident	76.6	Confident	76 Å²	76	68.1 Å²	68.1	36%	0.355	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-41.1	176.7	-71.7	169.3	-175.8	0	0	111.4	R225 Q226 A232 A233	R225-E229 WeakPolarHBondContact CG-OE1 3.49Å; R225-E229 IonicContact CZ-OE1 3.79Å; R225-E229 IonicContact NE-OE1 2.94Å; R225-E229 PolarHBondContact NE-OE1 2.98Å; R225-E229 IonicContact NH2-OE1 3.72Å; R225-E229 WeakPolarHBondContact O-CG 3.49Å; R225-E229 PolarHBondContact O-N 2.86Å; Q226-E229 PolarHBondContact O-N 3.36Å; E229-A232 PolarHBondContact O-N 3.44Å; E229-A233 VanDerWaalsContact O-CB 3.23Å; E229-A233 WeakPolarHBondContact O-CB 3.41Å; E229-A233 PolarHBondContact O-N 2.78Å
230	Y	81.7	Confident	74.2	Confident	134 Å²	134	68.9 Å²	68.9	53%	0.525	39%	0.393	S	S	.	.	H	α-helix	trans	-64.8	-41.4	174.4	178.6	-95.8	0	0	0	112.9	Q226 Q227 L228 A233 S234	Q226-Y230 WeakPolarHBondContact O-CB 3.21Å; Q226-Y230 PolarHBondContact O-N 2.74Å; Q227-Y230 PolarHBondContact O-N 2.77Å; L228-Y230 VanDerWaalsContact C-N 3.34Å; L228-Y230 PolarHBondContact O-N 2.75Å; Y230-A233 PolarHBondContact O-N 2.92Å; Y230-S234 WeakPolarHBondContact O-CB 3.38Å; Y230-S234 PolarHBondContact O-N 2.78Å; Y230-S234 PolarHBondContact O-OG 2.76Å
231	L	80.5	Confident	71.7	Confident	38 Å²	38	77 Å²	77	20%	0.199	44%	0.435	C	S	.	.	H	α-helix	trans	-65.5	-42.3	177	-72.9	173.6	0	0	0	111.4	Q227 L228 S234 A235	Q227-L231 WeakPolarHBondContact O-CB 3.2Å; Q227-L231 WeakPolarHBondContact O-CG 3.33Å; Q227-L231 PolarHBondContact O-N 2.96Å; L228-L231 PolarHBondContact O-N 2.96Å; L231-S234 PolarHBondContact O-N 3.45Å; L231-A235 PolarHBondContact O-N 3.15Å
232	A	79.2	Confident	69	Low	57 Å²	57	81.9 Å²	81.9	47%	0.471	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-46.3	175	0	0	0	0	0	111.7	L228 E229 S234 A235 D236	L228-A232 WeakPolarHBondContact O-CB 3.33Å; L228-A232 PolarHBondContact O-N 2.83Å; E229-A232 PolarHBondContact O-N 3.44Å; A232-S234 VanDerWaalsContact C-N 3.29Å; A232-S234 PolarHBondContact O-N 3.47Å; A232-A235 PolarHBondContact O-N 3.1Å; A232-A235 VanDerWaalsContact O-N 3.13Å; A232-D236 PolarHBondContact O-N 2.79Å; A232-D236 VanDerWaalsContact O-N 3.12Å
233	A	75.9	Confident	66.2	Low	14 Å²	14	90 Å²	90	12%	0.116	50%	0.497	C	S	.	.	H	α-helix	trans	-57.4	-39.1	174.8	0	0	0	0	0	113.5	E229 Y230 A235 D236 G237 T238 A240	E229-A233 VanDerWaalsContact O-CB 3.23Å; E229-A233 WeakPolarHBondContact O-CB 3.41Å; E229-A233 PolarHBondContact O-N 2.78Å; Y230-A233 PolarHBondContact O-N 2.92Å; A233-A235 VanDerWaalsContact C-N 3.33Å; A233-D236 PolarHBondContact O-N 2.97Å; A233-G237 PolarHBondContact O-N 3.13Å; A233-G237 VanDerWaalsContact O-N 3.07Å; A233-T238 WeakPolarHBondContact CA-O 3.45Å; A233-T238 WeakPolarHBondContact CB-O 3.31Å; A233-T238 PolarHBondContact O-N 3.14Å; A233-A240 HydrophobicContact CB-CB 3.62Å
234	S	71.8	Confident	63.6	Low	70 Å²	70	97.9 Å²	97.9	49%	0.49	53%	0.533	S	S	.	.	H	α-helix	trans	-70.2	-29.4	178.8	-60.4	0	0	0	0	112.5	Y230 L231 A232	Y230-S234 WeakPolarHBondContact O-CB 3.38Å; Y230-S234 PolarHBondContact O-N 2.78Å; Y230-S234 PolarHBondContact O-OG 2.76Å; L231-S234 PolarHBondContact O-N 3.45Å; A232-S234 VanDerWaalsContact C-N 3.29Å; A232-S234 PolarHBondContact O-N 3.47Å
235	A	66.1	Low	61.3	Low	85 Å²	85	102.1 Å²	102.1	70%	0.702	55%	0.552	S	S	*	*	H	α-helix	trans	-74.2	-39.4	174.8	0	0	0	0	0	112.3	L231 A232 A233	L231-A235 PolarHBondContact O-N 3.15Å; A232-A235 PolarHBondContact O-N 3.1Å; A232-A235 VanDerWaalsContact O-N 3.13Å; A233-A235 VanDerWaalsContact C-N 3.33Å
236	D	60	Low	59.2	Low	137 Å²	137	104.8 Å²	104.8	73%	0.733	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	8.4	-178.4	-80.1	-12.6	0	0	0	114	A232 A233 T238	A232-D236 PolarHBondContact O-N 2.79Å; A232-D236 VanDerWaalsContact O-N 3.12Å; A233-D236 PolarHBondContact O-N 2.97Å; D236-T238 PolarHBondContact O-N 3.5Å; D236-T238 PolarHBondContact O-OG1 3.41Å
237	G	47	Very low	57.4	Low	75 Å²	75	108.7 Å²	108.7	77%	0.773	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.6	15.5	178.1	0	0	0	0	0	115	A233	A233-G237 PolarHBondContact O-N 3.13Å; A233-G237 VanDerWaalsContact O-N 3.07Å
238	T	41.3	Very low	55.7	Low	96 Å²	96	110.3 Å²	110.3	59%	0.589	60%	0.599	S	S	*	*			trans	-114.9	113.7	-172.5	-52	0	0	0	0	109.3	A233 D236 A240	A233-T238 WeakPolarHBondContact CA-O 3.45Å; A233-T238 WeakPolarHBondContact CB-O 3.31Å; A233-T238 PolarHBondContact O-N 3.14Å; D236-T238 PolarHBondContact O-N 3.5Å; D236-T238 PolarHBondContact O-OG1 3.41Å; T238-A240 PolarHBondContact O-N 3.13Å; T238-A240 VanDerWaalsContact O-N 3.12Å
239	K	37.7	Very low	53.7	Low	201 Å²	201	115.2 Å²	115.2	87%	0.874	62%	0.624	S	S	*	*			trans	-59.4	112.5	-179.6	-74	-179.4	175.1	179.5	0	111.5
240	A	40.9	Very low	51.4	Low	50 Å²	50	113.2 Å²	113.2	41%	0.413	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-70	129.5	169	0	0	0	0	0	110.9	A233 T238	A233-A240 HydrophobicContact CB-CB 3.62Å; T238-A240 PolarHBondContact O-N 3.13Å; T238-A240 VanDerWaalsContact O-N 3.12Å
241	L	38.2	Very low	49.6	Very low	171 Å²	171	110.6 Å²	110.6	90%	0.895	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-82.3	123.4	171.8	-79.1	159.7	0	0	0	109.1
242	L	36.6	Very low	47.7	Very low	135 Å²	135	116.4 Å²	116.4	71%	0.707	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-73.2	128.9	-179.7	-67.3	161.5	0	0	0	111.2
243	Q	33.2	Very low	45.9	Very low	177 Å²	177	120.4 Å²	120.4	83%	0.827	65%	0.65	S	S	*	*			trans	-119.4	135.8	157.9	-80	-176.4	-14.9	0	0	109.1	Q226	Q226-Q243 PolarHBondContact NE2-O 3.46Å; Q226-Q243 VanDerWaalsContact NE2-O 3.1Å
244	E	35.9	Very low	44.6	Very low	175 Å²	175	122.2 Å²	122.2	82%	0.818	66%	0.662	S	S	*	*			trans	-80.4	145.4	-175.9	-71.9	173.7	158.4	0	0	112.5
245	D	38.6	Very low	43.7	Very low	135 Å²	135	121.6 Å²	121.6	72%	0.722	67%	0.666	S	S	*	*			trans	64	94.3	150.7	-60.8	-10.5	0	0	0	121.4
246	Q	38.8	Very low	43.7	Very low	203 Å²	203	120.7 Å²	120.7	95%	0.949	65%	0.652	S	S	*	*			trans	-152.8	108.5	139.1	-117.5	177.3	-4.1	0	0	111.4
247	E	45.2	Very low	44.7	Very low	152 Å²	152	120.4 Å²	120.4	71%	0.71	65%	0.646	S	S	*	*			trans	-75.5	144.6	-172.9	-65.1	-174.4	145.8	0	0	114.7	I249	E247-I249 VanDerWaalsContact C-N 3.33Å; E247-I249 PolarHBondContact O-N 3.33Å
248	D	50.6	Low	46.8	Very low	108 Å²	108	117.2 Å²	117.2	58%	0.578	61%	0.611	S	S	*	*	S	Bend	trans	56.6	-14	150.4	-74.7	-15.6	0	0	0	122.9	W251	D248-W251 PolarHBondContact O-NE1 3.14Å
249	I	44.2	Very low	49.3	Very low	130 Å²	130	114.6 Å²	114.6	67%	0.667	60%	0.595	S	S	*	*	S	Bend	trans	-92.5	-24	177	-60.8	170.2	0	0	0	111.9	E247 W251 I253	E247-I249 VanDerWaalsContact C-N 3.33Å; E247-I249 PolarHBondContact O-N 3.33Å; I249-W251 PolarHBondContact O-N 3.4Å; I249-I253 HydrophobicContact CG2-CD1 4.22Å
250	G	36.1	Very low	51.9	Low	35 Å²	35	105 Å²	105	36%	0.361	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-72.5	-19.8	-170.1	0	0	0	0	0	116.1	F252 I253 S254	G250-F252 PolarHBondContact O-N 3.42Å; G250-I253 PolarHBondContact O-N 3.43Å; G250-I253 VanDerWaalsContact O-N 3.14Å; G250-S254 WeakPolarHBondContact O-CB 3.41Å; G250-S254 PolarHBondContact O-N 3.38Å
251	W	43.3	Very low	54.3	Low	79 Å²	79	105.8 Å²	105.8	30%	0.299	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-69.4	-33.2	-174	67.7	-93.7	0	0	0	113	D248 I249 I253	D248-W251 PolarHBondContact O-NE1 3.14Å; I249-W251 PolarHBondContact O-N 3.4Å; W251-I253 VanDerWaalsContact C-N 3.28Å; W251-I253 PolarHBondContact O-N 2.89Å
252	F	40.6	Very low	56.8	Low	160 Å²	160	99.6 Å²	99.6	70%	0.702	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-70.9	-24	173.5	-83.7	-70.8	0	0	0	113.1	G250	G250-F252 PolarHBondContact O-N 3.42Å
253	I	41.8	Very low	59.5	Low	140 Å²	140	93.2 Å²	93.2	72%	0.718	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-25.2	-171.3	-51.9	178.4	0	0	0	111.3	I249 G250 W251	I249-I253 HydrophobicContact CG2-CD1 4.22Å; G250-I253 PolarHBondContact O-N 3.43Å; G250-I253 VanDerWaalsContact O-N 3.14Å; W251-I253 VanDerWaalsContact C-N 3.28Å; W251-I253 PolarHBondContact O-N 2.89Å
254	S	49.2	Very low	62.3	Low	53 Å²	53	85.2 Å²	85.2	37%	0.371	45%	0.448	S	S	.	.	S	Bend	trans	-98.1	-2.4	-169.6	-164.8	0	0	0	0	115.5	G250 V256	G250-S254 WeakPolarHBondContact O-CB 3.41Å; G250-S254 PolarHBondContact O-N 3.38Å; S254-V256 PolarHBondContact O-N 2.92Å
255	G	52.4	Low	64.8	Low	57 Å²	57	79.7 Å²	79.7	59%	0.588	43%	0.429	S	S	*	.			trans	60.9	16.7	178.4	0	0	0	0	0	115	H257	G255-H257 PolarHBondContact O-CD2 3.28Å; G255-H257 VanDerWaalsContact O-CD2 3.24Å; G255-H257 PolarHBondContact O-N 3.41Å
256	V	66.6	Low	67.3	Low	66 Å²	66	73.6 Å²	73.6	40%	0.4	40%	0.396	S	S	.	.			trans	-79.9	104.6	179.4	-177	0	0	0	0	108.1	L228 S254	L228-V256 HydrophobicContact CD1-CG1 3.66Å; S254-V256 PolarHBondContact O-N 2.92Å
257	H	80.4	Confident	69.8	Low	130 Å²	130	65.8 Å²	65.8	60%	0.602	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-80	125.6	173.7	-68.2	-86.5	0	0	0	109.4	G255 Q327	G255-H257 PolarHBondContact O-CD2 3.28Å; G255-H257 VanDerWaalsContact O-CD2 3.24Å; G255-H257 PolarHBondContact O-N 3.41Å; H257-Q327 PolarHBondContact ND1-NE2 2.78Å
258	V	91.6	Very high	72	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.6	172.1	-179.5	0	0	0	0	108.4	P223 L228 D262 T324 I326 Q327	P223-V258 HydrophobicContact CG-CG1 3.71Å; L228-V258 HydrophobicContact CD1-CG2 3.97Å; V258-D262 HydrophobicContact CG1-CB 4.39Å; V258-T324 HydrophobicContact CB-CG2 4.2Å; V258-T324 HydrophobicContact CG2-CG2 3.71Å; V258-I326 HydrophobicContact CG1-CG1 4.39Å; V258-I326 CarbonylContact O-C 3.47Å; V258-I326 WeakPolarHBondContact O-CA 3.36Å; V258-Q327 PolarHBondContact O-N 3.47Å
259	T	92.4	Very high	73.8	Confident	41 Å²	41	56.4 Å²	56.4	25%	0.252	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	160.6	175.2	71.9	0	0	0	0	111.2	N261 D262 C263 Q327	T259-N261 PolarHBondContact O-N 3.5Å; T259-N261 PolarHBondContact OG1-N 2.79Å; T259-D262 WeakPolarHBondContact CA-OD2 3.48Å; T259-D262 WeakPolarHBondContact CB-OD2 3.43Å; T259-D262 PolarHBondContact N-OD2 3.45Å; T259-D262 WeakPolarHBondContact O-CB 3.17Å; T259-D262 PolarHBondContact O-N 3.41Å; T259-D262 VanDerWaalsContact O-N 3.13Å; T259-D262 PolarHBondContact OG1-N 2.85Å; T259-D262 PolarHBondContact OG1-OD2 3.42Å; T259-C263 PolarHBondContact O-N 3.25Å; T259-C263 PolarHBondContact O-SG 3.42Å; T259-C263 VanDerWaalsContact O-SG 3.39Å; T259-Q327 CarbonylContact C-O 3.58Å; T259-Q327 WeakPolarHBondContact CA-O 3.49Å; T259-Q327 HydrophobicContact CG2-CB 4.49Å
260	L	93	Very high	76.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-60.4	-32.8	172.3	-172.8	62.1	0	0	0	111.4	L220 C263 F264 L307 I326 Q327 F328 L333 Y397	L220-L260 HydrophobicContact CD1-CD1 3.7Å; L260-C263 WeakPolarHBondContact O-CB 3.46Å; L260-C263 PolarHBondContact O-N 2.75Å; L260-F264 HydrophobicContact CD1-CE2 4.36Å; L260-F264 HydrophobicContact CD2-CE2 4.18Å; L260-F264 HydrophobicContact CG-CD2 4.17Å; L260-F264 HydrophobicContact CG-CE2 3.81Å; L260-F264 VanDerWaalsContact O-CD2 3.24Å; L260-F264 WeakPolarHBondContact O-CD2 3.13Å; L260-F264 PolarHBondContact O-N 3.25Å; L260-L307 HydrophobicContact CD1-CD1 4.27Å; L260-L307 HydrophobicContact CD2-CD1 3.87Å; L260-L307 HydrophobicContact CG-CD1 4.47Å; L260-I326 HydrophobicContact CB-CG2 4.33Å; L260-Q327 PolarHBondContact N-O 2.7Å; L260-F328 HydrophobicContact CB-CB 4.15Å; L260-F328 HydrophobicContact CD2-CB 3.97Å; L260-L333 HydrophobicContact CD2-CD1 3.88Å; L260-L333 HydrophobicContact CD2-CD2 3.94Å; L260-Y397 HydrophobicContact CD2-CE2 3.88Å
261	N	90.6	Very high	78.7	Confident	65 Å²	65	56.9 Å²	56.9	35%	0.348	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-37.5	174.4	-77.6	-27.9	0	0	0	112.4	T259 C263 F264 S265	T259-N261 PolarHBondContact O-N 3.5Å; T259-N261 PolarHBondContact OG1-N 2.79Å; N261-C263 VanDerWaalsContact C-N 3.26Å; N261-C263 PolarHBondContact O-N 3.42Å; N261-F264 PolarHBondContact O-N 3.44Å; N261-S265 WeakPolarHBondContact O-CB 3.36Å; N261-S265 PolarHBondContact O-N 3.31Å; N261-S265 PolarHBondContact O-OG 3.21Å
262	D	91.6	Very high	81	Confident	42 Å²	42	56.8 Å²	56.8	23%	0.225	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-36.1	174.7	-56.2	-46.3	0	0	0	111.3	P223 L228 V258 T259 S265 T266	P223-D262 HydrophobicContact CG-CB 4.14Å; L228-D262 HydrophobicContact CD2-CB 3.83Å; V258-D262 HydrophobicContact CG1-CB 4.39Å; T259-D262 WeakPolarHBondContact CA-OD2 3.48Å; T259-D262 WeakPolarHBondContact CB-OD2 3.43Å; T259-D262 PolarHBondContact N-OD2 3.45Å; T259-D262 WeakPolarHBondContact O-CB 3.17Å; T259-D262 PolarHBondContact O-N 3.41Å; T259-D262 VanDerWaalsContact O-N 3.13Å; T259-D262 PolarHBondContact OG1-N 2.85Å; T259-D262 PolarHBondContact OG1-OD2 3.42Å; D262-S265 PolarHBondContact O-N 2.78Å; D262-T266 WeakPolarHBondContact O-CB 3.46Å; D262-T266 PolarHBondContact O-N 3.12Å; D262-T266 PolarHBondContact O-OG1 3.36Å
263	C	93.3	Very high	83.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-41.8	175	-55.6	0	0	0	0	111.4	L220 T259 L260 N261 T266 F267	L220-C263 HydrophobicContact CB-CB 4.11Å; L220-C263 HydrophobicContact CD1-CB 4.22Å; T259-C263 PolarHBondContact O-N 3.25Å; T259-C263 PolarHBondContact O-SG 3.42Å; T259-C263 VanDerWaalsContact O-SG 3.39Å; L260-C263 WeakPolarHBondContact O-CB 3.46Å; L260-C263 PolarHBondContact O-N 2.75Å; N261-C263 VanDerWaalsContact C-N 3.26Å; N261-C263 PolarHBondContact O-N 3.42Å; C263-T266 PolarHBondContact O-N 2.98Å; C263-F267 WeakPolarHBondContact O-CB 3.13Å; C263-F267 PolarHBondContact O-N 2.65Å
264	F	91.4	Very high	85.7	Confident	9 Å²	9	46.3 Å²	46.3	4%	0.039	28%	0.283	C	S	.	.	H	α-helix	trans	-64	-46.4	172.4	-79.7	-66.9	0	0	0	112.4	L218 L220 L260 N261 T266 F267 F268 L307 L333 L335	L218-F264 HydrophobicContact CD1-CE1 3.91Å; L220-F264 HydrophobicContact CD1-CD1 4.3Å; L220-F264 HydrophobicContact CD1-CD2 4.38Å; L220-F264 HydrophobicContact CD1-CE1 4.04Å; L220-F264 HydrophobicContact CD1-CE2 4.1Å; L220-F264 HydrophobicContact CD1-CG 4.46Å; L220-F264 HydrophobicContact CD1-CZ 3.94Å; L220-F264 HydrophobicContact CD2-CD1 3.77Å; L220-F264 HydrophobicContact CD2-CE1 3.82Å; L220-F264 HydrophobicContact CD2-CG 4.47Å; L260-F264 HydrophobicContact CD1-CE2 4.36Å; L260-F264 HydrophobicContact CD2-CE2 4.18Å; L260-F264 HydrophobicContact CG-CD2 4.17Å; L260-F264 HydrophobicContact CG-CE2 3.81Å; L260-F264 VanDerWaalsContact O-CD2 3.24Å; L260-F264 WeakPolarHBondContact O-CD2 3.13Å; L260-F264 PolarHBondContact O-N 3.25Å; N261-F264 PolarHBondContact O-N 3.44Å; F264-T266 PolarHBondContact O-N 3.34Å; F264-F267 WeakPolarHBondContact O-CB 3.13Å; F264-F267 PolarHBondContact O-N 3.16Å; F264-F267 VanDerWaalsContact O-N 3.12Å; F264-F268 HydrophobicContact CB-CD2 4.38Å; F264-F268 HydrophobicContact CB-CE2 4.27Å; F264-F268 AromaticContact CD1-CE2 3.8Å; F264-F268 HydrophobicContact CD1-CE2 3.8Å; F264-F268 HydrophobicContact CD1-CZ 4.42Å; F264-F268 HydrophobicContact CG-CE2 4.48Å; F264-F268 WeakPolarHBondContact O-CD2 3.46Å; F264-F268 PolarHBondContact O-N 2.94Å; F264-L307 HydrophobicContact CE1-CD2 4.05Å; F264-L307 HydrophobicContact CE2-CD1 4.02Å; F264-L307 HydrophobicContact CZ-CD1 3.64Å; F264-L307 HydrophobicContact CZ-CD2 3.63Å; F264-L307 HydrophobicContact CZ-CG 4.3Å; F264-L333 HydrophobicContact CE2-CD2 4.44Å; F264-L335 HydrophobicContact CD1-CD2 4.19Å; F264-L335 HydrophobicContact CD2-CD2 3.68Å; F264-L335 HydrophobicContact CE1-CD2 3.84Å; F264-L335 HydrophobicContact CE2-CD2 3.3Å; F264-L335 HydrophobicContact CG-CD2 4.11Å; F264-L335 HydrophobicContact CZ-CD1 4.45Å; F264-L335 HydrophobicContact CZ-CD2 3.38Å
265	S	89.8	Confident	87.6	Confident	59 Å²	59	46 Å²	46	41%	0.413	29%	0.288	S	S	.	.	H	α-helix	trans	-58.2	-38.4	176.9	-70.8	0	0	0	0	111.7	N261 D262 S269	N261-S265 WeakPolarHBondContact O-CB 3.36Å; N261-S265 PolarHBondContact O-N 3.31Å; N261-S265 PolarHBondContact O-OG 3.21Å; D262-S265 PolarHBondContact O-N 2.78Å; S265-S269 WeakPolarHBondContact O-CB 3.04Å; S265-S269 PolarHBondContact O-N 3.06Å; S265-S269 VanDerWaalsContact O-N 3.08Å
266	T	90.9	Very high	89.1	Confident	7 Å²	7	51.6 Å²	51.6	4%	0.043	31%	0.305	C	S	.	.	H	α-helix	trans	-68	-45.1	174.2	-53.7	0	0	0	0	111.6	P221 P223 D262 C263 F264 F268 S269	P221-T266 HydrophobicContact CB-CG2 4.37Å; P221-T266 HydrophobicContact CG-CG2 3.73Å; P223-T266 HydrophobicContact CB-CG2 4.48Å; P223-T266 WeakPolarHBondContact CB-OG1 3.32Å; D262-T266 WeakPolarHBondContact O-CB 3.46Å; D262-T266 PolarHBondContact O-N 3.12Å; D262-T266 PolarHBondContact O-OG1 3.36Å; C263-T266 PolarHBondContact O-N 2.98Å; F264-T266 PolarHBondContact O-N 3.34Å; T266-F268 VanDerWaalsContact C-N 3.3Å; T266-F268 PolarHBondContact O-N 3.47Å; T266-S269 WeakPolarHBondContact O-CB 3.39Å; T266-S269 PolarHBondContact O-N 3.47Å; T266-S269 VanDerWaalsContact O-N 3.15Å; T266-S269 PolarHBondContact O-OG 3.13Å
