A0A096NCS8_PAPAN Loading...

Cleavage stimulation factor subunit 2

AlphaFold DB (A0A5S6RDF4), UniProt , Accession A0A096NCS8, Species PAPAN (Papio anubis, Olive baboon), Gene CSTF2, Length 597 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	36.2	Very low	53.8	Low	248 Å²	248	117.3 Å²	117.3	100%	1.222	70%	0.702	S	S	*	*				0	158.2	0	-77.3	178.1	168.3	0	0	108.5
2	A	40.3	Very low	55.8	Low	88 Å²	88	110.6 Å²	110.6	73%	0.727	66%	0.66	S	S	*	*			trans	-73	128.9	-169.5	0	0	0	0	0	112.8	L4	A2-L4 HydrophobicContact CB-CG 4.32Å; A2-L4 PolarHBondContact O-N 2.81Å
3	G	36.2	Very low	57.8	Low	78 Å²	78	112.5 Å²	112.5	80%	0.804	65%	0.649	S	S	*	*			trans	-89	75.4	161.4	0	0	0	0	0	109.7	T5	G3-T5 PolarHBondContact O-N 3.42Å; G3-T5 VanDerWaalsContact O-N 3.13Å
4	L	42.9	Very low	59.6	Low	161 Å²	161	106.3 Å²	106.3	84%	0.843	62%	0.615	S	S	*	*			trans	-71.8	102.9	170.8	-76.8	170.4	0	0	0	108.5	A2 V6	A2-L4 HydrophobicContact CB-CG 4.32Å; A2-L4 PolarHBondContact O-N 2.81Å; L4-V6 PolarHBondContact O-N 3.26Å
5	T	50.3	Low	61.3	Low	119 Å²	119	102.1 Å²	102.1	73%	0.73	59%	0.589	S	S	*	*			trans	-61.8	119.8	166.3	40.1	0	0	0	0	108.5	G3 R7	G3-T5 PolarHBondContact O-N 3.42Å; G3-T5 VanDerWaalsContact O-N 3.13Å; T5-R7 VanDerWaalsContact C-N 3.31Å; T5-R7 PolarHBondContact O-N 3.04Å
6	V	47.6	Very low	63.1	Low	140 Å²	140	100.6 Å²	100.6	85%	0.848	57%	0.571	S	S	*	*			trans	-72.8	90.5	175.8	60.4	0	0	0	0	108.6	L4	L4-V6 PolarHBondContact O-N 3.26Å
7	R	56.6	Low	64.7	Low	139 Å²	139	95.5 Å²	95.5	53%	0.525	54%	0.543	S	S	.	.			trans	-67.8	134.8	172.8	-62.6	165	85.1	174.6	7.6	108.1	T5 L15	T5-R7 VanDerWaalsContact C-N 3.31Å; T5-R7 PolarHBondContact O-N 3.04Å; R7-L15 VanDerWaalsContact NH2-CD1 3.28Å
8	D	68.8	Low	66.3	Low	110 Å²	110	90.2 Å²	90.2	59%	0.588	51%	0.513	S	S	*	.			trans	-55.6	128.6	180	-62.4	-91.8	0	0	0	110.9	A10 V11 D12	D8-A10 PolarHBondContact O-N 3.15Å; D8-V11 HydrophobicContact CB-CB 4.33Å; D8-V11 HydrophobicContact CB-CG2 4.04Å; D8-V11 PolarHBondContact O-N 2.82Å; D8-D12 PolarHBondContact O-N 2.69Å
9	P	68.4	Low	67.7	Low	106 Å²	106	88.2 Å²	88.2	69%	0.688	50%	0.498	S	S	*	.	H	α-helix	trans	-63.9	-20.6	-173.2	24.3	-33.9	0	0	0	112.7	R13	P9-R13 WeakPolarHBondContact O-CB 3.45Å; P9-R13 PolarHBondContact O-N 3.48Å
10	A	70.3	Confident	69	Low	62 Å²	62	83.8 Å²	83.8	51%	0.512	47%	0.473	S	S	.	.	H	α-helix	trans	-73.3	-39.6	171.9	0	0	0	0	0	112.9	D8 S14	D8-A10 PolarHBondContact O-N 3.15Å; A10-S14 WeakPolarHBondContact O-CB 3.22Å; A10-S14 PolarHBondContact O-N 2.83Å; A10-S14 PolarHBondContact O-OG 3.01Å
11	V	74.1	Confident	70	Confident	39 Å²	39	79.9 Å²	79.9	24%	0.236	45%	0.452	C	S	.	.	H	α-helix	trans	-71.1	-47	176.4	178.2	0	0	0	0	109.6	D8 R13 S14 L15	D8-V11 HydrophobicContact CB-CB 4.33Å; D8-V11 HydrophobicContact CB-CG2 4.04Å; D8-V11 PolarHBondContact O-N 2.82Å; V11-R13 VanDerWaalsContact C-N 3.33Å; V11-R13 PolarHBondContact O-N 3.09Å; V11-S14 WeakPolarHBondContact O-CB 3.26Å; V11-S14 PolarHBondContact O-N 3.49Å; V11-S14 VanDerWaalsContact O-N 3.1Å; V11-L15 HydrophobicContact CG1-CD1 4.06Å; V11-L15 HydrophobicContact CG1-CG 4.37Å; V11-L15 WeakPolarHBondContact O-CB 3.4Å; V11-L15 VanDerWaalsContact O-CG 3.3Å; V11-L15 WeakPolarHBondContact O-CG 3.43Å; V11-L15 PolarHBondContact O-N 3.49Å