267	F	90.8	Very high	90.2	Very high	39 Å²	39	54.2 Å²	54.2	17%	0.171	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-38.8	178	-176.9	-95.9	0	0	0	113.1	L196 L218 L220 P221 C263 F264 C294	L196-F267 HydrophobicContact CD1-CE1 4.42Å; L196-F267 HydrophobicContact CD1-CZ 4.23Å; L196-F267 HydrophobicContact CD2-CE1 4.12Å; L218-F267 HydrophobicContact CD2-CE1 4.25Å; L218-F267 HydrophobicContact CD2-CZ 4.15Å; L220-F267 HydrophobicContact CD2-CB 3.96Å; L220-F267 HydrophobicContact CD2-CD2 4.14Å; L220-F267 HydrophobicContact CD2-CG 3.97Å; P221-F267 HydrophobicContact CG-CB 4.46Å; C263-F267 WeakPolarHBondContact O-CB 3.13Å; C263-F267 PolarHBondContact O-N 2.65Å; F264-F267 WeakPolarHBondContact O-CB 3.13Å; F264-F267 PolarHBondContact O-N 3.16Å; F264-F267 VanDerWaalsContact O-N 3.12Å; F267-C294 HydrophobicContact CE1-CB 4.14Å
268	F	90.5	Very high	90.6	Very high	35 Å²	35	51.4 Å²	51.4	15%	0.154	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-1.8	179.2	-61.2	-58.5	0	0	0	113.9	L196 F264 T266 C294 L296	L196-F268 HydrophobicContact CD2-CE1 3.99Å; F264-F268 HydrophobicContact CB-CD2 4.38Å; F264-F268 HydrophobicContact CB-CE2 4.27Å; F264-F268 AromaticContact CD1-CE2 3.8Å; F264-F268 HydrophobicContact CD1-CE2 3.8Å; F264-F268 HydrophobicContact CD1-CZ 4.42Å; F264-F268 HydrophobicContact CG-CE2 4.48Å; F264-F268 WeakPolarHBondContact O-CD2 3.46Å; F264-F268 PolarHBondContact O-N 2.94Å; T266-F268 VanDerWaalsContact C-N 3.3Å; T266-F268 PolarHBondContact O-N 3.47Å; F268-C294 HydrophobicContact CD1-CB 4.28Å; F268-C294 WeakPolarHBondContact CD1-O 3.19Å; F268-L296 HydrophobicContact CE1-CB 4.01Å; F268-L296 HydrophobicContact CZ-CB 3.89Å; F268-L296 HydrophobicContact CZ-CD2 4.25Å
269	S	90.3	Very high	90.7	Very high	28 Å²	28	52.8 Å²	52.8	20%	0.196	31%	0.309	C	S	.	.	S	Bend	trans	-74.1	154.2	174.7	74	0	0	0	0	111.3	S265 T266 D271	S265-S269 WeakPolarHBondContact O-CB 3.04Å; S265-S269 PolarHBondContact O-N 3.06Å; S265-S269 VanDerWaalsContact O-N 3.08Å; T266-S269 WeakPolarHBondContact O-CB 3.39Å; T266-S269 PolarHBondContact O-N 3.47Å; T266-S269 VanDerWaalsContact O-N 3.15Å; T266-S269 PolarHBondContact O-OG 3.13Å; S269-D271 PolarHBondContact O-N 2.78Å
270	P	92.1	Very high	90.7	Very high	76 Å²	76	57.6 Å²	57.6	49%	0.494	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-61.7	121.4	175.2	-21.2	32.7	0	0	0	112.3	V291 K292 V293	P270-V291 HydrophobicContact CB-CG1 3.61Å; P270-K292 CarbonylContact C-O 3.53Å; P270-K292 WeakPolarHBondContact CA-O 3.28Å; P270-V293 HydrophobicContact CB-CG2 3.9Å; P270-V293 HydrophobicContact CG-CG2 4.03Å
271	D	90.2	Very high	90.8	Very high	99 Å²	99	57.8 Å²	57.8	53%	0.529	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.8	178.9	-168.6	12	0	0	0	110.9	S269 V291 K292	S269-D271 PolarHBondContact O-N 2.78Å; D271-V291 CarbonylContact O-C 3.44Å; D271-V291 VanDerWaalsContact O-CA 3.3Å; D271-V291 WeakPolarHBondContact O-CA 3.47Å; D271-K292 HydrophobicContact CB-CB 4.48Å; D271-K292 PolarHBondContact N-O 3.25Å; D271-K292 PolarHBondContact O-N 3.05Å
272	S	91.6	Very high	90.9	Very high	76 Å²	76	58.5 Å²	58.5	53%	0.531	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	105.7	-175.4	-67.6	0	0	0	0	110.7	S274	S272-S274 PolarHBondContact O-N 2.91Å
273	L	91.2	Very high	91	Very high	23 Å²	23	62 Å²	62	12%	0.12	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	102.4	176.4	-56.6	-177.8	0	0	0	109.2	V200 D277 Y279 N289 G290 K292	V200-L273 HydrophobicContact CG1-CD1 3.88Å; L273-D277 WeakPolarHBondContact CB-O 3.13Å; L273-Y279 HydrophobicContact CD1-CD1 4.01Å; L273-Y279 HydrophobicContact CD1-CG 4.1Å; L273-N289 CarbonylContact O-C 3.55Å; L273-N289 WeakPolarHBondContact O-CA 3.28Å; L273-G290 PolarHBondContact N-O 2.72Å; L273-G290 PolarHBondContact O-N 3.16Å; L273-K292 HydrophobicContact CD1-CB 4.06Å; L273-K292 HydrophobicContact CD2-CB 4.24Å; L273-K292 HydrophobicContact CG-CB 4.12Å
274	S	90	Very high	91.1	Very high	57 Å²	57	63.1 Å²	63.1	40%	0.399	38%	0.375	S	S	.	.			trans	-150	166.6	-176.8	66.5	0	0	0	0	111.7	S272 D276 D277	S272-S274 PolarHBondContact O-N 2.91Å; S274-D276 PolarHBondContact O-N 3.07Å; S274-D277 PolarHBondContact O-N 2.88Å
275	G	88.6	Confident	91.1	Very high	47 Å²	47	66.3 Å²	66.3	49%	0.485	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	61.1	-127.4	-177.7	0	0	0	0	0	111.9	D277 M278	G275-D277 PolarHBondContact O-N 3.15Å; G275-M278 WeakPolarHBondContact O-CE 3.48Å; G275-M278 WeakPolarHBondContact O-CG 3.05Å; G275-M278 PolarHBondContact O-N 3.18Å
276	D	85.2	Confident	91.3	Very high	175 Å²	175	69.5 Å²	69.5	94%	0.936	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-69.6	-18.3	177.9	-64.8	-29.8	0	0	0	112.9	S274	S274-D276 PolarHBondContact O-N 3.07Å
277	D	87.8	Confident	91.6	Very high	121 Å²	121	74 Å²	74	65%	0.647	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-91.7	11.4	178.7	-63	-49.2	0	0	0	113.4	L273 S274 G275	L273-D277 WeakPolarHBondContact CB-O 3.13Å; S274-D277 PolarHBondContact O-N 2.88Å; G275-D277 PolarHBondContact O-N 3.15Å
278	M	90.4	Very high	91.8	Very high	70 Å²	70	75.3 Å²	75.3	35%	0.345	44%	0.437	S	S	.	.			trans	-59	140	175.4	-79.9	-172.9	-73.2	0	0	111.9	G275 L287 N289	G275-M278 WeakPolarHBondContact O-CE 3.48Å; G275-M278 WeakPolarHBondContact O-CG 3.05Å; G275-M278 PolarHBondContact O-N 3.18Å; M278-L287 HydrophobicContact CB-CB 4.19Å; M278-L287 HydrophobicContact SD-CB 4.47Å; M278-N289 WeakPolarHBondContact CG-OD1 3.12Å; M278-N289 PolarHBondContact SD-OD1 2.69Å; M278-N289 VanDerWaalsContact SD-OD1 3.42Å
279	Y	92.3	Very high	92.1	Very high	38 Å²	38	77.4 Å²	77.4	15%	0.149	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	154.9	-179.9	87	-69.3	0	0	0	112.4	V200 C202 L273 C281 L287 R288	V200-Y279 HydrophobicContact CB-CE2 4.42Å; V200-Y279 HydrophobicContact CG1-CD1 4.05Å; V200-Y279 HydrophobicContact CG1-CD2 3.88Å; V200-Y279 HydrophobicContact CG1-CE1 3.81Å; V200-Y279 HydrophobicContact CG1-CE2 3.57Å; V200-Y279 HydrophobicContact CG1-CG 4.09Å; C202-Y279 WeakPolarHBondContact CA-OH 3.2Å; C202-Y279 WeakPolarHBondContact CB-OH 3.42Å; C202-Y279 PolarHBondContact N-OH 3.36Å; C202-Y279 VanDerWaalsContact N-OH 3.14Å; L273-Y279 HydrophobicContact CD1-CD1 4.01Å; L273-Y279 HydrophobicContact CD1-CG 4.1Å; Y279-C281 HydrophobicContact CE2-CB 4.12Å; Y279-C281 PolarHBondContact O-N 2.78Å; Y279-L287 CarbonylContact O-C 3.56Å; Y279-L287 WeakPolarHBondContact O-CA 3.44Å; Y279-R288 WeakPolarHBondContact CD1-O 3.15Å; Y279-R288 HydrophobicContact CE1-CB 4.35Å; Y279-R288 PolarHBondContact N-O 2.76Å; Y279-R288 PolarHBondContact O-N 3.49Å
280	Q	93.8	Very high	92.3	Very high	141 Å²	141	76 Å²	76	66%	0.659	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	104.3	176.5	-172.1	170.7	-11.1	0	0	110.7	G282 L287	Q280-G282 PolarHBondContact O-N 3.21Å; Q280-L287 HydrophobicContact CB-CD2 4.14Å
281	C	94.5	Very high	92.4	Very high	5 Å²	5	74 Å²	74	3%	0.034	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	116.9	178.2	176.2	0	0	0	0	110.6	C202 Y279 H283 C284 A285 K286 R288	C202-C281 VanDerWaalsContact SG-SG 3.68Å; Y279-C281 HydrophobicContact CE2-CB 4.12Å; Y279-C281 PolarHBondContact O-N 2.78Å; C281-H283 PolarHBondContact O-N 3.45Å; C281-C284 HydrophobicContact CB-CB 3.96Å; C281-C284 PolarHBondContact O-N 3.49Å; C281-C284 VanDerWaalsContact O-N 3.08Å; C281-A285 WeakPolarHBondContact O-CA 3.15Å; C281-A285 PolarHBondContact O-N 3.34Å; C281-K286 PolarHBondContact N-O 2.97Å; C281-R288 HydrophobicContact CB-CB 4.22Å; C281-R288 HydrophobicContact CB-CG 3.95Å
282	G	92.8	Very high	92.6	Very high	81 Å²	81	72.3 Å²	72.3	84%	0.835	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.7	-179.3	0	0	0	0	0	114.6	Q280	Q280-G282 PolarHBondContact O-N 3.21Å
283	H	93.7	Very high	92.7	Very high	114 Å²	114	70.5 Å²	70.5	53%	0.528	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-34.9	175.4	-177.9	-82.6	0	0	0	113.2	R207 C281	R207-H283 PolarHBondContact NE-CD2 3.39Å; R207-H283 PolarHBondContact NH2-CD2 3.38Å; R207-H283 VanDerWaalsContact NH2-CD2 3.33Å; C281-H283 PolarHBondContact O-N 3.45Å
284	C	94.8	Very high	92.7	Very high	26 Å²	26	70 Å²	70	18%	0.176	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-16.4	-180	-63.5	0	0	0	0	113.2	C281 K286 R288	C281-C284 HydrophobicContact CB-CB 3.96Å; C281-C284 PolarHBondContact O-N 3.49Å; C281-C284 VanDerWaalsContact O-N 3.08Å; C284-K286 PolarHBondContact O-N 2.8Å; C284-R288 HydrophobicContact CB-CG 4.12Å
285	A	93.1	Very high	92.6	Very high	76 Å²	76	72.9 Å²	72.9	63%	0.628	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	32.2	-171.9	0	0	0	0	0	113.5	C281	C281-A285 WeakPolarHBondContact O-CA 3.15Å; C281-A285 PolarHBondContact O-N 3.34Å
286	K	93.6	Very high	92.5	Very high	126 Å²	126	71.3 Å²	71.3	55%	0.548	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156.8	-177.3	-69.1	-176.9	-178.1	-176.8	0	110.3	C281 C284 R288	C281-K286 PolarHBondContact N-O 2.97Å; C284-K286 PolarHBondContact O-N 2.8Å; K286-R288 PolarHBondContact O-N 3.38Å
287	L	95.7	Very high	92.5	Very high	101 Å²	101	66.1 Å²	66.1	53%	0.529	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	129.6	165.7	-66.3	178.6	0	0	0	109.5	M278 Y279 Q280	M278-L287 HydrophobicContact CB-CB 4.19Å; M278-L287 HydrophobicContact SD-CB 4.47Å; Y279-L287 CarbonylContact O-C 3.56Å; Y279-L287 WeakPolarHBondContact O-CA 3.44Å; Q280-L287 HydrophobicContact CB-CD2 4.14Å
288	R	95.3	Very high	92.2	Very high	67 Å²	67	64.4 Å²	64.4	25%	0.253	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	151.5	-176.1	-67.1	-60.2	-174.5	-151.3	14.9	110.2	H204 Y279 C281 C284 K286	H204-R288 HydrophobicContact CB-CG 4.47Å; H204-R288 PolarHBondContact NE2-NH2 3.4Å; Y279-R288 WeakPolarHBondContact CD1-O 3.15Å; Y279-R288 HydrophobicContact CE1-CB 4.35Å; Y279-R288 PolarHBondContact N-O 2.76Å; Y279-R288 PolarHBondContact O-N 3.49Å; C281-R288 HydrophobicContact CB-CB 4.22Å; C281-R288 HydrophobicContact CB-CG 3.95Å; C284-R288 HydrophobicContact CB-CG 4.12Å; K286-R288 PolarHBondContact O-N 3.38Å
289	N	96.5	Very high	91.6	Very high	78 Å²	78	61.7 Å²	61.7	42%	0.417	33%	0.331	S	S	.	.			trans	-66.6	140.1	165.2	-61.3	1.5	0	0	0	109.2	L203 L273 M278	L203-N289 HydrophobicContact CB-CB 4.5Å; L203-N289 HydrophobicContact CD1-CB 4.17Å; L203-N289 PolarHBondContact N-O 3.48Å; L273-N289 CarbonylContact O-C 3.55Å; L273-N289 WeakPolarHBondContact O-CA 3.28Å; M278-N289 WeakPolarHBondContact CG-OD1 3.12Å; M278-N289 PolarHBondContact SD-OD1 2.69Å; M278-N289 VanDerWaalsContact SD-OD1 3.42Å
290	G	94.7	Very high	90.5	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	169.8	-179.5	0	0	0	0	0	111.8	K201 L273	K201-G290 CarbonylContact O-C 3.4Å; K201-G290 WeakPolarHBondContact O-CA 3.46Å; L273-G290 PolarHBondContact N-O 2.72Å; L273-G290 PolarHBondContact O-N 3.16Å
291	V	95.6	Very high	88.9	Confident	33 Å²	33	60.2 Å²	60.2	20%	0.2	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.2	168	178.8	0	0	0	0	107.4	V200 K201 L203 P270 D271 V293	V200-V291 CarbonylContact C-O 3.56Å; V200-V291 WeakPolarHBondContact CA-O 3.34Å; K201-V291 PolarHBondContact N-O 3.22Å; K201-V291 PolarHBondContact O-N 3.45Å; L203-V291 HydrophobicContact CD1-CG2 4.16Å; L203-V291 HydrophobicContact CD2-CG2 3.89Å; L203-V291 HydrophobicContact CG-CG2 4.23Å; P270-V291 HydrophobicContact CB-CG1 3.61Å; D271-V291 CarbonylContact O-C 3.44Å; D271-V291 VanDerWaalsContact O-CA 3.3Å; D271-V291 WeakPolarHBondContact O-CA 3.47Å; V291-V293 HydrophobicContact CG1-CG2 4.43Å
292	K	93.7	Very high	87.2	Confident	64 Å²	64	61.1 Å²	61.1	28%	0.278	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135.8	174.8	-176.5	175.1	-178.1	-179.3	0	109.3	S198 S199 V200 P270 D271 L273 C294	S198-K292 WeakPolarHBondContact OG-CE 3.4Å; S199-K292 CarbonylContact O-C 3.49Å; S199-K292 WeakPolarHBondContact O-CA 3.03Å; V200-K292 HydrophobicContact CG2-CB 4.24Å; V200-K292 HydrophobicContact CG2-CG 4.08Å; P270-K292 CarbonylContact C-O 3.53Å; P270-K292 WeakPolarHBondContact CA-O 3.28Å; D271-K292 HydrophobicContact CB-CB 4.48Å; D271-K292 PolarHBondContact N-O 3.25Å; D271-K292 PolarHBondContact O-N 3.05Å; L273-K292 HydrophobicContact CD1-CB 4.06Å; L273-K292 HydrophobicContact CD2-CB 4.24Å; L273-K292 HydrophobicContact CG-CB 4.12Å; K292-C294 VanDerWaalsContact CE-SG 3.57Å
293	V	93.4	Very high	86.3	Confident	38 Å²	38	57.3 Å²	57.3	23%	0.23	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.5	170.7	-178.7	0	0	0	0	107.2	S199 P270 V291	S199-V293 PolarHBondContact N-O 2.74Å; S199-V293 PolarHBondContact O-N 3.17Å; P270-V293 HydrophobicContact CB-CG2 3.9Å; P270-V293 HydrophobicContact CG-CG2 4.03Å; V291-V293 HydrophobicContact CG1-CG2 4.43Å
294	C	90.8	Very high	85.9	Confident	12 Å²	12	51.9 Å²	51.9	8%	0.081	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	145.5	171.5	-64.5	0	0	0	0	109.7	L197 F267 F268 K292	L197-C294 CarbonylContact O-C 3.56Å; L197-C294 WeakPolarHBondContact O-CA 2.93Å; F267-C294 HydrophobicContact CE1-CB 4.14Å; F268-C294 HydrophobicContact CD1-CB 4.28Å; F268-C294 WeakPolarHBondContact CD1-O 3.19Å; K292-C294 VanDerWaalsContact CE-SG 3.57Å
295	K	89.4	Confident	85.6	Confident	117 Å²	117	50.6 Å²	50.6	51%	0.509	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.2	168.4	-65.3	179.3	-178.3	173.6	0	109.2	L196 L197 L297	L196-K295 CarbonylContact C-O 3.57Å; L196-K295 VanDerWaalsContact CA-O 3.31Å; L196-K295 WeakPolarHBondContact CA-O 3.4Å; L197-K295 HydrophobicContact CB-CB 4.42Å; L197-K295 PolarHBondContact N-O 2.82Å; L197-K295 PolarHBondContact O-N 2.5Å; K295-L297 PolarHBondContact O-N 2.79Å
296	L	86.4	Confident	85.4	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.073	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.7	175.3	-163.2	57.8	0	0	0	108.9	L196 F215 F268 L299 L335 F338	L196-L296 HydrophobicContact CD2-CB 4.38Å; L196-L296 HydrophobicContact CD2-CD1 3.71Å; L196-L296 HydrophobicContact CG-CD1 4.28Å; F215-L296 HydrophobicContact CE1-CD1 3.45Å; F215-L296 VanDerWaalsContact CE1-CD1 3.45Å; F215-L296 HydrophobicContact CZ-CD1 3.65Å; F268-L296 HydrophobicContact CE1-CB 4.01Å; F268-L296 HydrophobicContact CZ-CB 3.89Å; F268-L296 HydrophobicContact CZ-CD2 4.25Å; L296-L299 HydrophobicContact CD1-CD2 4.23Å; L296-L299 HydrophobicContact CD2-CD1 4.32Å; L296-L299 HydrophobicContact CD2-CD2 3.37Å; L296-L299 HydrophobicContact CD2-CG 3.75Å; L296-L299 HydrophobicContact CG-CD2 4.13Å; L296-L299 HydrophobicContact CG-CG 4.32Å; L296-L335 HydrophobicContact CD2-CD1 4.41Å; L296-F338 HydrophobicContact CB-CE2 3.66Å; L296-F338 HydrophobicContact CB-CZ 3.64Å; L296-F338 HydrophobicContact CD2-CD2 3.91Å; L296-F338 HydrophobicContact CD2-CE2 3.13Å; L296-F338 HydrophobicContact CD2-CZ 3.63Å; L296-F338 HydrophobicContact CG-CE2 3.48Å; L296-F338 VanDerWaalsContact CG-CE2 3.48Å; L296-F338 HydrophobicContact CG-CZ 3.41Å; L296-F338 VanDerWaalsContact CG-CZ 3.41Å
297	L	85	Confident	85.3	Confident	67 Å²	67	41.1 Å²	41.1	35%	0.351	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-53.6	177.6	-68.1	178.9	0	0	0	110.2	R195 L197 K295	R195-L297 HydrophobicContact CB-CB 4.09Å; R195-L297 HydrophobicContact CB-CD1 4.5Å; R195-L297 WeakPolarHBondContact O-CB 3.29Å; R195-L297 PolarHBondContact O-N 3.11Å; L197-L297 HydrophobicContact CB-CD1 3.9Å; L197-L297 HydrophobicContact CB-CD2 3.87Å; L197-L297 HydrophobicContact CB-CG 3.8Å; K295-L297 PolarHBondContact O-N 2.79Å
298	E	81.6	Confident	85.1	Confident	84 Å²	84	37.5 Å²	37.5	39%	0.393	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.7	-176.7	-66.6	170.8	-167.1	0	0	108.9	G194 R195	G194-E298 CarbonylContact C-O 3.55Å; G194-E298 WeakPolarHBondContact CA-O 3.43Å; R195-E298 HydrophobicContact CB-CB 4.16Å; R195-E298 VanDerWaalsContact CD-OE2 3.28Å; R195-E298 WeakPolarHBondContact CD-OE2 3.01Å; R195-E298 IonicContact CZ-OE1 3.76Å; R195-E298 IonicContact CZ-OE2 3.73Å; R195-E298 PolarHBondContact N-O 3.36Å; R195-E298 IonicContact NH1-OE1 2.72Å; R195-E298 PolarHBondContact NH1-OE1 3.48Å; R195-E298 IonicContact NH1-OE2 3.65Å; R195-E298 PolarHBondContact NH1-OE2 2.85Å; R195-E298 VanDerWaalsContact NH1-OE2 3.13Å; R195-E298 PolarHBondContact O-N 3.21Å; R195-E298 VanDerWaalsContact O-N 3.15Å
299	L	77.4	Confident	84.9	Confident	14 Å²	14	34.4 Å²	34.4	7%	0.073	17%	0.171	C	C	.	.			trans	-90.5	155.3	164.7	-74.2	171.7	0	0	0	109.1	L296 E301 L305 L335 F338 Y342	L296-L299 HydrophobicContact CD1-CD2 4.23Å; L296-L299 HydrophobicContact CD2-CD1 4.32Å; L296-L299 HydrophobicContact CD2-CD2 3.37Å; L296-L299 HydrophobicContact CD2-CG 3.75Å; L296-L299 HydrophobicContact CG-CD2 4.13Å; L296-L299 HydrophobicContact CG-CG 4.32Å; L299-E301 PolarHBondContact O-N 3.47Å; L299-L305 HydrophobicContact CD2-CD1 4.24Å; L299-L305 HydrophobicContact CD2-CD2 4.48Å; L299-L335 HydrophobicContact CD1-CD1 3.81Å; L299-L335 HydrophobicContact CD2-CD1 3.83Å; L299-L335 HydrophobicContact CG-CD1 4.47Å; L299-F338 HydrophobicContact CD1-CB 3.78Å; L299-F338 HydrophobicContact CD1-CD1 3.86Å; L299-F338 HydrophobicContact CD1-CD2 3.54Å; L299-F338 HydrophobicContact CD1-CE1 4.4Å; L299-F338 HydrophobicContact CD1-CE2 4.17Å; L299-F338 HydrophobicContact CD1-CG 3.4Å; L299-F338 VanDerWaalsContact CD1-CG 3.4Å; L299-F338 HydrophobicContact CG-CD1 4.14Å; L299-F338 HydrophobicContact CG-CD2 4.11Å; L299-F338 HydrophobicContact CG-CE1 4.23Å; L299-F338 HydrophobicContact CG-CE2 4.25Å; L299-F338 HydrophobicContact CG-CG 4.1Å; L299-F338 HydrophobicContact CG-CZ 4.29Å; L299-Y342 WeakPolarHBondContact CB-OH 3.15Å; L299-Y342 HydrophobicContact CD1-CE2 3.8Å