12	D	77.9	Confident	72.7	Confident	37 Å²	37	72 Å²	72	20%	0.198	42%	0.415	C	S	.	.	H	α-helix	trans	-59.9	-40.4	176.8	-178.1	-92.1	0	0	0	112.5	D8 L15 R16	D8-D12 PolarHBondContact O-N 2.69Å; D12-L15 PolarHBondContact O-N 3.48Å; D12-R16 WeakPolarHBondContact O-CG 3.4Å; D12-R16 PolarHBondContact O-N 2.92Å; D12-R16 IonicContact OD1-CZ 2.68Å; D12-R16 IonicContact OD1-NE 2.7Å; D12-R16 PolarHBondContact OD1-NE 2.79Å; D12-R16 IonicContact OD1-NH2 2.85Å; D12-R16 PolarHBondContact OD1-NH2 3.09Å
13	R	81.9	Confident	75.1	Confident	135 Å²	135	67.9 Å²	67.9	51%	0.509	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-40.1	172.2	-172.8	174.7	-165.8	165	15.5	112.8	P9 V11 L15 R16 S17 E63	P9-R13 WeakPolarHBondContact O-CB 3.45Å; P9-R13 PolarHBondContact O-N 3.48Å; V11-R13 VanDerWaalsContact C-N 3.33Å; V11-R13 PolarHBondContact O-N 3.09Å; R13-L15 VanDerWaalsContact C-N 3.34Å; R13-R16 PolarHBondContact O-N 3.29Å; R13-S17 WeakPolarHBondContact O-CB 3.44Å; R13-S17 PolarHBondContact O-N 3.26Å; R13-S17 PolarHBondContact O-OG 2.91Å; R13-E63 WeakPolarHBondContact CG-OE2 3.39Å; R13-E63 IonicContact CZ-OE1 3.67Å; R13-E63 IonicContact CZ-OE2 3.74Å; R13-E63 VanDerWaalsContact NE-CD 3.31Å; R13-E63 IonicContact NE-OE1 2.7Å; R13-E63 PolarHBondContact NE-OE1 3.32Å; R13-E63 IonicContact NE-OE2 2.74Å; R13-E63 PolarHBondContact NE-OE2 2.82Å; R13-E63 IonicContact NH2-OE1 2.74Å; R13-E63 PolarHBondContact NH2-OE1 2.76Å; R13-E63 IonicContact NH2-OE2 3.48Å; R13-E63 PolarHBondContact NH2-OE2 2.96Å
14	S	82.5	Confident	77.6	Confident	26 Å²	26	64.5 Å²	64.5	18%	0.182	34%	0.344	C	S	.	.	H	α-helix	trans	-67.7	-34.7	177	-58.6	0	0	0	0	112.3	A10 V11 S17	A10-S14 WeakPolarHBondContact O-CB 3.22Å; A10-S14 PolarHBondContact O-N 2.83Å; A10-S14 PolarHBondContact O-OG 3.01Å; V11-S14 WeakPolarHBondContact O-CB 3.26Å; V11-S14 PolarHBondContact O-N 3.49Å; V11-S14 VanDerWaalsContact O-N 3.1Å; S14-S17 PolarHBondContact O-N 3.03Å
15	L	85.6	Confident	79.6	Confident	43 Å²	43	63.9 Å²	63.9	23%	0.225	33%	0.332	C	S	.	.	H	α-helix	trans	-68.2	-39.3	173.9	-76.5	175.4	0	0	0	112.2	R7 V11 D12 R13 S17 Q67	R7-L15 VanDerWaalsContact NH2-CD1 3.28Å; V11-L15 HydrophobicContact CG1-CD1 4.06Å; V11-L15 HydrophobicContact CG1-CG 4.37Å; V11-L15 WeakPolarHBondContact O-CB 3.4Å; V11-L15 VanDerWaalsContact O-CG 3.3Å; V11-L15 WeakPolarHBondContact O-CG 3.43Å; V11-L15 PolarHBondContact O-N 3.49Å; D12-L15 PolarHBondContact O-N 3.48Å; R13-L15 VanDerWaalsContact C-N 3.34Å; L15-S17 PolarHBondContact O-N 2.8Å; L15-Q67 PolarHBondContact O-NE2 2.97Å