300	P	68.5	Low	84.6	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.013	17%	0.172	C	C	.	.			trans	-52.6	110.1	175.1	-21.7	30.8	0	0	0	110.2	F192 N193 V302	F192-P300 WeakPolarHBondContact O-CG 2.72Å; N193-P300 WeakPolarHBondContact O-CA 3.44Å; P300-V302 PolarHBondContact O-N 2.92Å
301	E	59.8	Low	84.3	Confident	145 Å²	145	35.6 Å²	35.6	68%	0.678	17%	0.172	S	C	*	.	S	Bend	trans	-65	-27.6	-168.7	-70.3	-164.5	151.5	0	0	112.3	L299 K399	L299-E301 PolarHBondContact O-N 3.47Å; E301-K399 PolarHBondContact O-NZ 3.17Å
302	V	58.9	Low	83.7	Confident	25 Å²	25	35.7 Å²	35.7	15%	0.152	17%	0.17	C	C	.	.	S	Bend	trans	-102.8	-33.5	-165.9	-176.5	0	0	0	0	114.3	E190 P300 L403 L407	E190-V302 HydrophobicContact CG-CB 4.18Å; E190-V302 HydrophobicContact CG-CG1 4.46Å; E190-V302 HydrophobicContact CG-CG2 3.88Å; P300-V302 PolarHBondContact O-N 2.92Å; V302-L403 WeakPolarHBondContact O-CD1 3.32Å; V302-L407 HydrophobicContact CG1-CD2 4.02Å
303	S	74.2	Confident	82.8	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-161.7	-55.1	-178.7	56.7	0	0	0	0	123	P97 I191 Q398 K399	P97-S303 WeakPolarHBondContact CB-OG 3.33Å; P97-S303 VanDerWaalsContact CG-OG 3.27Å; P97-S303 WeakPolarHBondContact CG-OG 3.32Å; I191-S303 WeakPolarHBondContact CG2-OG 3.35Å; I191-S303 PolarHBondContact O-OG 2.78Å; S303-Q398 VanDerWaalsContact O-CA 3.22Å; S303-Q398 WeakPolarHBondContact O-CA 3.44Å; S303-K399 PolarHBondContact O-N 3.27Å
304	V	84.8	Confident	81.7	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	122.4	-164.2	-172.6	0	0	0	0	113.9	C95 P97 I191 F192 I345 F396 Y397	C95-V304 HydrophobicContact CB-CG2 4.48Å; P97-V304 HydrophobicContact CG-CG2 4.1Å; I191-V304 HydrophobicContact CG2-CB 4.25Å; I191-V304 HydrophobicContact CG2-CG2 4.16Å; I191-V304 PolarHBondContact O-N 3.19Å; F192-V304 HydrophobicContact CD1-CB 4.03Å; F192-V304 HydrophobicContact CD1-CG1 4.15Å; F192-V304 HydrophobicContact CE1-CB 3.76Å; F192-V304 HydrophobicContact CE1-CG1 3.62Å; V304-I345 HydrophobicContact CG1-CD1 4.21Å; V304-I345 HydrophobicContact CG2-CD1 4.21Å; V304-F396 HydrophobicContact CG1-CB 4.3Å; V304-F396 HydrophobicContact CG1-CD1 4.09Å; V304-Y397 CarbonylContact C-O 3.57Å; V304-Y397 WeakPolarHBondContact CA-O 3.3Å
305	L	88.6	Confident	80.6	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.9	169.5	177.4	64.2	0	0	0	110.2	F215 L218 L299 L307 L335 Y342 Y397	F215-L305 HydrophobicContact CE2-CD1 4.04Å; L218-L305 HydrophobicContact CD1-CD1 4.14Å; L218-L305 HydrophobicContact CG-CD1 4.48Å; L299-L305 HydrophobicContact CD2-CD1 4.24Å; L299-L305 HydrophobicContact CD2-CD2 4.48Å; L305-L307 HydrophobicContact CD1-CD2 3.98Å; L305-L307 HydrophobicContact CD2-CD1 4.47Å; L305-L307 HydrophobicContact CD2-CD2 3.92Å; L305-L307 HydrophobicContact CD2-CG 4.34Å; L305-L307 HydrophobicContact CG-CD2 3.74Å; L305-L307 HydrophobicContact CG-CG 4.14Å; L305-L335 HydrophobicContact CD2-CD1 3.66Å; L305-Y342 HydrophobicContact CB-CD1 4.08Å; L305-Y342 HydrophobicContact CB-CE1 4.01Å; L305-Y397 PolarHBondContact N-O 3.29Å; L305-Y397 PolarHBondContact O-N 3.39Å
306	C	90.1	Very high	79.8	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.02	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.8	173.4	-168	0	0	0	0	110.7	I151 D217 L218 F396	I151-C306 VanDerWaalsContact CD1-SG 3.53Å; D217-C306 CarbonylContact C-O 3.44Å; D217-C306 VanDerWaalsContact CA-O 3.23Å; D217-C306 WeakPolarHBondContact CA-O 3.17Å; D217-C306 HydrophobicContact CB-CB 4.04Å; L218-C306 PolarHBondContact N-O 3.46Å; C306-F396 HydrophobicContact CB-CD1 4.34Å; C306-F396 HydrophobicContact CB-CE1 4.25Å; C306-F396 VanDerWaalsContact SG-CE1 3.6Å
307	L	91.6	Very high	79	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.3	179.3	-54.8	178.6	0	0	0	109.5	L218 L220 L260 F264 L305 L333 I394 L395 Y397	L218-L307 HydrophobicContact CB-CD2 3.85Å; L218-L307 HydrophobicContact CD1-CD2 4.15Å; L218-L307 HydrophobicContact CG-CD2 4.39Å; L220-L307 HydrophobicContact CD1-CB 4.37Å; L220-L307 HydrophobicContact CD1-CD1 4.37Å; L220-L307 HydrophobicContact CD1-CD2 4.33Å; L260-L307 HydrophobicContact CD1-CD1 4.27Å; L260-L307 HydrophobicContact CD2-CD1 3.87Å; L260-L307 HydrophobicContact CG-CD1 4.47Å; F264-L307 HydrophobicContact CE1-CD2 4.05Å; F264-L307 HydrophobicContact CE2-CD1 4.02Å; F264-L307 HydrophobicContact CZ-CD1 3.64Å; F264-L307 HydrophobicContact CZ-CD2 3.63Å; F264-L307 HydrophobicContact CZ-CG 4.3Å; L305-L307 HydrophobicContact CD1-CD2 3.98Å; L305-L307 HydrophobicContact CD2-CD1 4.47Å; L305-L307 HydrophobicContact CD2-CD2 3.92Å; L305-L307 HydrophobicContact CD2-CG 4.34Å; L305-L307 HydrophobicContact CG-CD2 3.74Å; L305-L307 HydrophobicContact CG-CG 4.14Å; L307-L333 HydrophobicContact CD1-CD2 4.2Å; L307-I394 CarbonylContact O-C 3.5Å; L307-I394 VanDerWaalsContact O-CA 3.26Å; L307-I394 WeakPolarHBondContact O-CA 3.46Å; L307-L395 HydrophobicContact CB-CB 4.3Å; L307-L395 HydrophobicContact CB-CD1 4.3Å; L307-L395 PolarHBondContact N-O 3.26Å; L307-L395 PolarHBondContact O-N 2.97Å; L307-Y397 HydrophobicContact CD1-CD2 3.79Å; L307-Y397 HydrophobicContact CD1-CE2 4Å; L307-Y397 HydrophobicContact CG-CD2 4.46Å
308	H	91.6	Very high	78.3	Confident	25 Å²	25	54.3 Å²	54.3	12%	0.116	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.5	174	161.6	-129.9	0	0	0	109.6	L218 S219 L220 Y393	L218-H308 PolarHBondContact O-N 2.98Å; S219-H308 CarbonylContact C-O 3.6Å; S219-H308 VanDerWaalsContact CA-O 3.28Å; S219-H308 WeakPolarHBondContact CA-O 3.22Å; S219-H308 PolarHBondContact OG-ND1 3.34Å; L220-H308 PolarHBondContact N-O 3.4Å; H308-Y393 AromaticContact CD2-CE2 3.47Å; H308-Y393 VanDerWaalsContact CD2-CE2 3.47Å; H308-Y393 WeakPolarHBondContact CD2-CE2 3.33Å; H308-Y393 AromaticContact CD2-CZ 3.9Å; H308-Y393 AromaticContact NE2-CE2 3.32Å; H308-Y393 VanDerWaalsContact NE2-CE2 3.32Å; H308-Y393 WeakPolarHBondContact NE2-CE2 3.26Å; H308-Y393 AromaticContact NE2-CZ 3.74Å
309	V	90.8	Very high	77.9	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	118.3	174.8	-178.9	0	0	0	0	109.1	I222 R311 I326 Y393 L395	I222-V309 HydrophobicContact CD1-CG1 3.62Å; I222-V309 HydrophobicContact CG1-CG1 3.58Å; V309-R311 HydrophobicContact CB-CG 4.39Å; V309-R311 HydrophobicContact CG1-CG 3.83Å; V309-R311 PolarHBondContact O-N 3.21Å; V309-I326 HydrophobicContact CB-CD1 4.34Å; V309-I326 HydrophobicContact CG1-CD1 3.32Å; V309-I326 HydrophobicContact CG2-CD1 4.04Å; V309-Y393 PolarHBondContact N-O 3.4Å; V309-Y393 WeakPolarHBondContact O-CD2 3.32Å; V309-Y393 WeakPolarHBondContact O-CE2 3.42Å; V309-L395 HydrophobicContact CG2-CD1 3.82Å
310	K	89.8	Confident	78.1	Confident	103 Å²	103	56.3 Å²	56.3	45%	0.448	27%	0.274	S	S	.	.			trans	-70.1	72.8	-179.7	-67.4	-177.3	174.7	178.3	0	112.6	S219 L220	S219-K310 VanDerWaalsContact O-CE 3.22Å; S219-K310 WeakPolarHBondContact O-CE 3.37Å; L220-K310 PolarHBondContact O-N 2.88Å
311	R	88	Confident	78.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.283	C	S	.	.			trans	-80.4	-23.1	-178.6	-71.4	-171.9	178	-74.9	-5.4	114.5	I222 V309 K321 I322 T324 A392 Y393	I222-R311 HydrophobicContact CD1-CG 3.9Å; V309-R311 HydrophobicContact CB-CG 4.39Å; V309-R311 HydrophobicContact CG1-CG 3.83Å; V309-R311 PolarHBondContact O-N 3.21Å; R311-K321 HydrophobicContact CB-CG 4.39Å; R311-K321 CarbonylContact O-C 3.52Å; R311-K321 WeakPolarHBondContact O-CA 3.24Å; R311-I322 PolarHBondContact NH1-O 3.21Å; R311-I322 PolarHBondContact O-N 3Å; R311-T324 PolarHBondContact NH1-O 3.11Å; R311-T324 PolarHBondContact NH2-O 3.49Å; R311-A392 VanDerWaalsContact CZ-O 3.23Å; R311-A392 PolarHBondContact NE-O 3.47Å; R311-A392 PolarHBondContact NH2-O 2.95Å; R311-Y393 HydrophobicContact CB-CD2 4.38Å; R311-Y393 HydrophobicContact CG-CD2 4.38Å
312	F	82.6	Confident	80.1	Confident	35 Å²	35	52.3 Å²	52.3	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.6	-176.1	-58.3	-82.3	0	0	0	109.9	K321 H350 T354 Y393	F312-K321 HydrophobicContact CD1-CB 4.03Å; F312-K321 HydrophobicContact CD1-CG 4.08Å; F312-K321 HydrophobicContact CE1-CB 4.02Å; F312-K321 HydrophobicContact CE1-CD 3.97Å; F312-K321 HydrophobicContact CE1-CG 3.79Å; F312-K321 HydrophobicContact CZ-CD 4.34Å; F312-K321 HydrophobicContact CZ-CG 4.36Å; F312-H350 AromaticContact CZ-CE1 3.71Å; F312-H350 AromaticContact CZ-ND1 3.42Å; F312-H350 WeakPolarHBondContact CZ-ND1 3.4Å; F312-T354 HydrophobicContact CD1-CG2 4.02Å; F312-Y393 AromaticContact CD2-CE2 3.93Å; F312-Y393 HydrophobicContact CD2-CE2 3.93Å; F312-Y393 HydrophobicContact CE2-CD2 4.25Å; F312-Y393 HydrophobicContact CE2-CE1 4.34Å; F312-Y393 AromaticContact CE2-CE2 3.71Å; F312-Y393 HydrophobicContact CE2-CE2 3.71Å; F312-Y393 AromaticContact CE2-CZ 3.77Å
313	R	76.2	Confident	81.5	Confident	134 Å²	134	52.4 Å²	52.4	51%	0.506	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	138.8	171.3	-66.6	-172.8	-179	165.5	4.9	108.7	S319 K320 I322	R313-S319 CarbonylContact O-C 3.49Å; R313-S319 VanDerWaalsContact O-CA 3.32Å; R313-S319 WeakPolarHBondContact O-CA 3.39Å; R313-K320 PolarHBondContact N-O 2.68Å; R313-K320 PolarHBondContact O-N 2.88Å; R313-I322 HydrophobicContact CG-CD1 4.26Å
314	H	69.4	Low	82.3	Confident	81 Å²	81	53.4 Å²	53.4	38%	0.375	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	109.4	176.6	-64.9	-76.3	0	0	0	107.7	Q145 S319	Q145-H314 PolarHBondContact NE2-NE2 3.12Å; H314-S319 PolarHBondContact CE1-OG 2.89Å; H314-S319 VanDerWaalsContact ND1-CB 3.32Å; H314-S319 WeakPolarHBondContact ND1-CB 3.42Å; H314-S319 PolarHBondContact ND1-OG 3.22Å
315	D	67.9	Low	82.7	Confident	95 Å²	95	57 Å²	57	51%	0.508	29%	0.285	S	S	.	.			trans	-94.9	164.3	168.1	-56.2	-34.3	0	0	0	108.7	Y317 S318	D315-Y317 PolarHBondContact O-N 2.83Å; D315-S318 PolarHBondContact N-O 3.34Å; D315-S318 PolarHBondContact O-N 3.4Å
316	S	72.3	Confident	82.9	Confident	119 Å²	119	57.2 Å²	57.2	83%	0.832	29%	0.286	S	S	*	.	S	Bend	trans	-52.2	-24.2	-178	-65.8	0	0	0	0	114.6
317	Y	69.7	Low	83.1	Confident	227 Å²	227	61.8 Å²	61.8	89%	0.89	31%	0.307	S	S	*	.	S	Bend	trans	-117.2	-17.2	-175.6	-59.1	-76.5	0	0	0	114.3	D315	D315-Y317 PolarHBondContact O-N 2.83Å
318	S	70.4	Confident	83.3	Confident	48 Å²	48	62.3 Å²	62.3	34%	0.336	31%	0.309	S	S	.	.			trans	-156.2	141.6	-173	69.9	0	0	0	0	112.8	D315	D315-S318 PolarHBondContact N-O 3.34Å; D315-S318 PolarHBondContact O-N 3.4Å
319	S	73.3	Confident	83.4	Confident	42 Å²	42	63.5 Å²	63.5	29%	0.294	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	117.9	168.9	-49.3	0	0	0	0	109.5	Q144 R313 H314 T354	Q144-S319 PolarHBondContact OE1-OG 2.8Å; R313-S319 CarbonylContact O-C 3.49Å; R313-S319 VanDerWaalsContact O-CA 3.32Å; R313-S319 WeakPolarHBondContact O-CA 3.39Å; H314-S319 PolarHBondContact CE1-OG 2.89Å; H314-S319 VanDerWaalsContact ND1-CB 3.32Å; H314-S319 WeakPolarHBondContact ND1-CB 3.42Å; H314-S319 PolarHBondContact ND1-OG 3.22Å; S319-T354 VanDerWaalsContact C-OG1 3.31Å; S319-T354 PolarHBondContact O-OG1 2.9Å
320	K	82.3	Confident	83.5	Confident	98 Å²	98	63.8 Å²	63.8	43%	0.426	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	146.8	179.7	-64.4	-178.5	-174.8	172	0	111.3	R313	R313-K320 PolarHBondContact N-O 2.68Å; R313-K320 PolarHBondContact O-N 2.88Å
321	K	84.2	Confident	83.5	Confident	45 Å²	45	64.6 Å²	64.6	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.7	171.2	-175.1	-168.4	178.3	-163.4	0	110	R311 F312 G323 H350 G352	R311-K321 HydrophobicContact CB-CG 4.39Å; R311-K321 CarbonylContact O-C 3.52Å; R311-K321 WeakPolarHBondContact O-CA 3.24Å; F312-K321 HydrophobicContact CD1-CB 4.03Å; F312-K321 HydrophobicContact CD1-CG 4.08Å; F312-K321 HydrophobicContact CE1-CB 4.02Å; F312-K321 HydrophobicContact CE1-CD 3.97Å; F312-K321 HydrophobicContact CE1-CG 3.79Å; F312-K321 HydrophobicContact CZ-CD 4.34Å; F312-K321 HydrophobicContact CZ-CG 4.36Å; K321-G323 PolarHBondContact O-N 3.49Å; K321-H350 WeakPolarHBondContact CE-ND1 3.46Å; K321-H350 PolarHBondContact NZ-ND1 3.43Å; K321-H350 PolarHBondContact NZ-O 2.98Å; K321-G352 WeakPolarHBondContact CD-O 3.12Å; K321-G352 PolarHBondContact NZ-O 2.96Å
322	I	86.4	Confident	83.4	Confident	18 Å²	18	66.3 Å²	66.3	9%	0.092	34%	0.343	C	S	.	.			trans	-75.8	115.3	176.3	-56.4	169.3	0	0	0	109.4	I222 R311 R313 T324	I222-I322 HydrophobicContact CB-CD1 4.46Å; I222-I322 HydrophobicContact CB-CG2 4.48Å; I222-I322 HydrophobicContact CD1-CB 3.93Å; I222-I322 HydrophobicContact CD1-CD1 4.25Å; I222-I322 HydrophobicContact CD1-CG2 3.63Å; I222-I322 HydrophobicContact CG2-CG2 4.25Å; R311-I322 PolarHBondContact NH1-O 3.21Å; R311-I322 PolarHBondContact O-N 3Å; R313-I322 HydrophobicContact CG-CD1 4.26Å; I322-T324 WeakPolarHBondContact CG2-OG1 3.4Å
323	G	88.1	Confident	83.8	Confident	27 Å²	27	64.7 Å²	64.7	28%	0.278	34%	0.336	S	S	.	.			trans	-80.6	-8.5	-177	0	0	0	0	0	115.5	K321 M325 Q391	K321-G323 PolarHBondContact O-N 3.49Å; G323-M325 PolarHBondContact O-N 3.22Å; G323-Q391 PolarHBondContact O-NE2 3.36Å
324	T	90.4	Very high	83.9	Confident	21 Å²	21	61.9 Å²	61.9	13%	0.129	33%	0.331	C	S	.	.			trans	-54.4	125.3	-173.6	-49.3	0	0	0	0	112.4	I222 V258 R311 I322	I222-T324 HydrophobicContact CG2-CG2 4.28Å; V258-T324 HydrophobicContact CB-CG2 4.2Å; V258-T324 HydrophobicContact CG2-CG2 3.71Å; R311-T324 PolarHBondContact NH1-O 3.11Å; R311-T324 PolarHBondContact NH2-O 3.49Å; I322-T324 WeakPolarHBondContact CG2-OG1 3.4Å
325	M	92.9	Very high	84.3	Confident	76 Å²	76	58.6 Å²	58.6	37%	0.374	32%	0.316	S	S	.	.			trans	-72.7	133.6	172.2	-66.4	-58	-68.4	0	0	109.7	G323 N389 Q391	G323-M325 PolarHBondContact O-N 3.22Å; M325-N389 WeakPolarHBondContact CE-O 3.43Å; M325-Q391 HydrophobicContact SD-CB 3.96Å; M325-Q391 HydrophobicContact SD-CG 4.28Å
326	I	93.5	Very high	84.4	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.6	178.1	-59.9	171.8	0	0	0	106.7	I222 V258 L260 V309 F328	I222-I326 HydrophobicContact CD1-CD1 4.12Å; I222-I326 HydrophobicContact CG1-CD1 3.97Å; V258-I326 HydrophobicContact CG1-CG1 4.39Å; V258-I326 CarbonylContact O-C 3.47Å; V258-I326 WeakPolarHBondContact O-CA 3.36Å; L260-I326 HydrophobicContact CB-CG2 4.33Å; V309-I326 HydrophobicContact CB-CD1 4.34Å; V309-I326 HydrophobicContact CG1-CD1 3.32Å; V309-I326 HydrophobicContact CG2-CD1 4.04Å; I326-F328 WeakPolarHBondContact O-CD1 3.2Å
327	Q	94.3	Very high	84	Confident	99 Å²	99	62.5 Å²	62.5	46%	0.463	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.4	172.8	-69.6	179.9	-26	0	0	109.5	H257 V258 T259 L260	H257-Q327 PolarHBondContact ND1-NE2 2.78Å; V258-Q327 PolarHBondContact O-N 3.47Å; T259-Q327 CarbonylContact C-O 3.58Å; T259-Q327 WeakPolarHBondContact CA-O 3.49Å; T259-Q327 HydrophobicContact CG2-CB 4.49Å; L260-Q327 PolarHBondContact N-O 2.7Å
328	F	95.2	Very high	83.7	Confident	11 Å²	11	53.8 Å²	53.8	5%	0.048	28%	0.282	C	S	.	.			trans	-130.6	139.1	178	53.6	-89.8	0	0	0	109.3	L260 I326 L344 V347 V387 V390 A392 L395	L260-F328 HydrophobicContact CB-CB 4.15Å; L260-F328 HydrophobicContact CD2-CB 3.97Å; I326-F328 WeakPolarHBondContact O-CD1 3.2Å; F328-L344 HydrophobicContact CD2-CD2 4.04Å; F328-L344 HydrophobicContact CE2-CD2 3.83Å; F328-V347 HydrophobicContact CZ-CG2 4.32Å; F328-V387 WeakPolarHBondContact CZ-O 3.3Å; F328-V390 HydrophobicContact CZ-CG2 4.05Å; F328-A392 HydrophobicContact CD1-CB 3.82Å; F328-A392 HydrophobicContact CE1-CB 3.38Å; F328-A392 HydrophobicContact CZ-CB 3.93Å; F328-L395 HydrophobicContact CB-CD2 3.73Å; F328-L395 HydrophobicContact CD1-CD2 3.85Å; F328-L395 HydrophobicContact CD2-CD2 3.53Å; F328-L395 HydrophobicContact CE1-CD2 4.41Å; F328-L395 HydrophobicContact CE2-CD2 4.09Å; F328-L395 HydrophobicContact CG-CD2 3.39Å; F328-L395 HydrophobicContact CZ-CD2 4.49Å
329	P	93.8	Very high	83.4	Confident	49 Å²	49	58.9 Å²	58.9	32%	0.318	31%	0.311	S	S	.	.			trans	-78.8	140.8	-178.2	31.7	-34.8	0	0	0	111.2	H331 L333 Y397	P329-H331 VanDerWaalsContact C-N 3.31Å; P329-L333 HydrophobicContact CG-CB 3.93Å; P329-L333 HydrophobicContact CG-CD1 3.87Å; P329-Y397 VanDerWaalsContact O-CE1 3.31Å; P329-Y397 WeakPolarHBondContact O-CE1 3.29Å; P329-Y397 PolarHBondContact O-OH 2.93Å
330	L	92.9	Very high	83.2	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.037	31%	0.308	C	S	.	.	S	Bend	trans	-70.9	-30.7	169.3	-62.3	-176.6	0	0	0	112.3	D343 L344 W371 P384 V387 E388	L330-D343 CarbonylContact O-C 3.49Å; L330-L344 HydrophobicContact CD2-CB 4.44Å; L330-L344 HydrophobicContact CD2-CD2 3.55Å; L330-L344 PolarHBondContact O-N 3.48Å; L330-W371 HydrophobicContact CD2-CZ2 4.02Å; L330-P384 HydrophobicContact CD1-CB 3.6Å; L330-V387 HydrophobicContact CD2-CB 4.25Å; L330-V387 HydrophobicContact CD2-CG1 3.84Å; L330-E388 HydrophobicContact CD1-CG 3.68Å; L330-E388 WeakPolarHBondContact CD1-OE1 3.45Å; L330-E388 HydrophobicContact CD2-CG 3.91Å; L330-E388 HydrophobicContact CG-CG 3.5Å; L330-E388 WeakPolarHBondContact CG-OE1 3.46Å
331	H	90.1	Very high	83.2	Confident	121 Å²	121	56.5 Å²	56.5	56%	0.56	30%	0.303	S	S	*	.	S	Bend	trans	-132.3	146.8	-176.7	-61.2	-61.5	0	0	0	111.5	P329 L333 D343	P329-H331 VanDerWaalsContact C-N 3.31Å; H331-L333 PolarHBondContact O-N 2.86Å; H331-D343 WeakPolarHBondContact CA-OD1 3.44Å; H331-D343 WeakPolarHBondContact CB-OD1 3.22Å; H331-D343 IonicContact CG-OD1 3.42Å; H331-D343 IonicContact ND1-OD1 2.65Å; H331-D343 PolarHBondContact ND1-OD1 3.4Å
332	G	86.6	Confident	83.5	Confident	35 Å²	35	54.3 Å²	54.3	36%	0.361	29%	0.293	S	S	.	.			trans	65.6	37.7	170.3	0	0	0	0	0	114.6	D334 Y342 D343	G332-D334 PolarHBondContact O-N 3.36Å; G332-Y342 PolarHBondContact N-O 3.35Å; G332-Y342 VanDerWaalsContact N-O 3.15Å; G332-D343 PolarHBondContact N-OD1 2.89Å
333	L	89.5	Confident	83.7	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	109.2	167.7	176.8	63.3	0	0	0	108.6	L260 F264 L307 P329 H331 L335 Y342 Y397	L260-L333 HydrophobicContact CD2-CD1 3.88Å; L260-L333 HydrophobicContact CD2-CD2 3.94Å; F264-L333 HydrophobicContact CE2-CD2 4.44Å; L307-L333 HydrophobicContact CD1-CD2 4.2Å; P329-L333 HydrophobicContact CG-CB 3.93Å; P329-L333 HydrophobicContact CG-CD1 3.87Å; H331-L333 PolarHBondContact O-N 2.86Å; L333-L335 HydrophobicContact CD2-CD2 4.42Å; L333-L335 HydrophobicContact CG-CD2 4.32Å; L333-Y342 WeakPolarHBondContact CB-O 3.29Å; L333-Y342 PolarHBondContact N-O 2.93Å; L333-Y342 PolarHBondContact O-N 3.13Å; L333-Y342 VanDerWaalsContact O-N 3.1Å; L333-Y397 HydrophobicContact CB-CD1 3.91Å; L333-Y397 HydrophobicContact CB-CE1 3.69Å; L333-Y397 HydrophobicContact CD2-CD1 3.82Å; L333-Y397 HydrophobicContact CD2-CD2 3.73Å; L333-Y397 HydrophobicContact CD2-CE1 3.85Å; L333-Y397 HydrophobicContact CD2-CE2 3.74Å; L333-Y397 HydrophobicContact CD2-CG 3.76Å; L333-Y397 HydrophobicContact CG-CE1 4.36Å
334	D	79.5	Confident	83.9	Confident	74 Å²	74	54.3 Å²	54.3	40%	0.396	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	107.7	179	179.8	13	0	0	0	109.9	G332 K336	G332-D334 PolarHBondContact O-N 3.36Å; D334-K336 VanDerWaalsContact C-N 3.26Å; D334-K336 PolarHBondContact O-N 3.11Å; D334-K336 WeakPolarHBondContact OD1-CA 2.93Å; D334-K336 PolarHBondContact OD1-N 2.97Å; D334-K336 VanDerWaalsContact OD1-N 3.15Å
335	L	77.9	Confident	84.1	Confident	13 Å²	13	53.5 Å²	53.5	7%	0.068	28%	0.282	C	S	.	.			trans	-86.1	74.6	167.9	-59.3	-179.3	0	0	0	107.6	F264 L296 L299 L305 L333 Q337 F338	F264-L335 HydrophobicContact CD1-CD2 4.19Å; F264-L335 HydrophobicContact CD2-CD2 3.68Å; F264-L335 HydrophobicContact CE1-CD2 3.84Å; F264-L335 HydrophobicContact CE2-CD2 3.3Å; F264-L335 HydrophobicContact CG-CD2 4.11Å; F264-L335 HydrophobicContact CZ-CD1 4.45Å; F264-L335 HydrophobicContact CZ-CD2 3.38Å; L296-L335 HydrophobicContact CD2-CD1 4.41Å; L299-L335 HydrophobicContact CD1-CD1 3.81Å; L299-L335 HydrophobicContact CD2-CD1 3.83Å; L299-L335 HydrophobicContact CG-CD1 4.47Å; L305-L335 HydrophobicContact CD2-CD1 3.66Å; L333-L335 HydrophobicContact CD2-CD2 4.42Å; L333-L335 HydrophobicContact CG-CD2 4.32Å; L335-Q337 CarbonylContact O-C 3.38Å; L335-Q337 WeakPolarHBondContact O-CA 3.2Å; L335-Q337 PolarHBondContact O-N 3.49Å; L335-F338 HydrophobicContact CB-CD2 4.17Å; L335-F338 WeakPolarHBondContact O-CD2 3.28Å; L335-F338 PolarHBondContact O-N 3.41Å
336	K	68.5	Low	84.1	Confident	173 Å²	173	49.9 Å²	49.9	75%	0.752	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-20.8	-28.8	-174.4	-64.7	179.7	177.9	177.5	0	119.1	D334 F338	D334-K336 VanDerWaalsContact C-N 3.26Å; D334-K336 PolarHBondContact O-N 3.11Å; D334-K336 WeakPolarHBondContact OD1-CA 2.93Å; D334-K336 PolarHBondContact OD1-N 2.97Å; D334-K336 VanDerWaalsContact OD1-N 3.15Å; K336-F338 VanDerWaalsContact C-N 3.31Å
337	Q	65.5	Low	84.2	Confident	123 Å²	123	49.7 Å²	49.7	58%	0.575	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.4	172.8	-63.6	177.9	2.7	0	0	114	L335	L335-Q337 CarbonylContact O-C 3.38Å; L335-Q337 WeakPolarHBondContact O-CA 3.2Å; L335-Q337 PolarHBondContact O-N 3.49Å
338	F	62.3	Low	84.3	Confident	43 Å²	43	45 Å²	45	19%	0.189	24%	0.241	C	C	.	.	S	Bend	trans	-126.4	142.9	-174.9	-60	-87.4	0	0	0	111.1	L296 L299 L335 K336 T340	L296-F338 HydrophobicContact CB-CE2 3.66Å; L296-F338 HydrophobicContact CB-CZ 3.64Å; L296-F338 HydrophobicContact CD2-CD2 3.91Å; L296-F338 HydrophobicContact CD2-CE2 3.13Å; L296-F338 HydrophobicContact CD2-CZ 3.63Å; L296-F338 HydrophobicContact CG-CE2 3.48Å; L296-F338 VanDerWaalsContact CG-CE2 3.48Å; L296-F338 HydrophobicContact CG-CZ 3.41Å; L296-F338 VanDerWaalsContact CG-CZ 3.41Å; L299-F338 HydrophobicContact CD1-CB 3.78Å; L299-F338 HydrophobicContact CD1-CD1 3.86Å; L299-F338 HydrophobicContact CD1-CD2 3.54Å; L299-F338 HydrophobicContact CD1-CE1 4.4Å; L299-F338 HydrophobicContact CD1-CE2 4.17Å; L299-F338 HydrophobicContact CD1-CG 3.4Å; L299-F338 VanDerWaalsContact CD1-CG 3.4Å; L299-F338 HydrophobicContact CG-CD1 4.14Å; L299-F338 HydrophobicContact CG-CD2 4.11Å; L299-F338 HydrophobicContact CG-CE1 4.23Å; L299-F338 HydrophobicContact CG-CE2 4.25Å; L299-F338 HydrophobicContact CG-CG 4.1Å; L299-F338 HydrophobicContact CG-CZ 4.29Å; L335-F338 HydrophobicContact CB-CD2 4.17Å; L335-F338 WeakPolarHBondContact O-CD2 3.28Å; L335-F338 PolarHBondContact O-N 3.41Å; K336-F338 VanDerWaalsContact C-N 3.31Å; F338-T340 PolarHBondContact O-N 2.9Å; F338-T340 VanDerWaalsContact O-N 3.13Å
339	V	63.8	Low	84.2	Confident	155 Å²	155	45.1 Å²	45.1	94%	0.939	24%	0.244	S	C	*	.	S	Bend	trans	-72.3	-2.6	-179.5	-177.2	0	0	0	0	112.5
340	T	70.5	Confident	84	Confident	37 Å²	37	43.1 Å²	43.1	23%	0.227	23%	0.23	C	C	.	.			trans	-107.6	130.5	-168	57.8	0	0	0	0	111	F338 K399	F338-T340 PolarHBondContact O-N 2.9Å; F338-T340 VanDerWaalsContact O-N 3.13Å; T340-K399 HydrophobicContact CG2-CD 4.43Å; T340-K399 VanDerWaalsContact CG2-CE 3.4Å
341	T	81.7	Confident	83.8	Confident	53 Å²	53	45.7 Å²	45.7	33%	0.325	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	158.4	172.4	47.2	0	0	0	0	111.6	T400	T341-T400 PolarHBondContact O-N 2.96Å; T341-T400 PolarHBondContact O-OG1 2.9Å; T341-T400 WeakPolarHBondContact OG1-CB 3.41Å
342	Y	89.1	Confident	83.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.7	174.8	-64.1	-109.5	0	0	0	112	L299 L305 G332 L333 Q398 K399	L299-Y342 WeakPolarHBondContact CB-OH 3.15Å; L299-Y342 HydrophobicContact CD1-CE2 3.8Å; L305-Y342 HydrophobicContact CB-CD1 4.08Å; L305-Y342 HydrophobicContact CB-CE1 4.01Å; G332-Y342 PolarHBondContact N-O 3.35Å; G332-Y342 VanDerWaalsContact N-O 3.15Å; L333-Y342 WeakPolarHBondContact CB-O 3.29Å; L333-Y342 PolarHBondContact N-O 2.93Å; L333-Y342 PolarHBondContact O-N 3.13Å; L333-Y342 VanDerWaalsContact O-N 3.1Å; Y342-Q398 CarbonylContact C-O 3.54Å; Y342-Q398 WeakPolarHBondContact CA-O 3.19Å; Y342-Q398 WeakPolarHBondContact CB-O 3.34Å; Y342-Q398 VanDerWaalsContact CD1-C 3.47Å; Y342-K399 VanDerWaalsContact CD1-CA 3.47Å; Y342-K399 HydrophobicContact CD1-CB 3.97Å; Y342-K399 VanDerWaalsContact CD1-N 3.26Å; Y342-K399 HydrophobicContact CE1-CB 3.62Å; Y342-K399 HydrophobicContact CE1-CG 4.29Å
343	D	90.8	Very high	83	Confident	42 Å²	42	45 Å²	45	23%	0.225	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140	174.7	-59.2	-45.4	0	0	0	110.4	L330 H331 G332 I345 Y397 Q398 T400	L330-D343 CarbonylContact O-C 3.49Å; H331-D343 WeakPolarHBondContact CA-OD1 3.44Å; H331-D343 WeakPolarHBondContact CB-OD1 3.22Å; H331-D343 IonicContact CG-OD1 3.42Å; H331-D343 IonicContact ND1-OD1 2.65Å; H331-D343 PolarHBondContact ND1-OD1 3.4Å; G332-D343 PolarHBondContact N-OD1 2.89Å; D343-I345 PolarHBondContact O-N 3.44Å; D343-Y397 CarbonylContact O-C 3.44Å; D343-Y397 WeakPolarHBondContact O-CA 3.07Å; D343-Q398 PolarHBondContact N-O 3.49Å; D343-Q398 PolarHBondContact O-N 2.65Å; D343-T400 PolarHBondContact OD1-OG1 2.05Å; D343-T400 WeakPolarHBondContact OD2-CG2 3.42Å; D343-T400 PolarHBondContact OD2-OG1 3.15Å
344	L	94.2	Very high	82	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.016	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	128.6	178.9	-170.5	76.2	0	0	0	109.6	F328 L330 A346 V347 W371 V387 L395 Y397	F328-L344 HydrophobicContact CD2-CD2 4.04Å; F328-L344 HydrophobicContact CE2-CD2 3.83Å; L330-L344 HydrophobicContact CD2-CB 4.44Å; L330-L344 HydrophobicContact CD2-CD2 3.55Å; L330-L344 PolarHBondContact O-N 3.48Å; L344-A346 WeakPolarHBondContact CD1-O 3.34Å; L344-V347 HydrophobicContact CD2-CB 4.25Å; L344-V347 HydrophobicContact CD2-CG1 4.27Å; L344-W371 HydrophobicContact CB-CH2 4.19Å; L344-W371 HydrophobicContact CB-CZ2 4.46Å; L344-W371 HydrophobicContact CD2-CH2 3.74Å; L344-W371 HydrophobicContact CD2-CZ2 4.33Å; L344-W371 HydrophobicContact CD2-CZ3 4.5Å; L344-W371 HydrophobicContact CG-CH2 3.86Å; L344-W371 WeakPolarHBondContact O-CH2 3.28Å; L344-W371 WeakPolarHBondContact O-CZ2 3.39Å; L344-V387 HydrophobicContact CD2-CG1 4.12Å; L344-L395 HydrophobicContact CD1-CB 3.88Å; L344-L395 HydrophobicContact CD1-CD2 4.04Å; L344-L395 HydrophobicContact CD1-CG 4.47Å; L344-Y397 HydrophobicContact CB-CD1 4.21Å; L344-Y397 HydrophobicContact CB-CE1 3.74Å; L344-Y397 HydrophobicContact CD1-CD1 4.39Å; L344-Y397 HydrophobicContact CD1-CD2 3.97Å; L344-Y397 HydrophobicContact CD1-CE1 4.01Å; L344-Y397 HydrophobicContact CD1-CE2 3.57Å; L344-Y397 HydrophobicContact CD1-CG 4.36Å; L344-Y397 HydrophobicContact CG-CE1 4.5Å
345	I	92.8	Very high	81.4	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.015	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-26.1	176.3	56.4	162.1	0	0	0	112.6	C95 V304 D343 C363 F364 H366 F396 Q398	C95-I345 HydrophobicContact CB-CD1 4.11Å; C95-I345 VanDerWaalsContact SG-CD1 3.54Å; V304-I345 HydrophobicContact CG1-CD1 4.21Å; V304-I345 HydrophobicContact CG2-CD1 4.21Å; D343-I345 PolarHBondContact O-N 3.44Å; I345-C363 WeakPolarHBondContact O-CA 3.3Å; I345-F364 PolarHBondContact O-N 3Å; I345-H366 WeakPolarHBondContact CG2-NE2 3.31Å; I345-F396 HydrophobicContact CD1-CB 4.19Å; I345-F396 HydrophobicContact CG1-CB 3.8Å; I345-F396 WeakPolarHBondContact CG1-O 3.23Å; I345-F396 PolarHBondContact N-O 2.99Å; I345-Q398 HydrophobicContact CD1-CB 4.26Å; I345-Q398 HydrophobicContact CG1-CB 4.35Å; I345-Q398 HydrophobicContact CG2-CB 3.54Å; I345-Q398 HydrophobicContact CG2-CG 4.48Å
346	A	94.3	Very high	81.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	148.3	172.7	0	0	0	0	0	112	A91 L344 Y362 C363 F396	A91-A346 HydrophobicContact CB-CB 3.79Å; L344-A346 WeakPolarHBondContact CD1-O 3.34Å; A346-Y362 CarbonylContact C-O 3.53Å; A346-Y362 WeakPolarHBondContact CA-O 3.22Å; A346-C363 HydrophobicContact CB-CB 4.32Å; A346-F396 HydrophobicContact CB-CB 4.15Å; A346-F396 HydrophobicContact CB-CD2 4.08Å; A346-F396 HydrophobicContact CB-CG 4.43Å; A346-F396 PolarHBondContact N-O 3.28Å; A346-F396 PolarHBondContact O-N 2.89Å
347	V	95.9	Very high	81.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.8	168.4	58.2	0	0	0	0	109.9	F328 L344 Y362 V387 V390 A392 I394 L395	F328-V347 HydrophobicContact CZ-CG2 4.32Å; L344-V347 HydrophobicContact CD2-CB 4.25Å; L344-V347 HydrophobicContact CD2-CG1 4.27Å; V347-Y362 HydrophobicContact CG1-CD2 4.27Å; V347-Y362 HydrophobicContact CG1-CG 4.35Å; V347-Y362 PolarHBondContact N-O 3.48Å; V347-Y362 PolarHBondContact O-N 3.37Å; V347-V387 HydrophobicContact CG1-CG1 3.59Å; V347-V390 HydrophobicContact CG1-CG2 3.93Å; V347-V390 HydrophobicContact CG2-CG2 3.9Å; V347-A392 HydrophobicContact CG2-CB 3.59Å; V347-I394 CarbonylContact C-O 3.51Å; V347-I394 WeakPolarHBondContact CA-O 3.36Å; V347-L395 HydrophobicContact CG2-CD2 4.44Å; V347-L395 HydrophobicContact CG2-CG 4.23Å
348	I	94.5	Very high	83	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127	171.6	-59.7	174.8	0	0	0	107.4	V88 A91 Y359 I360 A361 Y393 I394 F396	V88-I348 HydrophobicContact CB-CD1 4.44Å; V88-I348 HydrophobicContact CG2-CD1 3.84Å; A91-I348 HydrophobicContact CB-CD1 4.05Å; A91-I348 HydrophobicContact CB-CG1 4.16Å; I348-Y359 HydrophobicContact CG2-CD1 3.99Å; I348-I360 WeakPolarHBondContact CA-O 3.42Å; I348-A361 HydrophobicContact CG1-CB 4.41Å; I348-Y393 WeakPolarHBondContact O-CA 3.24Å; I348-Y393 WeakPolarHBondContact O-CB 3.35Å; I348-Y393 PolarHBondContact O-N 3.06Å; I348-I394 HydrophobicContact CB-CB 4.2Å; I348-I394 HydrophobicContact CD1-CB 4.32Å; I348-I394 HydrophobicContact CD1-CD1 4.43Å; I348-I394 PolarHBondContact N-O 3.12Å; I348-I394 PolarHBondContact O-N 3.19Å; I348-F396 HydrophobicContact CD1-CE2 4.12Å
349	S	94	Very high	84.3	Confident	15 Å²	15	39.4 Å²	39.4	11%	0.105	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	146.4	171.9	-169.9	0	0	0	0	110.3	Y359 I360 Q391	S349-Y359 WeakPolarHBondContact O-CA 3.11Å; S349-I360 PolarHBondContact N-O 3.45Å; S349-I360 PolarHBondContact O-N 2.88Å; S349-Q391 WeakPolarHBondContact CA-O 3.42Å; S349-Q391 WeakPolarHBondContact CB-O 3.1Å; S349-Q391 PolarHBondContact OG-O 3.15Å
350	H	89.6	Confident	85.8	Confident	7 Å²	7	33.4 Å²	33.4	3%	0.032	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127	171.3	-179.4	-108.6	0	0	0	109.2	F312 K321 G357 H358 Y359 Q391	F312-H350 AromaticContact CZ-CE1 3.71Å; F312-H350 AromaticContact CZ-ND1 3.42Å; F312-H350 WeakPolarHBondContact CZ-ND1 3.4Å; K321-H350 WeakPolarHBondContact CE-ND1 3.46Å; K321-H350 PolarHBondContact NZ-ND1 3.43Å; K321-H350 PolarHBondContact NZ-O 2.98Å; H350-G357 WeakPolarHBondContact NE2-CA 3.14Å; H350-H358 WeakPolarHBondContact CA-O 3.02Å; H350-Y359 HydrophobicContact CB-CD1 3.83Å; H350-Y359 HydrophobicContact CB-CE1 3.54Å; H350-Y359 AromaticContact CD2-CD1 3.73Å; H350-Y359 AromaticContact CD2-CD2 3.69Å; H350-Y359 AromaticContact CD2-CE1 3.33Å; H350-Y359 WeakPolarHBondContact CD2-CE1 3.2Å; H350-Y359 AromaticContact CD2-CE2 3.32Å; H350-Y359 WeakPolarHBondContact CD2-CE2 3.36Å; H350-Y359 AromaticContact CD2-CG 3.89Å; H350-Y359 AromaticContact CD2-CZ 3.13Å; H350-Y359 AromaticContact CG-CE1 3.65Å; H350-Y359 AromaticContact CG-CZ 3.79Å; H350-Y359 AromaticContact NE2-CE2 3.77Å; H350-Y359 AromaticContact NE2-CZ 3.76Å; H350-Q391 PolarHBondContact O-OE1 2.96Å
351	S	88.6	Confident	86.9	Confident	61 Å²	61	31.6 Å²	31.6	43%	0.427	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	155	168.1	63.5	0	0	0	0	110	G357 H358	S351-G357 CarbonylContact O-C 3.55Å; S351-G357 WeakPolarHBondContact O-CA 3.18Å; S351-H358 PolarHBondContact N-O 3.42Å; S351-H358 PolarHBondContact O-N 3.31Å; S351-H358 PolarHBondContact OG-O 2.89Å
352	G	84.6	Confident	87.7	Confident	45 Å²	45	30.7 Å²	30.7	46%	0.464	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	91.2	-169.9	-177.9	0	0	0	0	0	114.8	K321 G356	K321-G352 WeakPolarHBondContact CD-O 3.12Å; K321-G352 PolarHBondContact NZ-O 2.96Å; G352-G356 CarbonylContact C-O 3.58Å
353	V	75.2	Confident	88	Confident	97 Å²	97	30.7 Å²	30.7	59%	0.588	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	-178.8	-173.1	-63.3	0	0	0	0	111	E355 G356	V353-E355 VanDerWaalsContact C-N 3.34Å; V353-E355 PolarHBondContact O-N 3.44Å; V353-G356 CarbonylContact C-O 3.52Å; V353-G356 PolarHBondContact N-O 2.71Å; V353-G356 CarbonylContact O-C 2.9Å; V353-G356 PolarHBondContact O-N 2.83Å
354	T	69.4	Low	88	Confident	10 Å²	10	30.4 Å²	30.4	6%	0.061	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-37.4	-174.9	-36	0	0	0	0	113.4	Q144 F312 S319	Q144-T354 HydrophobicContact CB-CG2 4.25Å; Q144-T354 HydrophobicContact CG-CG2 4.18Å; Q144-T354 VanDerWaalsContact CG-O 3.27Å; Q144-T354 WeakPolarHBondContact CG-O 3.24Å; Q144-T354 PolarHBondContact NE2-O 3.22Å; F312-T354 HydrophobicContact CD1-CG2 4.02Å; S319-T354 VanDerWaalsContact C-OG1 3.31Å; S319-T354 PolarHBondContact O-OG1 2.9Å
355	E	67.2	Low	87.5	Confident	156 Å²	156	30.4 Å²	30.4	73%	0.729	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-14.5	-177.6	-70.9	179.7	179.7	0	0	114.4	Q144 V353	Q144-E355 VanDerWaalsContact NE2-CA 3.32Å; V353-E355 VanDerWaalsContact C-N 3.34Å; V353-E355 PolarHBondContact O-N 3.44Å
356	G	71.9	Confident	86.7	Confident	39 Å²	39	33.2 Å²	33.2	40%	0.402	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-167	128.9	-173.6	0	0	0	0	0	110.4	G352 V353	G352-G356 CarbonylContact C-O 3.58Å; V353-G356 CarbonylContact C-O 3.52Å; V353-G356 PolarHBondContact N-O 2.71Å; V353-G356 CarbonylContact O-C 2.9Å; V353-G356 PolarHBondContact O-N 2.83Å
357	G	83.8	Confident	85.6	Confident	39 Å²	39	35.8 Å²	35.8	40%	0.402	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	-175.8	-178.3	0	0	0	0	0	111.3	H350 S351	H350-G357 WeakPolarHBondContact NE2-CA 3.14Å; S351-G357 CarbonylContact O-C 3.55Å; S351-G357 WeakPolarHBondContact O-CA 3.18Å
358	H	89	Confident	84.6	Confident	46 Å²	46	38 Å²	38	21%	0.213	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	132	-172.5	-171.5	52.4	0	0	0	110.7	C83 H350 S351 D375 D376	C83-H358 WeakPolarHBondContact CB-ND1 3.43Å; C83-H358 PolarHBondContact SG-ND1 3.33Å; C83-H358 VanDerWaalsContact SG-ND1 3.38Å; H350-H358 WeakPolarHBondContact CA-O 3.02Å; S351-H358 PolarHBondContact N-O 3.42Å; S351-H358 PolarHBondContact O-N 3.31Å; S351-H358 PolarHBondContact OG-O 2.89Å; H358-D375 IonicContact CD2-OD1 3.52Å; H358-D375 IonicContact CE1-OD1 3.59Å; H358-D375 PolarHBondContact CE1-OD1 3.47Å; H358-D375 IonicContact NE2-OD1 2.81Å; H358-D375 PolarHBondContact NE2-OD1 3.08Å; H358-D375 IonicContact NE2-OD2 3.32Å; H358-D376 IonicContact CE1-OD2 3.49Å; H358-D376 PolarHBondContact CE1-OD2 3.29Å; H358-D376 VanDerWaalsContact CE1-OD2 3.32Å
359	Y	89.7	Confident	84	Confident	19 Å²	19	39.6 Å²	39.6	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.7	-177.9	-68	-87.5	0	0	0	110.3	V147 I348 S349 H350 Y393	V147-Y359 HydrophobicContact CG2-CD1 4.16Å; V147-Y359 HydrophobicContact CG2-CE1 3.42Å; V147-Y359 VanDerWaalsContact CG2-CE1 3.42Å; V147-Y359 HydrophobicContact CG2-CE2 3.94Å; V147-Y359 VanDerWaalsContact CG2-OH 3.3Å; V147-Y359 WeakPolarHBondContact CG2-OH 3.42Å; I348-Y359 HydrophobicContact CG2-CD1 3.99Å; S349-Y359 WeakPolarHBondContact O-CA 3.11Å; H350-Y359 HydrophobicContact CB-CD1 3.83Å; H350-Y359 HydrophobicContact CB-CE1 3.54Å; H350-Y359 AromaticContact CD2-CD1 3.73Å; H350-Y359 AromaticContact CD2-CD2 3.69Å; H350-Y359 AromaticContact CD2-CE1 3.33Å; H350-Y359 WeakPolarHBondContact CD2-CE1 3.2Å; H350-Y359 AromaticContact CD2-CE2 3.32Å; H350-Y359 WeakPolarHBondContact CD2-CE2 3.36Å; H350-Y359 AromaticContact CD2-CG 3.89Å; H350-Y359 AromaticContact CD2-CZ 3.13Å; H350-Y359 AromaticContact CG-CE1 3.65Å; H350-Y359 AromaticContact CG-CZ 3.79Å; H350-Y359 AromaticContact NE2-CE2 3.77Å; H350-Y359 AromaticContact NE2-CZ 3.76Å; Y359-Y393 HydrophobicContact CD1-CD1 4.25Å; Y359-Y393 AromaticContact CE1-CD1 3.61Å; Y359-Y393 HydrophobicContact CE1-CD1 3.61Å; Y359-Y393 AromaticContact CE1-CE1 3.63Å; Y359-Y393 HydrophobicContact CE1-CE1 3.63Å
360	I	94.5	Very high	83.7	Confident	29 Å²	29	41.8 Å²	41.8	15%	0.149	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.8	176.3	-59.6	175.7	0	0	0	107.4	I348 S349 Y362 D375	I348-I360 WeakPolarHBondContact CA-O 3.42Å; S349-I360 PolarHBondContact N-O 3.45Å; S349-I360 PolarHBondContact O-N 2.88Å; I360-Y362 HydrophobicContact CB-CE2 4.11Å; I360-Y362 HydrophobicContact CG2-CD2 4.26Å; I360-Y362 HydrophobicContact CG2-CE1 4.48Å; I360-Y362 HydrophobicContact CG2-CE2 3.68Å; I360-D375 HydrophobicContact CD1-CB 4.36Å; I360-D375 HydrophobicContact CG1-CB 4.23Å; I360-D375 HydrophobicContact CG2-CB 4.34Å
361	A	94.8	Very high	83.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135.9	171.5	0	0	0	0	0	110.3	S87 Q90 I348 S373 F374	S87-A361 WeakPolarHBondContact O-CB 3.39Å; Q90-A361 HydrophobicContact CB-CB 3.85Å; I348-A361 HydrophobicContact CG1-CB 4.41Å; A361-S373 CarbonylContact O-C 3.55Å; A361-S373 WeakPolarHBondContact O-CA 3.13Å; A361-F374 HydrophobicContact CB-CB 4.38Å; A361-F374 PolarHBondContact N-O 2.86Å; A361-F374 PolarHBondContact O-N 3.46Å
362	Y	97.9	Very high	84.2	Confident	33 Å²	33	40.3 Å²	40.3	13%	0.129	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.8	169.5	-59.5	-97.3	0	0	0	106.8	A346 V347 I360 Y372 V382 V386 V387 V390	A346-Y362 CarbonylContact C-O 3.53Å; A346-Y362 WeakPolarHBondContact CA-O 3.22Å; V347-Y362 HydrophobicContact CG1-CD2 4.27Å; V347-Y362 HydrophobicContact CG1-CG 4.35Å; V347-Y362 PolarHBondContact N-O 3.48Å; V347-Y362 PolarHBondContact O-N 3.37Å; I360-Y362 HydrophobicContact CB-CE2 4.11Å; I360-Y362 HydrophobicContact CG2-CD2 4.26Å; I360-Y362 HydrophobicContact CG2-CE1 4.48Å; I360-Y362 HydrophobicContact CG2-CE2 3.68Å; Y362-Y372 CarbonylContact C-O 3.59Å; Y362-Y372 VanDerWaalsContact CA-O 3.27Å; Y362-Y372 WeakPolarHBondContact CA-O 3.37Å; Y362-V382 HydrophobicContact CD1-CG2 4.12Å; Y362-V382 HydrophobicContact CE1-CG1 4.49Å; Y362-V386 HydrophobicContact CE1-CG1 4.3Å; Y362-V387 HydrophobicContact CD1-CG2 4.4Å; Y362-V390 HydrophobicContact CD2-CG1 4.08Å; Y362-V390 HydrophobicContact CD2-CG2 4.46Å; Y362-V390 HydrophobicContact CE1-CG1 4.17Å; Y362-V390 HydrophobicContact CE2-CB 4.32Å; Y362-V390 HydrophobicContact CE2-CG1 3.66Å
363	C	94.6	Very high	84.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.2	-175.2	-49.2	0	0	0	0	111.1	Q90 N94 I345 A346 Y372 F374	Q90-C363 PolarHBondContact O-SG 2.9Å; Q90-C363 VanDerWaalsContact O-SG 3.42Å; N94-C363 HydrophobicContact CB-CB 3.62Å; I345-C363 WeakPolarHBondContact O-CA 3.3Å; A346-C363 HydrophobicContact CB-CB 4.32Å; C363-Y372 PolarHBondContact N-O 3.33Å; C363-Y372 PolarHBondContact O-N 3.49Å; C363-F374 HydrophobicContact CB-CD2 4.23Å; C363-F374 HydrophobicContact CB-CE2 3.78Å
364	F	91	Very high	85.7	Confident	36 Å²	36	34.8 Å²	34.8	16%	0.158	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	119.5	172.8	-175.4	-104.6	0	0	0	109.5	I345 H366 C369 W371	I345-F364 PolarHBondContact O-N 3Å; F364-H366 AromaticContact CD1-CE1 3.71Å; F364-H366 AromaticContact CD1-CG 3.9Å; F364-H366 AromaticContact CD1-ND1 3.64Å; F364-H366 AromaticContact CD1-NE2 3.98Å; F364-H366 AromaticContact CE1-ND1 3.71Å; F364-H366 PolarHBondContact O-N 3.49Å; F364-C369 HydrophobicContact CZ-CB 3.87Å; F364-W371 HydrophobicContact CB-CD2 4.09Å; F364-W371 HydrophobicContact CB-CE3 4.1Å; F364-W371 HydrophobicContact CB-CH2 3.87Å; F364-W371 HydrophobicContact CB-CZ2 3.87Å; F364-W371 HydrophobicContact CB-CZ3 3.99Å; F364-W371 AromaticContact CD2-CD1 3.88Å; F364-W371 HydrophobicContact CD2-CD2 4.15Å; F364-W371 AromaticContact CD2-CE2 3.78Å; F364-W371 HydrophobicContact CD2-CG 4.22Å; F364-W371 HydrophobicContact CD2-CZ2 4.27Å; F364-W371 AromaticContact CD2-NE1 3.61Å; F364-W371 HydrophobicContact CG-CZ2 4.41Å
365	N	83.6	Confident	87	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	106.3	175.2	-176.7	-44.4	0	0	0	109.3	V71 L73 L367 N368 C369 Q370 Y372	V71-N365 PolarHBondContact O-ND2 3.26Å; L73-N365 HydrophobicContact CD2-CB 4.4Å; L73-N365 VanDerWaalsContact CD2-ND2 3.32Å; L73-N365 WeakPolarHBondContact CD2-ND2 2.97Å; N365-L367 PolarHBondContact O-N 2.9Å; N365-L367 VanDerWaalsContact OD1-CB 3.28Å; N365-L367 WeakPolarHBondContact OD1-CB 3.47Å; N365-L367 PolarHBondContact OD1-N 3.49Å; N365-N368 WeakPolarHBondContact CB-OD1 3.27Å; N365-N368 PolarHBondContact O-N 3.38Å; N365-N368 PolarHBondContact O-OD1 3.41Å; N365-N368 PolarHBondContact OD1-N 3.27Å; N365-C369 VanDerWaalsContact O-CA 3.24Å; N365-C369 WeakPolarHBondContact O-CA 3.48Å; N365-C369 PolarHBondContact O-N 3.12Å; N365-Q370 PolarHBondContact N-O 3.22Å; N365-Q370 PolarHBondContact O-N 3.33Å; N365-Y372 HydrophobicContact CB-CD2 3.92Å; N365-Y372 HydrophobicContact CB-CE2 3.89Å
366	H	76.5	Confident	88.1	Confident	62 Å²	62	30.2 Å²	30.2	29%	0.287	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16	-178	-64.9	-90.9	0	0	0	114.7	P96 I345 F364 C369 Q398	P96-H366 WeakPolarHBondContact CG-CD2 3.48Å; P96-H366 VanDerWaalsContact CG-NE2 3.28Å; P96-H366 WeakPolarHBondContact CG-NE2 3.35Å; I345-H366 WeakPolarHBondContact CG2-NE2 3.31Å; F364-H366 AromaticContact CD1-CE1 3.71Å; F364-H366 AromaticContact CD1-CG 3.9Å; F364-H366 AromaticContact CD1-ND1 3.64Å; F364-H366 AromaticContact CD1-NE2 3.98Å; F364-H366 AromaticContact CE1-ND1 3.71Å; F364-H366 PolarHBondContact O-N 3.49Å; H366-C369 PolarHBondContact O-SG 3.3Å; H366-Q398 PolarHBondContact CE1-OE1 2.71Å
367	L	71	Confident	88.9	Confident	54 Å²	54	34.5 Å²	34.5	28%	0.283	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-39.4	-179.4	-57.6	173.5	0	0	0	111.6	F39 V71 N365	F39-L367 HydrophobicContact CD1-CD1 4.44Å; F39-L367 HydrophobicContact CE1-CD1 4.21Å; V71-L367 HydrophobicContact CB-CD1 3.59Å; V71-L367 HydrophobicContact CG1-CD1 3.51Å; N365-L367 PolarHBondContact O-N 2.9Å; N365-L367 VanDerWaalsContact OD1-CB 3.28Å; N365-L367 WeakPolarHBondContact OD1-CB 3.47Å; N365-L367 PolarHBondContact OD1-N 3.49Å
368	N	75.2	Confident	89.4	Confident	46 Å²	46	37 Å²	37	25%	0.246	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-3.5	179.8	64.3	30.3	0	0	0	113.7	N365 Q370 Y372	N365-N368 WeakPolarHBondContact CB-OD1 3.27Å; N365-N368 PolarHBondContact O-N 3.38Å; N365-N368 PolarHBondContact O-OD1 3.41Å; N365-N368 PolarHBondContact OD1-N 3.27Å; N368-Q370 PolarHBondContact O-N 2.91Å; N368-Q370 WeakPolarHBondContact OD1-CB 3.28Å; N368-Q370 PolarHBondContact OD1-N 3.11Å; N368-Q370 VanDerWaalsContact OD1-N 3.15Å; N368-Y372 PolarHBondContact ND2-OH 2.93Å
369	C	81.8	Confident	89.6	Confident	35 Å²	35	37 Å²	37	24%	0.236	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	46.4	177.7	-63.1	0	0	0	0	112.5	C60 F364 N365 H366	C60-C369 HydrophobicContact CB-CB 4.28Å; C60-C369 WeakPolarHBondContact CB-SG 3.5Å; C60-C369 WeakPolarHBondContact SG-CB 3.26Å; C60-C369 CovalentContact SG-SG 2.05Å; C60-C369 PolarHBondContact SG-SG 3.11Å; F364-C369 HydrophobicContact CZ-CB 3.87Å; N365-C369 VanDerWaalsContact O-CA 3.24Å; N365-C369 WeakPolarHBondContact O-CA 3.48Å; N365-C369 PolarHBondContact O-N 3.12Å; H366-C369 PolarHBondContact O-SG 3.3Å
370	Q	88	Confident	89.9	Confident	61 Å²	61	37.2 Å²	37.2	29%	0.285	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	153.1	178.4	-60.3	-62.1	-48.3	0	0	111.9	N365 N368 Y372	N365-Q370 PolarHBondContact N-O 3.22Å; N365-Q370 PolarHBondContact O-N 3.33Å; N368-Q370 PolarHBondContact O-N 2.91Å; N368-Q370 WeakPolarHBondContact OD1-CB 3.28Å; N368-Q370 PolarHBondContact OD1-N 3.11Å; N368-Q370 VanDerWaalsContact OD1-N 3.15Å; Q370-Y372 HydrophobicContact CB-CD2 4.47Å; Q370-Y372 HydrophobicContact CB-CE2 3.73Å
371	W	94.3	Very high	89.9	Confident	6 Å²	6	43.9 Å²	43.9	2%	0.023	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	140.6	173.6	-74.4	93.9	0	0	0	112	L330 L344 F364 R381 V382 V387	L330-W371 HydrophobicContact CD2-CZ2 4.02Å; L344-W371 HydrophobicContact CB-CH2 4.19Å; L344-W371 HydrophobicContact CB-CZ2 4.46Å; L344-W371 HydrophobicContact CD2-CH2 3.74Å; L344-W371 HydrophobicContact CD2-CZ2 4.33Å; L344-W371 HydrophobicContact CD2-CZ3 4.5Å; L344-W371 HydrophobicContact CG-CH2 3.86Å; L344-W371 WeakPolarHBondContact O-CH2 3.28Å; L344-W371 WeakPolarHBondContact O-CZ2 3.39Å; F364-W371 HydrophobicContact CB-CD2 4.09Å; F364-W371 HydrophobicContact CB-CE3 4.1Å; F364-W371 HydrophobicContact CB-CH2 3.87Å; F364-W371 HydrophobicContact CB-CZ2 3.87Å; F364-W371 HydrophobicContact CB-CZ3 3.99Å; F364-W371 AromaticContact CD2-CD1 3.88Å; F364-W371 HydrophobicContact CD2-CD2 4.15Å; F364-W371 AromaticContact CD2-CE2 3.78Å; F364-W371 HydrophobicContact CD2-CG 4.22Å; F364-W371 HydrophobicContact CD2-CZ2 4.27Å; F364-W371 AromaticContact CD2-NE1 3.61Å; F364-W371 HydrophobicContact CG-CZ2 4.41Å; W371-R381 WeakPolarHBondContact O-CA 3.26Å; W371-V382 HydrophobicContact CB-CG2 3.75Å; W371-V382 PolarHBondContact O-N 3.34Å; W371-V387 HydrophobicContact CB-CG2 4.02Å; W371-V387 HydrophobicContact CD2-CB 4.45Å; W371-V387 HydrophobicContact CD2-CG1 4.24Å; W371-V387 HydrophobicContact CD2-CG2 3.8Å; W371-V387 HydrophobicContact CE3-CB 4.47Å; W371-V387 HydrophobicContact CE3-CG1 3.91Å; W371-V387 HydrophobicContact CE3-CG2 3.83Å; W371-V387 HydrophobicContact CG-CG2 3.9Å; W371-V387 HydrophobicContact CH2-CG1 4.12Å; W371-V387 HydrophobicContact CZ2-CG1 4.41Å; W371-V387 HydrophobicContact CZ3-CG1 3.84Å
372	Y	94.9	Very high	90	Very high	30 Å²	30	45 Å²	45	12%	0.118	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.5	175.9	-67.1	-95.1	0	0	0	110.4	L73 Y362 C363 N365 N368 Q370 V379 G380 R381	L73-Y372 HydrophobicContact CD1-CD1 4.23Å; L73-Y372 HydrophobicContact CD1-CE1 3.6Å; L73-Y372 HydrophobicContact CD1-CE2 4.08Å; L73-Y372 HydrophobicContact CD2-CD1 3.8Å; L73-Y372 HydrophobicContact CD2-CD2 3.54Å; L73-Y372 HydrophobicContact CD2-CE1 3.95Å; L73-Y372 HydrophobicContact CD2-CE2 3.68Å; L73-Y372 HydrophobicContact CD2-CG 3.6Å; L73-Y372 HydrophobicContact CG-CE1 4.43Å; Y362-Y372 CarbonylContact C-O 3.59Å; Y362-Y372 VanDerWaalsContact CA-O 3.27Å; Y362-Y372 WeakPolarHBondContact CA-O 3.37Å; C363-Y372 PolarHBondContact N-O 3.33Å; C363-Y372 PolarHBondContact O-N 3.49Å; N365-Y372 HydrophobicContact CB-CD2 3.92Å; N365-Y372 HydrophobicContact CB-CE2 3.89Å; N368-Y372 PolarHBondContact ND2-OH 2.93Å; Q370-Y372 HydrophobicContact CB-CD2 4.47Å; Q370-Y372 HydrophobicContact CB-CE2 3.73Å; Y372-V379 HydrophobicContact CD1-CG1 4.16Å; Y372-G380 CarbonylContact C-O 3.53Å; Y372-G380 WeakPolarHBondContact CA-O 3.17Å; Y372-R381 HydrophobicContact CD1-CB 4.06Å; Y372-R381 HydrophobicContact CE1-CB 3.82Å; Y372-R381 HydrophobicContact CE1-CG 4.38Å
373	S	97.5	Very high	90	Very high	23 Å²	23	48.5 Å²	48.5	16%	0.161	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	136.4	163.6	59.7	0	0	0	0	109.6	A361 V379 G380	A361-S373 CarbonylContact O-C 3.55Å; A361-S373 WeakPolarHBondContact O-CA 3.13Å; S373-V379 WeakPolarHBondContact O-CA 3.45Å; S373-G380 PolarHBondContact N-O 3.37Å; S373-G380 PolarHBondContact O-N 3.18Å; S373-G380 PolarHBondContact OG-O 2.94Å
374	F	93.6	Very high	89.9	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	93.5	174.5	-63.1	-96.3	0	0	0	107.5	G72 L73 Q90 A361 C363 V379	G72-F374 WeakPolarHBondContact O-CZ 3.09Å; L73-F374 HydrophobicContact CD2-CZ 4.14Å; Q90-F374 HydrophobicContact CB-CB 4.1Å; Q90-F374 HydrophobicContact CB-CG 4.15Å; Q90-F374 HydrophobicContact CG-CB 3.72Å; Q90-F374 HydrophobicContact CG-CD1 4.05Å; Q90-F374 HydrophobicContact CG-CG 3.96Å; A361-F374 HydrophobicContact CB-CB 4.38Å; A361-F374 PolarHBondContact N-O 2.86Å; A361-F374 PolarHBondContact O-N 3.46Å; C363-F374 HydrophobicContact CB-CD2 4.23Å; C363-F374 HydrophobicContact CB-CE2 3.78Å; F374-V379 HydrophobicContact CD1-CB 4.42Å; F374-V379 HydrophobicContact CD1-CG1 3.99Å; F374-V379 HydrophobicContact CD1-CG2 3.62Å; F374-V379 HydrophobicContact CE1-CG1 3.78Å; F374-V379 HydrophobicContact CE1-CG2 3.94Å; F374-V379 HydrophobicContact CZ-CG1 4.2Å
375	D	95.5	Very high	90.2	Very high	55 Å²	55	56.5 Å²	56.5	29%	0.294	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	84.7	175.3	-174.7	-10.6	0	0	0	108	H358 I360 E377 V378	H358-D375 IonicContact CD2-OD1 3.52Å; H358-D375 IonicContact CE1-OD1 3.59Å; H358-D375 PolarHBondContact CE1-OD1 3.47Å; H358-D375 IonicContact NE2-OD1 2.81Å; H358-D375 PolarHBondContact NE2-OD1 3.08Å; H358-D375 IonicContact NE2-OD2 3.32Å; I360-D375 HydrophobicContact CD1-CB 4.36Å; I360-D375 HydrophobicContact CG1-CB 4.23Å; I360-D375 HydrophobicContact CG2-CB 4.34Å; D375-E377 PolarHBondContact O-N 3.49Å; D375-E377 VanDerWaalsContact O-N 3.08Å; D375-V378 HydrophobicContact CB-CB 4.46Å; D375-V378 PolarHBondContact N-O 2.72Å; D375-V378 WeakPolarHBondContact O-CB 3.23Å; D375-V378 PolarHBondContact O-N 2.81Å
376	D	90.6	Very high	90.8	Very high	16 Å²	16	59.3 Å²	59.3	9%	0.086	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	-114.9	-171.4	-68.6	-43.3	0	0	0	111.8	G75 L76 N78 C83 N86 H358 V378	G75-D376 CarbonylContact C-O 3.6Å; G75-D376 WeakPolarHBondContact CA-O 3.23Å; L76-D376 PolarHBondContact N-O 3.47Å; L76-D376 CarbonylContact O-C 3.51Å; L76-D376 WeakPolarHBondContact O-CA 3.42Å; L76-D376 WeakPolarHBondContact O-CB 3.33Å; N78-D376 HydrophobicContact CB-CB 4.14Å; N78-D376 VanDerWaalsContact CB-OD2 3.28Å; N78-D376 WeakPolarHBondContact CB-OD2 3.32Å; N78-D376 PolarHBondContact ND2-OD2 3.49Å; C83-D376 WeakPolarHBondContact CA-OD1 3.22Å; C83-D376 WeakPolarHBondContact CB-OD1 3.41Å; N86-D376 PolarHBondContact ND2-OD1 3.08Å; H358-D376 IonicContact CE1-OD2 3.49Å; H358-D376 PolarHBondContact CE1-OD2 3.29Å; H358-D376 VanDerWaalsContact CE1-OD2 3.32Å; D376-V378 VanDerWaalsContact C-N 3.28Å; D376-V378 PolarHBondContact O-N 2.85Å
377	E	89.9	Confident	91.7	Very high	129 Å²	129	56.4 Å²	56.4	60%	0.603	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.8	-179.3	62.8	-173	-177	0	0	113.4	L76 D375	L76-E377 PolarHBondContact O-N 3.05Å; L76-E377 VanDerWaalsContact O-N 3.14Å; D375-E377 PolarHBondContact O-N 3.49Å; D375-E377 VanDerWaalsContact O-N 3.08Å
378	V	93.7	Very high	92.8	Very high	92 Å²	92	57.8 Å²	57.8	56%	0.558	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	117.3	-177.1	-176.1	0	0	0	0	109.5	D375 D376	D375-V378 HydrophobicContact CB-CB 4.46Å; D375-V378 PolarHBondContact N-O 2.72Å; D375-V378 WeakPolarHBondContact O-CB 3.23Å; D375-V378 PolarHBondContact O-N 2.81Å; D376-V378 VanDerWaalsContact C-N 3.28Å; D376-V378 PolarHBondContact O-N 2.85Å
379	V	93.2	Very high	93.7	Very high	44 Å²	44	59.5 Å²	59.5	27%	0.267	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.9	174.3	-174.6	0	0	0	0	109	L73 G75 Y372 S373 F374	L73-V379 HydrophobicContact CB-CG1 4.4Å; G75-V379 VanDerWaalsContact N-CG2 3.33Å; Y372-V379 HydrophobicContact CD1-CG1 4.16Å; S373-V379 WeakPolarHBondContact O-CA 3.45Å; F374-V379 HydrophobicContact CD1-CB 4.42Å; F374-V379 HydrophobicContact CD1-CG1 3.99Å; F374-V379 HydrophobicContact CD1-CG2 3.62Å; F374-V379 HydrophobicContact CE1-CG1 3.78Å; F374-V379 HydrophobicContact CE1-CG2 3.94Å; F374-V379 HydrophobicContact CZ-CG1 4.2Å
380	G	94.7	Very high	94.4	Very high	25 Å²	25	58.4 Å²	58.4	26%	0.258	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.8	-178	0	0	0	0	0	111.9	Y372 S373	Y372-G380 CarbonylContact C-O 3.53Å; Y372-G380 WeakPolarHBondContact CA-O 3.17Å; S373-G380 PolarHBondContact N-O 3.37Å; S373-G380 PolarHBondContact O-N 3.18Å; S373-G380 PolarHBondContact OG-O 2.94Å
381	R	96.2	Very high	94.6	Very high	169 Å²	169	57.4 Å²	57.4	64%	0.638	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	137	172.2	-176.9	179.6	174.6	-158.9	-3.5	109.5	W371 Y372	W371-R381 WeakPolarHBondContact O-CA 3.26Å; Y372-R381 HydrophobicContact CD1-CB 4.06Å; Y372-R381 HydrophobicContact CE1-CB 3.82Å; Y372-R381 HydrophobicContact CE1-CG 4.38Å
382	V	97	Very high	94.6	Very high	24 Å²	24	57.1 Å²	57.1	15%	0.145	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	153.7	177.7	-63.5	0	0	0	0	111	Y362 W371 V386 V387	Y362-V382 HydrophobicContact CD1-CG2 4.12Å; Y362-V382 HydrophobicContact CE1-CG1 4.49Å; W371-V382 HydrophobicContact CB-CG2 3.75Å; W371-V382 PolarHBondContact O-N 3.34Å; V382-V386 HydrophobicContact CB-CB 4.39Å; V382-V387 HydrophobicContact CG2-CG2 3.84Å
383	D	96.2	Very high	94.5	Very high	105 Å²	105	56.1 Å²	56.1	56%	0.561	29%	0.287	S	S	*	.			trans	-74.2	143.1	171.6	-169.4	-87.3	0	0	0	110.2	Y385 V386	D383-Y385 PolarHBondContact O-N 3.31Å; D383-Y385 VanDerWaalsContact O-N 3.11Å; D383-Y385 WeakPolarHBondContact OD1-CB 3.41Å; D383-Y385 PolarHBondContact OD1-N 2.78Å; D383-V386 HydrophobicContact CB-CG2 4.44Å; D383-V386 WeakPolarHBondContact O-CB 3.19Å; D383-V386 PolarHBondContact O-N 3.25Å
384	P	94.4	Very high	94.3	Very high	51 Å²	51	55.1 Å²	55.1	33%	0.331	28%	0.28	S	S	.	.	H	α-helix	trans	-48.9	-34.7	173.7	-26.6	32.4	0	0	0	113.8	L330 V386 V387 E388	L330-P384 HydrophobicContact CD1-CB 3.6Å; P384-V386 VanDerWaalsContact C-N 3.26Å; P384-V386 PolarHBondContact O-N 3.25Å; P384-V387 WeakPolarHBondContact O-CA 3.45Å; P384-V387 WeakPolarHBondContact O-CB 3.43Å; P384-V387 PolarHBondContact O-N 2.74Å; P384-E388 PolarHBondContact O-N 3.3Å
385	Y	95.3	Very high	94.3	Very high	153 Å²	153	55 Å²	55	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-58.6	-36.2	176.5	178.9	-100.2	0	0	0	112.8	D383 V387 N389	D383-Y385 PolarHBondContact O-N 3.31Å; D383-Y385 VanDerWaalsContact O-N 3.11Å; D383-Y385 WeakPolarHBondContact OD1-CB 3.41Å; D383-Y385 PolarHBondContact OD1-N 2.78Å; Y385-V387 VanDerWaalsContact C-N 3.33Å; Y385-N389 WeakPolarHBondContact CE2-ND2 3.23Å; Y385-N389 PolarHBondContact O-N 2.9Å; Y385-N389 PolarHBondContact O-ND2 3.47Å
386	V	96.4	Very high	94.1	Very high	63 Å²	63	52.5 Å²	52.5	38%	0.382	27%	0.266	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175.5	178.8	0	0	0	0	109.6	Y362 V382 D383 P384 E388 N389 V390	Y362-V386 HydrophobicContact CE1-CG1 4.3Å; V382-V386 HydrophobicContact CB-CB 4.39Å; D383-V386 HydrophobicContact CB-CG2 4.44Å; D383-V386 WeakPolarHBondContact O-CB 3.19Å; D383-V386 PolarHBondContact O-N 3.25Å; P384-V386 VanDerWaalsContact C-N 3.26Å; P384-V386 PolarHBondContact O-N 3.25Å; V386-E388 PolarHBondContact O-N 2.99Å; V386-N389 PolarHBondContact O-N 3.13Å; V386-N389 VanDerWaalsContact O-N 3.16Å; V386-V390 VanDerWaalsContact O-CG1 3.23Å; V386-V390 WeakPolarHBondContact O-CG1 3.32Å; V386-V390 PolarHBondContact O-N 3Å
387	V	96.9	Very high	94.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-42.9	-178.6	-173.4	0	0	0	0	111	F328 L330 L344 V347 Y362 W371 V382 P384 Y385 N389 V390	F328-V387 WeakPolarHBondContact CZ-O 3.3Å; L330-V387 HydrophobicContact CD2-CB 4.25Å; L330-V387 HydrophobicContact CD2-CG1 3.84Å; L344-V387 HydrophobicContact CD2-CG1 4.12Å; V347-V387 HydrophobicContact CG1-CG1 3.59Å; Y362-V387 HydrophobicContact CD1-CG2 4.4Å; W371-V387 HydrophobicContact CB-CG2 4.02Å; W371-V387 HydrophobicContact CD2-CB 4.45Å; W371-V387 HydrophobicContact CD2-CG1 4.24Å; W371-V387 HydrophobicContact CD2-CG2 3.8Å; W371-V387 HydrophobicContact CE3-CB 4.47Å; W371-V387 HydrophobicContact CE3-CG1 3.91Å; W371-V387 HydrophobicContact CE3-CG2 3.83Å; W371-V387 HydrophobicContact CG-CG2 3.9Å; W371-V387 HydrophobicContact CH2-CG1 4.12Å; W371-V387 HydrophobicContact CZ2-CG1 4.41Å; W371-V387 HydrophobicContact CZ3-CG1 3.84Å; V382-V387 HydrophobicContact CG2-CG2 3.84Å; P384-V387 WeakPolarHBondContact O-CA 3.45Å; P384-V387 WeakPolarHBondContact O-CB 3.43Å; P384-V387 PolarHBondContact O-N 2.74Å; Y385-V387 VanDerWaalsContact C-N 3.33Å; V387-N389 PolarHBondContact O-N 3.02Å; V387-V390 WeakPolarHBondContact O-CG2 3.45Å; V387-V390 PolarHBondContact O-N 3.28Å
388	E	94.3	Very high	94.1	Very high	84 Å²	84	46.4 Å²	46.4	39%	0.393	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-23.3	177.2	-72.1	177.1	164.7	0	0	113.8	L330 P384 V386	L330-E388 HydrophobicContact CD1-CG 3.68Å; L330-E388 WeakPolarHBondContact CD1-OE1 3.45Å; L330-E388 HydrophobicContact CD2-CG 3.91Å; L330-E388 HydrophobicContact CG-CG 3.5Å; L330-E388 WeakPolarHBondContact CG-OE1 3.46Å; P384-E388 PolarHBondContact O-N 3.3Å; V386-E388 PolarHBondContact O-N 2.99Å
389	N	94.3	Very high	93.6	Very high	82 Å²	82	43.8 Å²	43.8	44%	0.439	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	9.8	-173.7	-71.1	-77.8	0	0	0	113.7	M325 Y385 V386 V387	M325-N389 WeakPolarHBondContact CE-O 3.43Å; Y385-N389 WeakPolarHBondContact CE2-ND2 3.23Å; Y385-N389 PolarHBondContact O-N 2.9Å; Y385-N389 PolarHBondContact O-ND2 3.47Å; V386-N389 PolarHBondContact O-N 3.13Å; V386-N389 VanDerWaalsContact O-N 3.16Å; V387-N389 PolarHBondContact O-N 3.02Å
390	V	95.1	Very high	92.8	Very high	12 Å²	12	44.9 Å²	44.9	7%	0.073	23%	0.225	C	C	.	.	S	Bend	trans	-76.9	153	173.3	-52.6	0	0	0	0	111.9	F328 V347 Y362 V386 V387 A392	F328-V390 HydrophobicContact CZ-CG2 4.05Å; V347-V390 HydrophobicContact CG1-CG2 3.93Å; V347-V390 HydrophobicContact CG2-CG2 3.9Å; Y362-V390 HydrophobicContact CD2-CG1 4.08Å; Y362-V390 HydrophobicContact CD2-CG2 4.46Å; Y362-V390 HydrophobicContact CE1-CG1 4.17Å; Y362-V390 HydrophobicContact CE2-CB 4.32Å; Y362-V390 HydrophobicContact CE2-CG1 3.66Å; V386-V390 VanDerWaalsContact O-CG1 3.23Å; V386-V390 WeakPolarHBondContact O-CG1 3.32Å; V386-V390 PolarHBondContact O-N 3Å; V387-V390 WeakPolarHBondContact O-CG2 3.45Å; V387-V390 PolarHBondContact O-N 3.28Å; V390-A392 VanDerWaalsContact C-N 3.28Å; V390-A392 PolarHBondContact O-N 3.37Å
391	Q	93.2	Very high	91.3	Very high	39 Å²	39	46.4 Å²	46.4	18%	0.182	23%	0.231	C	C	.	.			trans	-74.9	85.3	170.6	-172.9	176.9	83.5	0	0	109	G323 M325 S349 H350 Y393	G323-Q391 PolarHBondContact O-NE2 3.36Å; M325-Q391 HydrophobicContact SD-CB 3.96Å; M325-Q391 HydrophobicContact SD-CG 4.28Å; S349-Q391 WeakPolarHBondContact CA-O 3.42Å; S349-Q391 WeakPolarHBondContact CB-O 3.1Å; S349-Q391 PolarHBondContact OG-O 3.15Å; H350-Q391 PolarHBondContact O-OE1 2.96Å; Q391-Y393 PolarHBondContact O-N 2.74Å
392	A	93.8	Very high	89.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	129.4	-175.6	0	0	0	0	0	111.8	R311 F328 V347 V390 L395	R311-A392 VanDerWaalsContact CZ-O 3.23Å; R311-A392 PolarHBondContact NE-O 3.47Å; R311-A392 PolarHBondContact NH2-O 2.95Å; F328-A392 HydrophobicContact CD1-CB 3.82Å; F328-A392 HydrophobicContact CE1-CB 3.38Å; F328-A392 HydrophobicContact CZ-CB 3.93Å; V347-A392 HydrophobicContact CG2-CB 3.59Å; V390-A392 VanDerWaalsContact C-N 3.28Å; V390-A392 PolarHBondContact O-N 3.37Å; A392-L395 HydrophobicContact CB-CD1 4.06Å; A392-L395 HydrophobicContact CB-CD2 4.02Å; A392-L395 HydrophobicContact CB-CG 4.06Å
393	Y	92.4	Very high	87	Confident	9 Å²	9	44.3 Å²	44.3	4%	0.035	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	-45	176.6	175.7	-130.5	0	0	0	111.7	V147 H308 V309 R311 F312 I348 Y359 Q391	V147-Y393 HydrophobicContact CB-CE1 3.55Å; V147-Y393 HydrophobicContact CG1-CD1 4.41Å; V147-Y393 HydrophobicContact CG1-CE1 3.81Å; V147-Y393 HydrophobicContact CG2-CE1 3.67Å; H308-Y393 AromaticContact CD2-CE2 3.47Å; H308-Y393 VanDerWaalsContact CD2-CE2 3.47Å; H308-Y393 WeakPolarHBondContact CD2-CE2 3.33Å; H308-Y393 AromaticContact CD2-CZ 3.9Å; H308-Y393 AromaticContact NE2-CE2 3.32Å; H308-Y393 VanDerWaalsContact NE2-CE2 3.32Å; H308-Y393 WeakPolarHBondContact NE2-CE2 3.26Å; H308-Y393 AromaticContact NE2-CZ 3.74Å; V309-Y393 PolarHBondContact N-O 3.4Å; V309-Y393 WeakPolarHBondContact O-CD2 3.32Å; V309-Y393 WeakPolarHBondContact O-CE2 3.42Å; R311-Y393 HydrophobicContact CB-CD2 4.38Å; R311-Y393 HydrophobicContact CG-CD2 4.38Å; F312-Y393 AromaticContact CD2-CE2 3.93Å; F312-Y393 HydrophobicContact CD2-CE2 3.93Å; F312-Y393 HydrophobicContact CE2-CD2 4.25Å; F312-Y393 HydrophobicContact CE2-CE1 4.34Å; F312-Y393 AromaticContact CE2-CE2 3.71Å; F312-Y393 HydrophobicContact CE2-CE2 3.71Å; F312-Y393 AromaticContact CE2-CZ 3.77Å; I348-Y393 WeakPolarHBondContact O-CA 3.24Å; I348-Y393 WeakPolarHBondContact O-CB 3.35Å; I348-Y393 PolarHBondContact O-N 3.06Å; Y359-Y393 HydrophobicContact CD1-CD1 4.25Å; Y359-Y393 AromaticContact CE1-CD1 3.61Å; Y359-Y393 HydrophobicContact CE1-CD1 3.61Å; Y359-Y393 AromaticContact CE1-CE1 3.63Å; Y359-Y393 HydrophobicContact CE1-CE1 3.63Å; Q391-Y393 PolarHBondContact O-N 2.74Å
394	I	93.1	Very high	84.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.4	170.3	-58.9	175.1	0	0	0	108.4	V147 I151 L307 V347 I348 F396	V147-I394 HydrophobicContact CB-CD1 4.28Å; V147-I394 HydrophobicContact CG1-CD1 3.37Å; I151-I394 HydrophobicContact CD1-CD1 4.19Å; I151-I394 HydrophobicContact CD1-CG2 4.43Å; L307-I394 CarbonylContact O-C 3.5Å; L307-I394 VanDerWaalsContact O-CA 3.26Å; L307-I394 WeakPolarHBondContact O-CA 3.46Å; V347-I394 CarbonylContact C-O 3.51Å; V347-I394 WeakPolarHBondContact CA-O 3.36Å; I348-I394 HydrophobicContact CB-CB 4.2Å; I348-I394 HydrophobicContact CD1-CB 4.32Å; I348-I394 HydrophobicContact CD1-CD1 4.43Å; I348-I394 PolarHBondContact N-O 3.12Å; I348-I394 PolarHBondContact O-N 3.19Å; I394-F396 HydrophobicContact CB-CE2 4.48Å; I394-F396 HydrophobicContact CG2-CD2 4.1Å; I394-F396 HydrophobicContact CG2-CE2 3.49Å; I394-F396 VanDerWaalsContact CG2-CE2 3.49Å; I394-F396 HydrophobicContact CG2-CZ 3.95Å
395	L	94.3	Very high	82.5	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.4	177.3	-53	97.7	0	0	0	109.5	L307 V309 F328 L344 V347 A392 Y397	L307-L395 HydrophobicContact CB-CB 4.3Å; L307-L395 HydrophobicContact CB-CD1 4.3Å; L307-L395 PolarHBondContact N-O 3.26Å; L307-L395 PolarHBondContact O-N 2.97Å; V309-L395 HydrophobicContact CG2-CD1 3.82Å; F328-L395 HydrophobicContact CB-CD2 3.73Å; F328-L395 HydrophobicContact CD1-CD2 3.85Å; F328-L395 HydrophobicContact CD2-CD2 3.53Å; F328-L395 HydrophobicContact CE1-CD2 4.41Å; F328-L395 HydrophobicContact CE2-CD2 4.09Å; F328-L395 HydrophobicContact CG-CD2 3.39Å; F328-L395 HydrophobicContact CZ-CD2 4.49Å; L344-L395 HydrophobicContact CD1-CB 3.88Å; L344-L395 HydrophobicContact CD1-CD2 4.04Å; L344-L395 HydrophobicContact CD1-CG 4.47Å; V347-L395 HydrophobicContact CG2-CD2 4.44Å; V347-L395 HydrophobicContact CG2-CG 4.23Å; A392-L395 HydrophobicContact CB-CD1 4.06Å; A392-L395 HydrophobicContact CB-CD2 4.02Å; A392-L395 HydrophobicContact CB-CG 4.06Å; L395-Y397 HydrophobicContact CB-CD2 4.02Å; L395-Y397 HydrophobicContact CB-CE2 3.77Å; L395-Y397 HydrophobicContact CD2-CE2 3.93Å; L395-Y397 HydrophobicContact CG-CE2 4.45Å
396	F	92	Very high	80.3	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.013	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.2	172.7	-66.5	-97.2	0	0	0	108.1	A91 L92 F192 V304 C306 I345 A346 I348 I394	A91-F396 HydrophobicContact CB-CD2 3.8Å; A91-F396 HydrophobicContact CB-CE2 3.51Å; A91-F396 HydrophobicContact CB-CZ 4.15Å; L92-F396 HydrophobicContact CD2-CE1 3.8Å; L92-F396 HydrophobicContact CD2-CZ 4.22Å; F192-F396 HydrophobicContact CE1-CD1 4.33Å; F192-F396 HydrophobicContact CE1-CE1 4.33Å; V304-F396 HydrophobicContact CG1-CB 4.3Å; V304-F396 HydrophobicContact CG1-CD1 4.09Å; C306-F396 HydrophobicContact CB-CD1 4.34Å; C306-F396 HydrophobicContact CB-CE1 4.25Å; C306-F396 VanDerWaalsContact SG-CE1 3.6Å; I345-F396 HydrophobicContact CD1-CB 4.19Å; I345-F396 HydrophobicContact CG1-CB 3.8Å; I345-F396 WeakPolarHBondContact CG1-O 3.23Å; I345-F396 PolarHBondContact N-O 2.99Å; A346-F396 HydrophobicContact CB-CB 4.15Å; A346-F396 HydrophobicContact CB-CD2 4.08Å; A346-F396 HydrophobicContact CB-CG 4.43Å; A346-F396 PolarHBondContact N-O 3.28Å; A346-F396 PolarHBondContact O-N 2.89Å; I348-F396 HydrophobicContact CD1-CE2 4.12Å; I394-F396 HydrophobicContact CB-CE2 4.48Å; I394-F396 HydrophobicContact CG2-CD2 4.1Å; I394-F396 HydrophobicContact CG2-CE2 3.49Å; I394-F396 VanDerWaalsContact CG2-CE2 3.49Å; I394-F396 HydrophobicContact CG2-CZ 3.95Å
397	Y	92	Very high	78	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.4	-178.9	-88.3	-79.3	0	0	0	109.7	L260 V304 L305 L307 P329 L333 D343 L344 L395	L260-Y397 HydrophobicContact CD2-CE2 3.88Å; V304-Y397 CarbonylContact C-O 3.57Å; V304-Y397 WeakPolarHBondContact CA-O 3.3Å; L305-Y397 PolarHBondContact N-O 3.29Å; L305-Y397 PolarHBondContact O-N 3.39Å; L307-Y397 HydrophobicContact CD1-CD2 3.79Å; L307-Y397 HydrophobicContact CD1-CE2 4Å; L307-Y397 HydrophobicContact CG-CD2 4.46Å; P329-Y397 VanDerWaalsContact O-CE1 3.31Å; P329-Y397 WeakPolarHBondContact O-CE1 3.29Å; P329-Y397 PolarHBondContact O-OH 2.93Å; L333-Y397 HydrophobicContact CB-CD1 3.91Å; L333-Y397 HydrophobicContact CB-CE1 3.69Å; L333-Y397 HydrophobicContact CD2-CD1 3.82Å; L333-Y397 HydrophobicContact CD2-CD2 3.73Å; L333-Y397 HydrophobicContact CD2-CE1 3.85Å; L333-Y397 HydrophobicContact CD2-CE2 3.74Å; L333-Y397 HydrophobicContact CD2-CG 3.76Å; L333-Y397 HydrophobicContact CG-CE1 4.36Å; D343-Y397 CarbonylContact O-C 3.44Å; D343-Y397 WeakPolarHBondContact O-CA 3.07Å; L344-Y397 HydrophobicContact CB-CD1 4.21Å; L344-Y397 HydrophobicContact CB-CE1 3.74Å; L344-Y397 HydrophobicContact CD1-CD1 4.39Å; L344-Y397 HydrophobicContact CD1-CD2 3.97Å; L344-Y397 HydrophobicContact CD1-CE1 4.01Å; L344-Y397 HydrophobicContact CD1-CE2 3.57Å; L344-Y397 HydrophobicContact CD1-CG 4.36Å; L344-Y397 HydrophobicContact CG-CE1 4.5Å; L395-Y397 HydrophobicContact CB-CD2 4.02Å; L395-Y397 HydrophobicContact CB-CE2 3.77Å; L395-Y397 HydrophobicContact CD2-CE2 3.93Å; L395-Y397 HydrophobicContact CG-CE2 4.45Å
398	Q	87.5	Confident	75.4	Confident	17 Å²	17	47.3 Å²	47.3	8%	0.079	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.5	177.7	174.1	162.7	77.7	0	0	110.8	S303 Y342 D343 I345 H366 T400 L403	S303-Q398 VanDerWaalsContact O-CA 3.22Å; S303-Q398 WeakPolarHBondContact O-CA 3.44Å; Y342-Q398 CarbonylContact C-O 3.54Å; Y342-Q398 WeakPolarHBondContact CA-O 3.19Å; Y342-Q398 WeakPolarHBondContact CB-O 3.34Å; Y342-Q398 VanDerWaalsContact CD1-C 3.47Å; D343-Q398 PolarHBondContact N-O 3.49Å; D343-Q398 PolarHBondContact O-N 2.65Å; I345-Q398 HydrophobicContact CD1-CB 4.26Å; I345-Q398 HydrophobicContact CG1-CB 4.35Å; I345-Q398 HydrophobicContact CG2-CB 3.54Å; I345-Q398 HydrophobicContact CG2-CG 4.48Å; H366-Q398 PolarHBondContact CE1-OE1 2.71Å; Q398-T400 PolarHBondContact O-N 3.32Å; Q398-L403 HydrophobicContact CG-CD1 4.23Å; Q398-L403 HydrophobicContact CG-CD2 3.85Å
399	K	84.2	Confident	73.1	Confident	37 Å²	37	48.3 Å²	48.3	16%	0.161	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	128.6	178.9	-174	173.8	172.2	175.5	0	111.1	E301 S303 T340 Y342 S401	E301-K399 PolarHBondContact O-NZ 3.17Å; S303-K399 PolarHBondContact O-N 3.27Å; T340-K399 HydrophobicContact CG2-CD 4.43Å; T340-K399 VanDerWaalsContact CG2-CE 3.4Å; Y342-K399 VanDerWaalsContact CD1-CA 3.47Å; Y342-K399 HydrophobicContact CD1-CB 3.97Å; Y342-K399 VanDerWaalsContact CD1-N 3.26Å; Y342-K399 HydrophobicContact CE1-CB 3.62Å; Y342-K399 HydrophobicContact CE1-CG 4.29Å; K399-S401 VanDerWaalsContact C-N 3.27Å; K399-S401 PolarHBondContact O-N 3.41Å
400	T	74.9	Confident	71	Confident	67 Å²	67	45.2 Å²	45.2	41%	0.411	24%	0.235	S	C	.	.			trans	-78.6	74.3	174.6	-43.5	0	0	0	0	109.1	T341 D343 Q398	T341-T400 PolarHBondContact O-N 2.96Å; T341-T400 PolarHBondContact O-OG1 2.9Å; T341-T400 WeakPolarHBondContact OG1-CB 3.41Å; D343-T400 PolarHBondContact OD1-OG1 2.05Å; D343-T400 WeakPolarHBondContact OD2-CG2 3.42Å; D343-T400 PolarHBondContact OD2-OG1 3.15Å; Q398-T400 PolarHBondContact O-N 3.32Å
401	S	64.1	Low	68.6	Low	57 Å²	57	45.9 Å²	45.9	40%	0.399	24%	0.242	S	C	.	.	S	Bend	trans	-130.2	172.7	167.6	64.6	0	0	0	0	109.4	K399 L403	K399-S401 VanDerWaalsContact C-N 3.27Å; K399-S401 PolarHBondContact O-N 3.41Å; S401-L403 WeakPolarHBondContact O-CB 3.49Å; S401-L403 PolarHBondContact O-N 3.33Å
402	N	53.1	Low	65.9	Low	121 Å²	121	45.7 Å²	45.7	65%	0.647	25%	0.251	S	S	*	.			trans	-67.3	62.5	-174.6	-72.4	-28.5	0	0	0	113.2	M404 D405	N402-M404 VanDerWaalsContact C-N 3.26Å; N402-M404 PolarHBondContact O-N 3.39Å; N402-D405 PolarHBondContact O-N 2.68Å
403	L	50.4	Low	63.9	Low	27 Å²	27	52.9 Å²	52.9	14%	0.141	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-14.3	-153.2	-164.7	87.5	0	0	0	115.7	V302 Q398 S401 L407	V302-L403 WeakPolarHBondContact O-CD1 3.32Å; Q398-L403 HydrophobicContact CG-CD1 4.23Å; Q398-L403 HydrophobicContact CG-CD2 3.85Å; S401-L403 WeakPolarHBondContact O-CB 3.49Å; S401-L403 PolarHBondContact O-N 3.33Å; L403-L407 HydrophobicContact CD2-CD1 4.28Å; L403-L407 HydrophobicContact CG-CD1 4Å; L403-L407 VanDerWaalsContact O-CD1 3.29Å; L403-L407 WeakPolarHBondContact O-CD1 3.41Å; L403-L407 WeakPolarHBondContact O-CG 3.36Å
404	M	48.7	Very low	61.8	Low	113 Å²	113	54.6 Å²	54.6	56%	0.557	29%	0.287	S	S	*	.	H	α-helix	trans	-80.3	-26.1	178	-71.8	-149.4	-69.6	0	0	113.8	N402 R408	N402-M404 VanDerWaalsContact C-N 3.26Å; N402-M404 PolarHBondContact O-N 3.39Å; M404-R408 WeakPolarHBondContact O-CB 3.44Å; M404-R408 WeakPolarHBondContact O-CD 3.31Å; M404-R408 WeakPolarHBondContact O-CG 3.15Å; M404-R408 PolarHBondContact O-N 3.37Å; M404-R408 VanDerWaalsContact O-N 3.1Å
405	D	46	Very low	59.5	Low	92 Å²	92	60.2 Å²	60.2	49%	0.492	31%	0.309	S	S	.	.	H	α-helix	trans	-82.5	-39.4	-172.1	-67.1	-25.8	0	0	0	112.5	N402 R408 L409	N402-D405 PolarHBondContact O-N 2.68Å; D405-R408 IonicContact OD1-NH1 2.97Å; D405-L409 WeakPolarHBondContact O-CB 3.41Å; D405-L409 WeakPolarHBondContact O-CD1 3.48Å; D405-L409 WeakPolarHBondContact O-CG 3.42Å; D405-L409 PolarHBondContact O-N 3.09Å
406	S	49.1	Very low	57.2	Low	45 Å²	45	65.8 Å²	65.8	32%	0.315	34%	0.335	S	S	.	.	H	α-helix	trans	-66.8	-40.5	174.1	51.5	0	0	0	0	111.9	L409 S410	S406-L409 PolarHBondContact O-N 2.87Å; S406-S410 PolarHBondContact O-N 3.23Å; S406-S410 PolarHBondContact O-OG 3.07Å
407	L	48.4	Very low	55.3	Low	29 Å²	29	71.4 Å²	71.4	15%	0.152	36%	0.361	C	S	.	.	H	α-helix	trans	-68	-37.8	177.2	-72.8	171.7	0	0	0	112.5	P97 V302 L403 L409 A411	P97-L407 HydrophobicContact CB-CD1 3.94Å; P97-L407 HydrophobicContact CB-CD2 3.72Å; P97-L407 HydrophobicContact CG-CD1 3.96Å; P97-L407 HydrophobicContact CG-CD2 4.43Å; V302-L407 HydrophobicContact CG1-CD2 4.02Å; L403-L407 HydrophobicContact CD2-CD1 4.28Å; L403-L407 HydrophobicContact CG-CD1 4Å; L403-L407 VanDerWaalsContact O-CD1 3.29Å; L403-L407 WeakPolarHBondContact O-CD1 3.41Å; L403-L407 WeakPolarHBondContact O-CG 3.36Å; L407-L409 VanDerWaalsContact C-N 3.33Å; L407-A411 WeakPolarHBondContact O-CB 3.42Å; L407-A411 PolarHBondContact O-N 3.45Å
408	R	42.8	Very low	53	Low	156 Å²	156	73.8 Å²	73.8	59%	0.589	37%	0.372	S	S	*	.	H	α-helix	trans	-62.4	-39.9	171.1	-77.9	169.9	179.4	159.9	-2.6	112	M404 D405 G412	M404-R408 WeakPolarHBondContact O-CB 3.44Å; M404-R408 WeakPolarHBondContact O-CD 3.31Å; M404-R408 WeakPolarHBondContact O-CG 3.15Å; M404-R408 PolarHBondContact O-N 3.37Å; M404-R408 VanDerWaalsContact O-N 3.1Å; D405-R408 IonicContact OD1-NH1 2.97Å; R408-G412 WeakPolarHBondContact O-CA 3.44Å; R408-G412 PolarHBondContact O-N 3.39Å
409	L	45.5	Very low	51	Low	105 Å²	105	75.5 Å²	75.5	55%	0.55	38%	0.383	S	S	.	.	H	α-helix	trans	-72.1	-40	179	-80.7	160	0	0	0	113.1	D405 S406 L407 R413	D405-L409 WeakPolarHBondContact O-CB 3.41Å; D405-L409 WeakPolarHBondContact O-CD1 3.48Å; D405-L409 WeakPolarHBondContact O-CG 3.42Å; D405-L409 PolarHBondContact O-N 3.09Å; S406-L409 PolarHBondContact O-N 2.87Å; L407-L409 VanDerWaalsContact C-N 3.33Å; L409-R413 WeakPolarHBondContact O-CB 3.37Å; L409-R413 WeakPolarHBondContact O-CG 3.16Å; L409-R413 PolarHBondContact O-N 3.3Å; L409-R413 VanDerWaalsContact O-N 3.09Å; L409-R413 PolarHBondContact O-NE 2.84Å
410	S	50.5	Low	49.3	Very low	17 Å²	17	79.8 Å²	79.8	12%	0.119	40%	0.402	C	S	.	.	H	α-helix	trans	-71.4	-45.3	175.2	-67	0	0	0	0	111.1	E190 S406 G412 R413 L414	E190-S410 VanDerWaalsContact OE1-CB 3.3Å; E190-S410 WeakPolarHBondContact OE1-CB 3.37Å; E190-S410 PolarHBondContact OE1-OG 3.1Å; S406-S410 PolarHBondContact O-N 3.23Å; S406-S410 PolarHBondContact O-OG 3.07Å; S410-G412 PolarHBondContact O-N 3.35Å; S410-R413 PolarHBondContact O-N 2.83Å; S410-L414 WeakPolarHBondContact O-CB 3.36Å; S410-L414 VanDerWaalsContact O-CG 3.26Å; S410-L414 WeakPolarHBondContact O-CG 3.42Å; S410-L414 PolarHBondContact O-N 3.46Å
411	A	44.4	Very low	48	Very low	26 Å²	26	80.7 Å²	80.7	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-63.9	-38.5	175.8	0	0	0	0	0	112.5	L407 Y415	L407-A411 WeakPolarHBondContact O-CB 3.42Å; L407-A411 PolarHBondContact O-N 3.45Å; A411-Y415 VanDerWaalsContact O-CB 3.31Å; A411-Y415 WeakPolarHBondContact O-CB 3.02Å; A411-Y415 PolarHBondContact O-N 2.88Å
412	G	37.4	Very low	46.9	Very low	36 Å²	36	79.4 Å²	79.4	37%	0.371	39%	0.391	S	S	.	.	H	α-helix	trans	-65	-44.3	175.4	0	0	0	0	0	113	R408 S410 Y415 E416	R408-G412 WeakPolarHBondContact O-CA 3.44Å; R408-G412 PolarHBondContact O-N 3.39Å; S410-G412 PolarHBondContact O-N 3.35Å; G412-Y415 PolarHBondContact O-N 3.49Å; G412-E416 PolarHBondContact O-N 2.86Å
413	R	50.9	Low	46.6	Very low	151 Å²	151	74.8 Å²	74.8	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-63.8	-44.9	175.4	-79.9	-176.6	-79.5	-161.3	2.3	112.3	L409 S410 Y415 E416 E417	L409-R413 WeakPolarHBondContact O-CB 3.37Å; L409-R413 WeakPolarHBondContact O-CG 3.16Å; L409-R413 PolarHBondContact O-N 3.3Å; L409-R413 VanDerWaalsContact O-N 3.09Å; L409-R413 PolarHBondContact O-NE 2.84Å; S410-R413 PolarHBondContact O-N 2.83Å; R413-Y415 VanDerWaalsContact C-N 3.29Å; R413-Y415 PolarHBondContact O-N 3.38Å; R413-E416 PolarHBondContact O-N 3.29Å; R413-E417 PolarHBondContact O-N 3.49Å
414	L	48.3	Very low	46.4	Very low	46 Å²	46	78.1 Å²	78.1	24%	0.241	38%	0.384	C	S	.	.	H	α-helix	trans	-63.1	-35.7	176.3	-70.7	168	0	0	0	112	S410 F418	S410-L414 WeakPolarHBondContact O-CB 3.36Å; S410-L414 VanDerWaalsContact O-CG 3.26Å; S410-L414 WeakPolarHBondContact O-CG 3.42Å; S410-L414 PolarHBondContact O-N 3.46Å; L414-F418 WeakPolarHBondContact O-CB 3.45Å; L414-F418 PolarHBondContact O-N 3.31Å
415	Y	44.2	Very low	46.2	Very low	119 Å²	119	76.2 Å²	76.2	47%	0.467	38%	0.376	S	S	.	.	H	α-helix	trans	-67.4	-47.1	174.5	-177.3	-97.5	0	0	0	112.1	A411 G412 R413 E417 F418 V419	A411-Y415 VanDerWaalsContact O-CB 3.31Å; A411-Y415 WeakPolarHBondContact O-CB 3.02Å; A411-Y415 PolarHBondContact O-N 2.88Å; G412-Y415 PolarHBondContact O-N 3.49Å; R413-Y415 VanDerWaalsContact C-N 3.29Å; R413-Y415 PolarHBondContact O-N 3.38Å; Y415-E417 PolarHBondContact O-N 3.36Å; Y415-F418 PolarHBondContact O-N 3.24Å; Y415-V419 HydrophobicContact CD1-CG2 4.02Å; Y415-V419 HydrophobicContact CD2-CG2 4.49Å; Y415-V419 HydrophobicContact CE1-CG2 3.63Å; Y415-V419 HydrophobicContact CE2-CG2 4.15Å; Y415-V419 HydrophobicContact CG-CG2 4.44Å; Y415-V419 VanDerWaalsContact O-CG2 3.3Å; Y415-V419 WeakPolarHBondContact O-CG2 3.29Å; Y415-V419 PolarHBondContact O-N 2.84Å
416	E	46.8	Very low	46	Very low	118 Å²	118	73.9 Å²	73.9	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-61.6	-43.7	177.7	-79.1	-168.9	-172.2	0	0	112.6	G412 R413 F418 V419 K420	G412-E416 PolarHBondContact O-N 2.86Å; R413-E416 PolarHBondContact O-N 3.29Å; E416-F418 VanDerWaalsContact C-N 3.34Å; E416-V419 PolarHBondContact O-N 3.41Å; E416-K420 WeakPolarHBondContact O-CB 3.39Å; E416-K420 VanDerWaalsContact O-CG 3.3Å; E416-K420 WeakPolarHBondContact O-CG 3.41Å; E416-K420 PolarHBondContact O-N 2.88Å
417	E	51.4	Low	46	Very low	120 Å²	120	74.5 Å²	74.5	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-66.3	-38.1	176.3	-72	-177.3	169.8	0	0	111.7	R413 Y415 K420 E421	R413-E417 PolarHBondContact O-N 3.49Å; Y415-E417 PolarHBondContact O-N 3.36Å; E417-K420 PolarHBondContact O-N 3.26Å; E417-E421 PolarHBondContact O-N 3.5Å
418	F	45	Very low	46	Very low	51 Å²	51	77.9 Å²	77.9	22%	0.224	38%	0.384	C	S	.	.	H	α-helix	trans	-63.7	-45.3	173.4	177.9	-95.7	0	0	0	112.6	A108 K183 L414 Y415 E416 K420 E421 V422	A108-F418 HydrophobicContact CB-CE1 3.96Å; A108-F418 HydrophobicContact CB-CZ 4.36Å; K183-F418 HydrophobicContact CD-CD2 3.93Å; L414-F418 WeakPolarHBondContact O-CB 3.45Å; L414-F418 PolarHBondContact O-N 3.31Å; Y415-F418 PolarHBondContact O-N 3.24Å; E416-F418 VanDerWaalsContact C-N 3.34Å; F418-K420 VanDerWaalsContact C-N 3.34Å; F418-K420 PolarHBondContact O-N 3.22Å; F418-E421 PolarHBondContact O-N 3.1Å; F418-V422 HydrophobicContact CD1-CG2 4.08Å; F418-V422 HydrophobicContact CD2-CG2 4.19Å; F418-V422 HydrophobicContact CE1-CG2 3.72Å; F418-V422 HydrophobicContact CE2-CG2 3.83Å; F418-V422 HydrophobicContact CG-CG2 4.31Å; F418-V422 HydrophobicContact CZ-CG2 3.6Å; F418-V422 WeakPolarHBondContact O-CB 3.18Å; F418-V422 VanDerWaalsContact O-CG2 3.25Å; F418-V422 WeakPolarHBondContact O-CG2 3.48Å; F418-V422 PolarHBondContact O-N 2.99Å
419	V	44.6	Very low	46	Very low	53 Å²	53	72.9 Å²	72.9	32%	0.321	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-45.6	176.5	171.2	0	0	0	0	110	Y415 E416 E421 V422 V423	Y415-V419 HydrophobicContact CD1-CG2 4.02Å; Y415-V419 HydrophobicContact CD2-CG2 4.49Å; Y415-V419 HydrophobicContact CE1-CG2 3.63Å; Y415-V419 HydrophobicContact CE2-CG2 4.15Å; Y415-V419 HydrophobicContact CG-CG2 4.44Å; Y415-V419 VanDerWaalsContact O-CG2 3.3Å; Y415-V419 WeakPolarHBondContact O-CG2 3.29Å; Y415-V419 PolarHBondContact O-N 2.84Å; E416-V419 PolarHBondContact O-N 3.41Å; V419-E421 PolarHBondContact O-N 3.37Å; V419-V422 PolarHBondContact O-N 2.96Å; V419-V423 HydrophobicContact CG1-CG2 4.22Å; V419-V423 VanDerWaalsContact O-CB 3.32Å; V419-V423 WeakPolarHBondContact O-CB 3.45Å; V419-V423 WeakPolarHBondContact O-CG2 3.21Å; V419-V423 PolarHBondContact O-N 2.96Å
420	K	48.9	Very low	46.1	Very low	126 Å²	126	69.4 Å²	69.4	55%	0.548	36%	0.355	S	S	.	.	H	α-helix	trans	-58.1	-48.5	176.9	-75.1	172.1	-174.6	168.7	0	112.2	E416 E417 F418 V423 I424	E416-K420 WeakPolarHBondContact O-CB 3.39Å; E416-K420 VanDerWaalsContact O-CG 3.3Å; E416-K420 WeakPolarHBondContact O-CG 3.41Å; E416-K420 PolarHBondContact O-N 2.88Å; E417-K420 PolarHBondContact O-N 3.26Å; F418-K420 VanDerWaalsContact C-N 3.34Å; F418-K420 PolarHBondContact O-N 3.22Å; K420-V423 PolarHBondContact O-N 2.82Å; K420-I424 WeakPolarHBondContact O-CD1 3.25Å; K420-I424 VanDerWaalsContact O-CG1 3.25Å; K420-I424 WeakPolarHBondContact O-CG1 3.25Å; K420-I424 PolarHBondContact O-N 3.46Å
421	E	47.5	Very low	46.2	Very low	86 Å²	86	72 Å²	72	40%	0.402	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-39.3	179.4	-76.8	-161.9	148.6	0	0	113.3	K183 E417 F418 V419 V423 I424 I425	K183-E421 WeakPolarHBondContact CE-OE2 3.37Å; K183-E421 IonicContact NZ-OE2 3.52Å; K183-E421 PolarHBondContact NZ-OE2 3.06Å; E417-E421 PolarHBondContact O-N 3.5Å; F418-E421 PolarHBondContact O-N 3.1Å; V419-E421 PolarHBondContact O-N 3.37Å; E421-V423 VanDerWaalsContact C-N 3.33Å; E421-I424 PolarHBondContact O-N 3.38Å; E421-I425 VanDerWaalsContact O-CG1 3.29Å; E421-I425 WeakPolarHBondContact O-CG1 3.3Å; E421-I425 PolarHBondContact O-N 3.41Å
422	V	41.5	Very low	46.4	Very low	31 Å²	31	74 Å²	74	19%	0.188	38%	0.382	C	S	.	.	H	α-helix	trans	-64.5	-41.3	175.9	170.9	0	0	0	0	110.4	F418 V419 I424 I425 V426	F418-V422 HydrophobicContact CD1-CG2 4.08Å; F418-V422 HydrophobicContact CD2-CG2 4.19Å; F418-V422 HydrophobicContact CE1-CG2 3.72Å; F418-V422 HydrophobicContact CE2-CG2 3.83Å; F418-V422 HydrophobicContact CG-CG2 4.31Å; F418-V422 HydrophobicContact CZ-CG2 3.6Å; F418-V422 WeakPolarHBondContact O-CB 3.18Å; F418-V422 VanDerWaalsContact O-CG2 3.25Å; F418-V422 WeakPolarHBondContact O-CG2 3.48Å; F418-V422 PolarHBondContact O-N 2.99Å; V419-V422 PolarHBondContact O-N 2.96Å; V422-I424 VanDerWaalsContact C-N 3.34Å; V422-I424 PolarHBondContact O-N 3.44Å; V422-I425 PolarHBondContact O-N 3.47Å; V422-V426 HydrophobicContact CG1-CG2 4.18Å; V422-V426 WeakPolarHBondContact O-CB 3.32Å; V422-V426 WeakPolarHBondContact O-CG2 3.49Å; V422-V426 PolarHBondContact O-N 3.02Å
423	V	45.6	Very low	46.7	Very low	23 Å²	23	76.6 Å²	76.6	14%	0.139	39%	0.387	C	S	.	.	H	α-helix	trans	-59.3	-46.2	173.8	165.9	0	0	0	0	110.2	V419 K420 E421 V426 V427 W452 V458	V419-V423 HydrophobicContact CG1-CG2 4.22Å; V419-V423 VanDerWaalsContact O-CB 3.32Å; V419-V423 WeakPolarHBondContact O-CB 3.45Å; V419-V423 WeakPolarHBondContact O-CG2 3.21Å; V419-V423 PolarHBondContact O-N 2.96Å; K420-V423 PolarHBondContact O-N 2.82Å; E421-V423 VanDerWaalsContact C-N 3.33Å; V423-V426 PolarHBondContact O-N 3.01Å; V423-V427 HydrophobicContact CG1-CG2 4.31Å; V423-V427 WeakPolarHBondContact O-CB 3.3Å; V423-V427 WeakPolarHBondContact O-CG2 3.25Å; V423-V427 PolarHBondContact O-N 3.36Å; V423-W452 HydrophobicContact CB-CH2 4.28Å; V423-W452 HydrophobicContact CG1-CH2 4Å; V423-W452 HydrophobicContact CG1-CZ3 4.4Å; V423-W452 HydrophobicContact CG2-CH2 4.21Å; V423-V458 HydrophobicContact CG1-CG2 4.28Å; V423-V458 HydrophobicContact CG2-CG2 4.17Å
424	I	47.8	Very low	46.6	Very low	97 Å²	97	70.2 Å²	70.2	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-61	-47.5	177.2	-69.8	163.5	0	0	0	111.7	K420 E421 V422 V426 V427 N428	K420-I424 WeakPolarHBondContact O-CD1 3.25Å; K420-I424 VanDerWaalsContact O-CG1 3.25Å; K420-I424 WeakPolarHBondContact O-CG1 3.25Å; K420-I424 PolarHBondContact O-N 3.46Å; E421-I424 PolarHBondContact O-N 3.38Å; V422-I424 VanDerWaalsContact C-N 3.34Å; V422-I424 PolarHBondContact O-N 3.44Å; I424-V426 PolarHBondContact O-N 2.96Å; I424-V427 PolarHBondContact O-N 3.42Å; I424-N428 WeakPolarHBondContact O-CB 3.49Å; I424-N428 PolarHBondContact O-N 3.32Å; I424-N428 PolarHBondContact O-ND2 3.34Å
425	I	43.2	Very low	47	Very low	74 Å²	74	73.1 Å²	73.1	38%	0.379	38%	0.383	S	S	.	.	H	α-helix	trans	-62.1	-45.9	179.6	-69	166.2	0	0	0	110.2	E421 V422 N428 C429	E421-I425 VanDerWaalsContact O-CG1 3.29Å; E421-I425 WeakPolarHBondContact O-CG1 3.3Å; E421-I425 PolarHBondContact O-N 3.41Å; V422-I425 PolarHBondContact O-N 3.47Å; I425-N428 PolarHBondContact O-N 2.82Å; I425-C429 WeakPolarHBondContact O-CB 3.41Å; I425-C429 PolarHBondContact O-N 2.89Å; I425-C429 PolarHBondContact O-SG 3.47Å; I425-C429 VanDerWaalsContact O-SG 3.35Å
426	V	41.6	Very low	47.3	Very low	43 Å²	43	73.4 Å²	73.4	26%	0.261	39%	0.393	S	S	.	.	H	α-helix	trans	-67.8	-39.9	-179.1	177.4	0	0	0	0	111.2	V422 V423 I424 N428 C429 L430 W452	V422-V426 HydrophobicContact CG1-CG2 4.18Å; V422-V426 WeakPolarHBondContact O-CB 3.32Å; V422-V426 WeakPolarHBondContact O-CG2 3.49Å; V422-V426 PolarHBondContact O-N 3.02Å; V423-V426 PolarHBondContact O-N 3.01Å; I424-V426 PolarHBondContact O-N 2.96Å; V426-N428 VanDerWaalsContact C-N 3.32Å; V426-N428 PolarHBondContact O-N 3.1Å; V426-C429 PolarHBondContact O-N 3.49Å; V426-L430 HydrophobicContact CG1-CD1 3.7Å; V426-L430 HydrophobicContact CG1-CG 4.08Å; V426-L430 VanDerWaalsContact O-CB 3.25Å; V426-L430 WeakPolarHBondContact O-CB 3.25Å; V426-L430 VanDerWaalsContact O-CG 3.25Å; V426-L430 WeakPolarHBondContact O-CG 3.25Å; V426-L430 PolarHBondContact O-N 3.23Å; V426-W452 HydrophobicContact CB-CH2 4.09Å; V426-W452 HydrophobicContact CB-CZ2 3.52Å; V426-W452 HydrophobicContact CG1-CD2 4.38Å; V426-W452 HydrophobicContact CG1-CH2 4.04Å; V426-W452 HydrophobicContact CG1-CZ2 3.18Å; V426-W452 HydrophobicContact CG2-CZ2 4.3Å
427	V	49.4	Very low	47.4	Very low	57 Å²	57	69 Å²	69	35%	0.345	37%	0.373	S	S	.	.	H	α-helix	trans	-60.9	-42.3	173	168.9	0	0	0	0	110.7	V423 I424 T431 W452	V423-V427 HydrophobicContact CG1-CG2 4.31Å; V423-V427 WeakPolarHBondContact O-CB 3.3Å; V423-V427 WeakPolarHBondContact O-CG2 3.25Å; V423-V427 PolarHBondContact O-N 3.36Å; I424-V427 PolarHBondContact O-N 3.42Å; V427-T431 VanDerWaalsContact O-CB 3.23Å; V427-T431 WeakPolarHBondContact O-CB 3.3Å; V427-T431 PolarHBondContact O-N 2.79Å; V427-T431 PolarHBondContact O-OG1 2.72Å; V427-W452 HydrophobicContact CG2-CH2 3.94Å; V427-W452 HydrophobicContact CG2-CZ3 3.66Å
428	N	47.9	Very low	47.5	Very low	100 Å²	100	69 Å²	69	54%	0.535	39%	0.386	S	S	.	.	H	α-helix	trans	-66.7	-43.3	177.2	-73.1	-22.3	0	0	0	112.2	I424 I425 V426 T431 S432	I424-N428 WeakPolarHBondContact O-CB 3.49Å; I424-N428 PolarHBondContact O-N 3.32Å; I424-N428 PolarHBondContact O-ND2 3.34Å; I425-N428 PolarHBondContact O-N 2.82Å; V426-N428 VanDerWaalsContact C-N 3.32Å; V426-N428 PolarHBondContact O-N 3.1Å; N428-T431 PolarHBondContact O-N 3.48Å; N428-S432 WeakPolarHBondContact O-CB 3.23Å; N428-S432 PolarHBondContact O-N 3.41Å
429	C	43	Very low	47.9	Very low	51 Å²	51	76 Å²	76	35%	0.345	41%	0.411	S	S	.	.	H	α-helix	trans	-63.6	-47	175.5	-73.3	0	0	0	0	111.5	I425 V426 T431 S432 I433	I425-C429 WeakPolarHBondContact O-CB 3.41Å; I425-C429 PolarHBondContact O-N 2.89Å; I425-C429 PolarHBondContact O-SG 3.47Å; I425-C429 VanDerWaalsContact O-SG 3.35Å; V426-C429 PolarHBondContact O-N 3.49Å; C429-T431 VanDerWaalsContact C-N 3.34Å; C429-T431 PolarHBondContact O-N 2.88Å; C429-S432 PolarHBondContact O-N 2.81Å; C429-I433 WeakPolarHBondContact O-CB 3.38Å; C429-I433 VanDerWaalsContact O-CG1 3.25Å; C429-I433 WeakPolarHBondContact O-CG1 3.18Å; C429-I433 PolarHBondContact O-N 2.84Å
430	L	47.4	Very low	48.3	Very low	33 Å²	33	78.8 Å²	78.8	17%	0.173	42%	0.416	C	S	.	.	H	α-helix	trans	-62	-42.4	176.1	-75.1	171.8	0	0	0	110.9	V426 S432 I433 L434 L448 W452	V426-L430 HydrophobicContact CG1-CD1 3.7Å; V426-L430 HydrophobicContact CG1-CG 4.08Å; V426-L430 VanDerWaalsContact O-CB 3.25Å; V426-L430 WeakPolarHBondContact O-CB 3.25Å; V426-L430 VanDerWaalsContact O-CG 3.25Å; V426-L430 WeakPolarHBondContact O-CG 3.25Å; V426-L430 PolarHBondContact O-N 3.23Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 3.36Å; L430-I433 PolarHBondContact O-N 3.46Å; L430-L434 HydrophobicContact CB-CD1 4.35Å; L430-L434 WeakPolarHBondContact O-CB 3.33Å; L430-L434 WeakPolarHBondContact O-CD1 3.49Å; L430-L434 WeakPolarHBondContact O-CG 3.28Å; L430-L434 PolarHBondContact O-N 3.25Å; L430-L448 HydrophobicContact CD2-CD2 4.25Å; L430-W452 HydrophobicContact CD1-CD2 3.9Å; L430-W452 HydrophobicContact CD1-CE3 4.39Å; L430-W452 HydrophobicContact CD1-CG 3.91Å
431	T	54.3	Low	48.9	Very low	71 Å²	71	78.3 Å²	78.3	44%	0.436	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-44.4	175.3	-57.3	0	0	0	0	110.6	V427 N428 C429 I433 L434 V435	V427-T431 VanDerWaalsContact O-CB 3.23Å; V427-T431 WeakPolarHBondContact O-CB 3.3Å; V427-T431 PolarHBondContact O-N 2.79Å; V427-T431 PolarHBondContact O-OG1 2.72Å; N428-T431 PolarHBondContact O-N 3.48Å; C429-T431 VanDerWaalsContact C-N 3.34Å; C429-T431 PolarHBondContact O-N 2.88Å; T431-I433 PolarHBondContact O-N 2.9Å; T431-L434 PolarHBondContact O-N 2.66Å; T431-V435 HydrophobicContact CG2-CG2 3.98Å; T431-V435 WeakPolarHBondContact O-CB 3.13Å; T431-V435 WeakPolarHBondContact O-CG2 3.1Å; T431-V435 PolarHBondContact O-N 3.42Å
432	S	48.5	Very low	49.6	Very low	67 Å²	67	80.4 Å²	80.4	47%	0.469	43%	0.432	S	S	.	.	H	α-helix	trans	-62.3	-43.9	177	-174.9	0	0	0	0	112.6	N428 C429 L430 N436	N428-S432 WeakPolarHBondContact O-CB 3.23Å; N428-S432 PolarHBondContact O-N 3.41Å; C429-S432 PolarHBondContact O-N 2.81Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 3.36Å; S432-N436 VanDerWaalsContact O-CB 3.3Å; S432-N436 WeakPolarHBondContact O-CB 3.12Å; S432-N436 PolarHBondContact O-N 2.85Å; S432-N436 VanDerWaalsContact O-N 3.12Å; S432-N436 PolarHBondContact O-ND2 3.28Å; S432-N436 VanDerWaalsContact O-ND2 3.1Å
433	I	42.4	Very low	50.5	Low	92 Å²	92	82.6 Å²	82.6	47%	0.472	45%	0.45	S	S	.	.	H	α-helix	trans	-67.5	-46.2	178.8	-67.6	164.7	0	0	0	110.6	C429 L430 T431 D437	C429-I433 WeakPolarHBondContact O-CB 3.38Å; C429-I433 VanDerWaalsContact O-CG1 3.25Å; C429-I433 WeakPolarHBondContact O-CG1 3.18Å; C429-I433 PolarHBondContact O-N 2.84Å; L430-I433 PolarHBondContact O-N 3.46Å; T431-I433 PolarHBondContact O-N 2.9Å; I433-D437 WeakPolarHBondContact O-CB 3.33Å; I433-D437 PolarHBondContact O-N 3.16Å
434	L	48.6	Very low	51.1	Low	17 Å²	17	86 Å²	86	9%	0.089	46%	0.464	C	S	.	.	H	α-helix	trans	-77.2	-26.1	-175.2	-62.2	170.5	0	0	0	112.3	L430 T431 K445 I449	L430-L434 HydrophobicContact CB-CD1 4.35Å; L430-L434 WeakPolarHBondContact O-CB 3.33Å; L430-L434 WeakPolarHBondContact O-CD1 3.49Å; L430-L434 WeakPolarHBondContact O-CG 3.28Å; L430-L434 PolarHBondContact O-N 3.25Å; T431-L434 PolarHBondContact O-N 2.66Å; L434-K445 HydrophobicContact CB-CD 4.17Å; L434-K445 HydrophobicContact CB-CG 4.42Å; L434-K445 HydrophobicContact CD2-CB 3.88Å; L434-K445 HydrophobicContact CD2-CD 4.28Å; L434-K445 HydrophobicContact CD2-CG 3.67Å; L434-K445 WeakPolarHBondContact O-CD 3.42Å; L434-K445 WeakPolarHBondContact O-CE 3.33Å; L434-K445 PolarHBondContact O-NZ 3.35Å; L434-I449 HydrophobicContact CD1-CD1 3.7Å; L434-I449 HydrophobicContact CD1-CG1 3.6Å
435	V	57.1	Low	51.4	Low	106 Å²	106	82.9 Å²	82.9	64%	0.642	45%	0.447	S	S	*	.	H	α-helix	trans	-79.5	-39.3	174.5	172.6	0	0	0	0	111.4	T431	T431-V435 HydrophobicContact CG2-CG2 3.98Å; T431-V435 WeakPolarHBondContact O-CB 3.13Å; T431-V435 WeakPolarHBondContact O-CG2 3.1Å; T431-V435 PolarHBondContact O-N 3.42Å
436	N	52	Low	52.5	Low	125 Å²	125	84.2 Å²	84.2	67%	0.668	45%	0.451	S	S	*	.	H	α-helix	trans	-94.4	-18.3	-172.5	-66.5	-45.9	0	0	0	114.9	S432 S438	S432-N436 VanDerWaalsContact O-CB 3.3Å; S432-N436 WeakPolarHBondContact O-CB 3.12Å; S432-N436 PolarHBondContact O-N 2.85Å; S432-N436 VanDerWaalsContact O-N 3.12Å; S432-N436 PolarHBondContact O-ND2 3.28Å; S432-N436 VanDerWaalsContact O-ND2 3.1Å; N436-S438 PolarHBondContact O-N 3.47Å
437	D	47.9	Very low	53.4	Low	27 Å²	27	87.3 Å²	87.3	14%	0.144	46%	0.463	C	S	.	.			trans	-91.3	107.5	179.7	-154.2	-24.3	0	0	0	111.2	I433 R439 Y440 K445	I433-D437 WeakPolarHBondContact O-CB 3.33Å; I433-D437 PolarHBondContact O-N 3.16Å; D437-R439 PolarHBondContact O-N 2.88Å; D437-R439 VanDerWaalsContact OD1-CB 3.28Å; D437-R439 WeakPolarHBondContact OD1-CB 3.12Å; D437-R439 WeakPolarHBondContact OD1-CG 3.17Å; D437-R439 IonicContact OD1-CZ 3.86Å; D437-R439 PolarHBondContact OD1-N 2.99Å; D437-R439 VanDerWaalsContact OD1-N 3.16Å; D437-R439 IonicContact OD1-NE 2.78Å; D437-R439 PolarHBondContact OD1-NE 3.12Å; D437-R439 IonicContact OD1-NH2 3.98Å; D437-R439 IonicContact OD2-CZ 3.45Å; D437-R439 IonicContact OD2-NE 3.13Å; D437-R439 PolarHBondContact OD2-NE 2.8Å; D437-R439 IonicContact OD2-NH2 3.78Å; D437-R439 PolarHBondContact OD2-NH2 3.48Å; D437-Y440 HydrophobicContact CB-CD2 4.08Å; D437-Y440 HydrophobicContact CB-CE2 4.29Å; D437-K445 WeakPolarHBondContact O-CE 3.19Å; D437-K445 PolarHBondContact O-NZ 3.31Å
438	S	54.2	Low	53.6	Low	118 Å²	118	88.9 Å²	88.9	83%	0.825	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-3.7	178.1	56	0	0	0	0	113.5	N436	N436-S438 PolarHBondContact O-N 3.47Å
439	R	52.7	Low	54	Low	198 Å²	198	87.4 Å²	87.4	75%	0.747	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-16.3	-176.3	-64.4	177.3	-69.6	-177.3	0.9	114.7	D437	D437-R439 PolarHBondContact O-N 2.88Å; D437-R439 VanDerWaalsContact OD1-CB 3.28Å; D437-R439 WeakPolarHBondContact OD1-CB 3.12Å; D437-R439 WeakPolarHBondContact OD1-CG 3.17Å; D437-R439 IonicContact OD1-CZ 3.86Å; D437-R439 PolarHBondContact OD1-N 2.99Å; D437-R439 VanDerWaalsContact OD1-N 3.16Å; D437-R439 IonicContact OD1-NE 2.78Å; D437-R439 PolarHBondContact OD1-NE 3.12Å; D437-R439 IonicContact OD1-NH2 3.98Å; D437-R439 IonicContact OD2-CZ 3.45Å; D437-R439 IonicContact OD2-NE 3.13Å; D437-R439 PolarHBondContact OD2-NE 2.8Å; D437-R439 IonicContact OD2-NH2 3.78Å; D437-R439 PolarHBondContact OD2-NH2 3.48Å
440	Y	53.8	Low	54.8	Low	112 Å²	112	92.2 Å²	92.2	44%	0.439	47%	0.471	S	S	.	.	S	Bend	trans	-100.4	132.4	179.7	-62	-81.4	0	0	0	111.2	D437 K445	D437-Y440 HydrophobicContact CB-CD2 4.08Å; D437-Y440 HydrophobicContact CB-CE2 4.29Å; Y440-K445 VanDerWaalsContact O-CE 3.25Å; Y440-K445 WeakPolarHBondContact O-CE 3.48Å
441	L	60.8	Low	55.4	Low	116 Å²	116	97.9 Å²	97.9	61%	0.607	49%	0.49	S	S	*	.			trans	-65.4	146	171.1	-76.9	156.2	0	0	0	109.7	S443 E444 K445	L441-S443 PolarHBondContact O-N 3.02Å; L441-S443 VanDerWaalsContact O-N 3.1Å; L441-E444 HydrophobicContact CB-CG 4.15Å; L441-E444 PolarHBondContact N-OE2 2.85Å; L441-E444 WeakPolarHBondContact O-CB 3.35Å; L441-E444 PolarHBondContact O-N 3.22Å; L441-K445 PolarHBondContact O-N 3.41Å; L441-K445 VanDerWaalsContact O-N 3.11Å
442	L	61.8	Low	55.1	Low	130 Å²	130	95.5 Å²	95.5	68%	0.681	47%	0.473	S	S	*	.	H	α-helix	trans	-53.9	-34.9	-179	-169	73.5	0	0	0	112.6	K445 H446	L442-K445 PolarHBondContact O-N 3.18Å; L442-H446 PolarHBondContact O-N 3.2Å; L442-H446 VanDerWaalsContact O-N 3.08Å
443	S	59.9	Low	55.4	Low	78 Å²	78	95.2 Å²	95.2	55%	0.545	47%	0.466	S	S	.	.	H	α-helix	trans	-63.2	-39.6	175	51.9	0	0	0	0	113	L441 H446 E447	L441-S443 PolarHBondContact O-N 3.02Å; L441-S443 VanDerWaalsContact O-N 3.1Å; S443-H446 PolarHBondContact O-N 3.45Å; S443-E447 PolarHBondContact O-N 3.4Å; S443-E447 VanDerWaalsContact O-N 3.09Å
444	E	58.2	Low	55.9	Low	95 Å²	95	96.1 Å²	96.1	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-70.7	-37.1	178.2	-61.6	173.2	141.9	0	0	110.7	L441 E447 L448	L441-E444 HydrophobicContact CB-CG 4.15Å; L441-E444 PolarHBondContact N-OE2 2.85Å; L441-E444 WeakPolarHBondContact O-CB 3.35Å; L441-E444 PolarHBondContact O-N 3.22Å; E444-E447 PolarHBondContact O-N 3.34Å; E444-L448 WeakPolarHBondContact O-CB 3.25Å; E444-L448 PolarHBondContact O-N 3.43Å
445	K	56.1	Low	55.8	Low	31 Å²	31	100.4 Å²	100.4	14%	0.135	50%	0.497	C	S	.	.	H	α-helix	trans	-61.5	-44.2	174.6	-59.3	-176.2	174	177.1	0	111.4	L434 D437 Y440 L441 L442 L448 I449	L434-K445 HydrophobicContact CB-CD 4.17Å; L434-K445 HydrophobicContact CB-CG 4.42Å; L434-K445 HydrophobicContact CD2-CB 3.88Å; L434-K445 HydrophobicContact CD2-CD 4.28Å; L434-K445 HydrophobicContact CD2-CG 3.67Å; L434-K445 WeakPolarHBondContact O-CD 3.42Å; L434-K445 WeakPolarHBondContact O-CE 3.33Å; L434-K445 PolarHBondContact O-NZ 3.35Å; D437-K445 WeakPolarHBondContact O-CE 3.19Å; D437-K445 PolarHBondContact O-NZ 3.31Å; Y440-K445 VanDerWaalsContact O-CE 3.25Å; Y440-K445 WeakPolarHBondContact O-CE 3.48Å; L441-K445 PolarHBondContact O-N 3.41Å; L441-K445 VanDerWaalsContact O-N 3.11Å; L442-K445 PolarHBondContact O-N 3.18Å; K445-L448 PolarHBondContact O-N 2.93Å; K445-I449 VanDerWaalsContact O-CG1 3.3Å; K445-I449 WeakPolarHBondContact O-CG1 3.44Å; K445-I449 PolarHBondContact O-N 3.37Å; K445-I449 VanDerWaalsContact O-N 3.1Å
446	H	64.7	Low	55.2	Low	101 Å²	101	99.9 Å²	99.9	47%	0.468	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-42.3	178.3	-90.7	-132.9	0	0	0	113.1	L442 S443 L448 I449 R450	L442-H446 PolarHBondContact O-N 3.2Å; L442-H446 VanDerWaalsContact O-N 3.08Å; S443-H446 PolarHBondContact O-N 3.45Å; H446-L448 VanDerWaalsContact C-N 3.34Å; H446-I449 PolarHBondContact O-N 2.67Å; H446-R450 WeakPolarHBondContact O-CB 3.3Å; H446-R450 WeakPolarHBondContact O-CG 3.44Å; H446-R450 PolarHBondContact O-N 3.1Å
447	E	62	Low	54.7	Low	109 Å²	109	102.8 Å²	102.8	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-38.2	176.8	-74.8	-61.9	125.6	0	0	111.7	S443 E444 R450 W451	S443-E447 PolarHBondContact O-N 3.4Å; S443-E447 VanDerWaalsContact O-N 3.09Å; E444-E447 PolarHBondContact O-N 3.34Å; E447-R450 PolarHBondContact O-N 3.38Å; E447-R450 IonicContact OE1-NH1 3.13Å; E447-R450 PolarHBondContact OE1-NH1 3.02Å; E447-R450 VanDerWaalsContact OE1-NH1 3.13Å; E447-W451 VanDerWaalsContact O-CB 3.25Å; E447-W451 WeakPolarHBondContact O-CB 3.25Å; E447-W451 PolarHBondContact O-N 3.11Å
448	L	52.9	Low	54.5	Low	90 Å²	90	103.7 Å²	103.7	47%	0.471	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-43.5	175.9	-142.2	100.4	0	0	0	111.9	L430 E444 K445 H446 W452	L430-L448 HydrophobicContact CD2-CD2 4.25Å; E444-L448 WeakPolarHBondContact O-CB 3.25Å; E444-L448 PolarHBondContact O-N 3.43Å; K445-L448 PolarHBondContact O-N 2.93Å; H446-L448 VanDerWaalsContact C-N 3.34Å; L448-W452 WeakPolarHBondContact O-CB 3.47Å; L448-W452 PolarHBondContact O-N 3.47Å
449	I	56.6	Low	53.7	Low	68 Å²	68	110 Å²	110	35%	0.349	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-47.2	176.3	-68.7	166.4	0	0	0	110.5	L434 K445 H446 W451 W452 L453	L434-I449 HydrophobicContact CD1-CD1 3.7Å; L434-I449 HydrophobicContact CD1-CG1 3.6Å; K445-I449 VanDerWaalsContact O-CG1 3.3Å; K445-I449 WeakPolarHBondContact O-CG1 3.44Å; K445-I449 PolarHBondContact O-N 3.37Å; K445-I449 VanDerWaalsContact O-N 3.1Å; H446-I449 PolarHBondContact O-N 2.67Å; I449-W451 PolarHBondContact O-N 3.38Å; I449-W452 PolarHBondContact O-N 3.46Å; I449-L453 HydrophobicContact CG2-CD1 3.79Å; I449-L453 HydrophobicContact CG2-CG 4.29Å; I449-L453 WeakPolarHBondContact O-CG 3.42Å; I449-L453 PolarHBondContact O-N 2.9Å
450	R	58.9	Low	53.7	Low	153 Å²	153	105.7 Å²	105.7	58%	0.577	51%	0.508	S	S	*	.	H	α-helix	trans	-61.2	-45.1	178.2	-80.7	-178	179.5	151.8	-2.7	112.4	H446 E447 W452 L453 C454	H446-R450 WeakPolarHBondContact O-CB 3.3Å; H446-R450 WeakPolarHBondContact O-CG 3.44Å; H446-R450 PolarHBondContact O-N 3.1Å; E447-R450 PolarHBondContact O-N 3.38Å; E447-R450 IonicContact OE1-NH1 3.13Å; E447-R450 PolarHBondContact OE1-NH1 3.02Å; E447-R450 VanDerWaalsContact OE1-NH1 3.13Å; R450-W452 VanDerWaalsContact C-N 3.26Å; R450-W452 PolarHBondContact O-N 3.09Å; R450-L453 PolarHBondContact O-N 2.87Å; R450-C454 VanDerWaalsContact O-CB 3.23Å; R450-C454 WeakPolarHBondContact O-CB 3.38Å; R450-C454 PolarHBondContact O-N 2.93Å
451	W	59.3	Low	53.7	Low	151 Å²	151	105.3 Å²	105.3	57%	0.572	51%	0.511	S	S	*	.	H	α-helix	trans	-60.1	-40.5	176.9	-177.6	88.8	0	0	0	111.2	E447 I449 K455	E447-W451 VanDerWaalsContact O-CB 3.25Å; E447-W451 WeakPolarHBondContact O-CB 3.25Å; E447-W451 PolarHBondContact O-N 3.11Å; I449-W451 PolarHBondContact O-N 3.38Å; W451-K455 HydrophobicContact CH2-CD 3.71Å; W451-K455 HydrophobicContact CZ2-CD 4.01Å; W451-K455 HydrophobicContact CZ3-CD 4.1Å; W451-K455 WeakPolarHBondContact O-CB 3.45Å; W451-K455 PolarHBondContact O-N 3.01Å
452	W	49.5	Very low	53.4	Low	22 Å²	22	104.7 Å²	104.7	8%	0.083	51%	0.506	C	S	.	.	H	α-helix	trans	-67.7	-48.8	178.2	-167.4	84.6	0	0	0	112.4	V423 V426 V427 L430 L448 I449 R450 C454 K455 F456	V423-W452 HydrophobicContact CB-CH2 4.28Å; V423-W452 HydrophobicContact CG1-CH2 4Å; V423-W452 HydrophobicContact CG1-CZ3 4.4Å; V423-W452 HydrophobicContact CG2-CH2 4.21Å; V426-W452 HydrophobicContact CB-CH2 4.09Å; V426-W452 HydrophobicContact CB-CZ2 3.52Å; V426-W452 HydrophobicContact CG1-CD2 4.38Å; V426-W452 HydrophobicContact CG1-CH2 4.04Å; V426-W452 HydrophobicContact CG1-CZ2 3.18Å; V426-W452 HydrophobicContact CG2-CZ2 4.3Å; V427-W452 HydrophobicContact CG2-CH2 3.94Å; V427-W452 HydrophobicContact CG2-CZ3 3.66Å; L430-W452 HydrophobicContact CD1-CD2 3.9Å; L430-W452 HydrophobicContact CD1-CE3 4.39Å; L430-W452 HydrophobicContact CD1-CG 3.91Å; L448-W452 WeakPolarHBondContact O-CB 3.47Å; L448-W452 PolarHBondContact O-N 3.47Å; I449-W452 PolarHBondContact O-N 3.46Å; R450-W452 VanDerWaalsContact C-N 3.26Å; R450-W452 PolarHBondContact O-N 3.09Å; W452-C454 VanDerWaalsContact C-N 3.33Å; W452-C454 PolarHBondContact O-N 3.45Å; W452-K455 PolarHBondContact O-N 2.9Å; W452-F456 AromaticContact CD1-CE2 3.94Å; W452-F456 HydrophobicContact CD2-CD2 4.11Å; W452-F456 HydrophobicContact CD2-CE2 4.49Å; W452-F456 AromaticContact CE2-CD2 3.71Å; W452-F456 AromaticContact CE2-CE2 3.8Å; W452-F456 HydrophobicContact CG-CD2 4.38Å; W452-F456 HydrophobicContact CZ2-CD2 4.01Å; W452-F456 HydrophobicContact CZ2-CE2 4.2Å; W452-F456 AromaticContact NE1-CD2 3.8Å; W452-F456 AromaticContact NE1-CE2 3.43Å; W452-F456 WeakPolarHBondContact O-CD2 3.23Å; W452-F456 PolarHBondContact O-N 3.1Å
453	L	54.3	Low	52.9	Low	61 Å²	61	103.2 Å²	103.2	32%	0.319	50%	0.496	S	S	.	.	H	α-helix	trans	-59.5	-42.8	177.2	-70	171	0	0	0	112	I449 R450 K455 F456 E457 V458	I449-L453 HydrophobicContact CG2-CD1 3.79Å; I449-L453 HydrophobicContact CG2-CG 4.29Å; I449-L453 WeakPolarHBondContact O-CG 3.42Å; I449-L453 PolarHBondContact O-N 2.9Å; R450-L453 PolarHBondContact O-N 2.87Å; L453-K455 VanDerWaalsContact C-N 3.28Å; L453-K455 PolarHBondContact O-N 3.41Å; L453-F456 PolarHBondContact O-N 3.49Å; L453-E457 PolarHBondContact O-N 3.4Å; L453-V458 HydrophobicContact CD2-CB 4.18Å; L453-V458 HydrophobicContact CD2-CG1 4.27Å
454	C	53.9	Low	52.4	Low	110 Å²	110	104.8 Å²	104.8	74%	0.743	49%	0.492	S	S	*	.	H	α-helix	trans	-65.6	-29.9	179.5	-165.7	0	0	0	0	112.7	R450 W452	R450-C454 VanDerWaalsContact O-CB 3.23Å; R450-C454 WeakPolarHBondContact O-CB 3.38Å; R450-C454 PolarHBondContact O-N 2.93Å; W452-C454 VanDerWaalsContact C-N 3.33Å; W452-C454 PolarHBondContact O-N 3.45Å
455	K	45.3	Very low	52	Low	107 Å²	107	105.5 Å²	105.5	47%	0.465	50%	0.496	S	S	.	.	H	α-helix	trans	-78.4	-23.4	-179.2	-163.6	179.4	179.6	-170.2	0	113.6	M115 W451 W452 L453	M115-K455 PolarHBondContact SD-NZ 2.96Å; W451-K455 HydrophobicContact CH2-CD 3.71Å; W451-K455 HydrophobicContact CZ2-CD 4.01Å; W451-K455 HydrophobicContact CZ3-CD 4.1Å; W451-K455 WeakPolarHBondContact O-CB 3.45Å; W451-K455 PolarHBondContact O-N 3.01Å; W452-K455 PolarHBondContact O-N 2.9Å; L453-K455 VanDerWaalsContact C-N 3.28Å; L453-K455 PolarHBondContact O-N 3.41Å
456	F	45	Very low	51.7	Low	96 Å²	96	110.8 Å²	110.8	42%	0.421	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	9.4	-175.4	-74.3	-77.3	0	0	0	114.1	W452 L453 V458	W452-F456 AromaticContact CD1-CE2 3.94Å; W452-F456 HydrophobicContact CD2-CD2 4.11Å; W452-F456 HydrophobicContact CD2-CE2 4.49Å; W452-F456 AromaticContact CE2-CD2 3.71Å; W452-F456 AromaticContact CE2-CE2 3.8Å; W452-F456 HydrophobicContact CG-CD2 4.38Å; W452-F456 HydrophobicContact CZ2-CD2 4.01Å; W452-F456 HydrophobicContact CZ2-CE2 4.2Å; W452-F456 AromaticContact NE1-CD2 3.8Å; W452-F456 AromaticContact NE1-CE2 3.43Å; W452-F456 WeakPolarHBondContact O-CD2 3.23Å; W452-F456 PolarHBondContact O-N 3.1Å; L453-F456 PolarHBondContact O-N 3.49Å; F456-V458 HydrophobicContact CB-CG2 3.9Å; F456-V458 PolarHBondContact O-N 3.08Å
457	E	41.6	Very low	50.8	Low	185 Å²	185	111.5 Å²	111.5	86%	0.864	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	30.9	-179.1	-61.8	-175.9	164.5	0	0	113	L453 E459	L453-E457 PolarHBondContact O-N 3.4Å; E457-E459 PolarHBondContact O-N 3.13Å
458	V	42.3	Very low	49.8	Very low	47 Å²	47	111.8 Å²	111.8	29%	0.285	53%	0.527	S	S	.	.			trans	-85.4	108.2	173.7	-175.1	0	0	0	0	106.3	V423 L453 F456	V423-V458 HydrophobicContact CG1-CG2 4.28Å; V423-V458 HydrophobicContact CG2-CG2 4.17Å; L453-V458 HydrophobicContact CD2-CB 4.18Å; L453-V458 HydrophobicContact CD2-CG1 4.27Å; F456-V458 HydrophobicContact CB-CG2 3.9Å; F456-V458 PolarHBondContact O-N 3.08Å
459	E	38.3	Very low	49.5	Very low	251 Å²	251	113.7 Å²	113.7	100%	1.173	53%	0.532	S	S	*	.			trans	-54.8	0	160.9	-76.3	-171.5	164.1	0	0	110.2	E457	E457-E459 PolarHBondContact O-N 3.13Å

Retrieved 459 of 459 residues in 349.1 ms (Link to these results)

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