16	R	89.8	Confident	81.3	Confident	78 Å²	78	66.3 Å²	66.3	29%	0.294	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	2.9	172.4	-68.5	-167.9	-83.2	159.4	-2	114.5	D12 R13 Y64 Q65 Q67	D12-R16 WeakPolarHBondContact O-CG 3.4Å; D12-R16 PolarHBondContact O-N 2.92Å; D12-R16 IonicContact OD1-CZ 2.68Å; D12-R16 IonicContact OD1-NE 2.7Å; D12-R16 PolarHBondContact OD1-NE 2.79Å; D12-R16 IonicContact OD1-NH2 2.85Å; D12-R16 PolarHBondContact OD1-NH2 3.09Å; R13-R16 PolarHBondContact O-N 3.29Å; R16-Y64 PolarHBondContact O-N 3.12Å; R16-Q65 WeakPolarHBondContact CD-O 3.42Å; R16-Q65 PolarHBondContact NH1-O 3.42Å; R16-Q67 HydrophobicContact CG-CB 4.38Å
17	S	90.6	Very high	83.1	Confident	15 Å²	15	60.1 Å²	60.1	11%	0.105	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.2	-177.9	-65.2	0	0	0	0	112.4	R13 S14 L15 C62 A92	R13-S17 WeakPolarHBondContact O-CB 3.44Å; R13-S17 PolarHBondContact O-N 3.26Å; R13-S17 PolarHBondContact O-OG 2.91Å; S14-S17 PolarHBondContact O-N 3.03Å; L15-S17 PolarHBondContact O-N 2.8Å; S17-C62 CarbonylContact C-O 3.5Å; S17-C62 WeakPolarHBondContact CA-O 3.24Å; S17-A92 VanDerWaalsContact O-CB 3.26Å; S17-A92 WeakPolarHBondContact O-CB 3.23Å; S17-A92 PolarHBondContact O-N 2.91Å; S17-A92 VanDerWaalsContact O-N 3.08Å
18	V	93.1	Very high	84.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.1	-174.5	-178.5	0	0	0	0	109.3	F36 F61 C62 Y64 A70 M74 V89 D90	V18-F36 HydrophobicContact CG1-CE1 4.44Å; V18-F61 CarbonylContact O-C 3.58Å; V18-F61 WeakPolarHBondContact O-CA 3.34Å; V18-C62 HydrophobicContact CB-CB 4.48Å; V18-C62 PolarHBondContact N-O 3.29Å; V18-C62 PolarHBondContact O-N 3.28Å; V18-Y64 HydrophobicContact CG2-CD2 3.94Å; V18-Y64 HydrophobicContact CG2-CE2 3.98Å; V18-A70 HydrophobicContact CG2-CB 3.57Å; V18-M74 HydrophobicContact CG1-CG 3.85Å; V18-M74 HydrophobicContact CG2-CG 4.44Å; V18-V89 HydrophobicContact CG1-CG1 3.23Å; V18-D90 CarbonylContact C-O 3.5Å; V18-D90 WeakPolarHBondContact CG1-O 3.08Å
19	F	93.4	Very high	85.5	Confident	51 Å²	51	54 Å²	54	22%	0.224	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	135.5	172.7	168.9	-91.5	0	0	0	109.2	Y59 F61 V89 D90 A92	F19-Y59 AromaticContact CE2-CD2 3.74Å; F19-Y59 HydrophobicContact CE2-CD2 3.74Å; F19-Y59 HydrophobicContact CE2-CG 4.04Å; F19-Y59 HydrophobicContact CZ-CG 4.37Å; F19-F61 HydrophobicContact CB-CD1 4.42Å; F19-F61 HydrophobicContact CB-CE1 4.37Å; F19-F61 HydrophobicContact CD2-CD1 4.35Å; F19-F61 AromaticContact CD2-CE1 3.8Å; F19-F61 HydrophobicContact CD2-CE1 3.8Å; F19-F61 HydrophobicContact CD2-CZ 4.17Å; F19-V89 WeakPolarHBondContact O-CA 3.41Å; F19-D90 HydrophobicContact CB-CB 4.29Å; F19-D90 HydrophobicContact CD1-CB 3.86Å; F19-D90 PolarHBondContact N-O 3.44Å; F19-D90 PolarHBondContact O-N 2.9Å; F19-A92 HydrophobicContact CB-CB 4.43Å
20	V	93	Very high	86.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.4	178.2	-169.2	0	0	0	0	108.4	I23 F36 F45 Y59 G60 C62 R88	V20-I23 HydrophobicContact CB-CD1 4.09Å; V20-I23 HydrophobicContact CG1-CD1 3.8Å; V20-I23 HydrophobicContact CG1-CG1 3.93Å; V20-F36 HydrophobicContact CB-CZ 4.15Å; V20-F36 HydrophobicContact CG1-CE2 3.98Å; V20-F36 HydrophobicContact CG1-CZ 3.61Å; V20-F36 HydrophobicContact CG2-CD1 4.31Å; V20-F36 HydrophobicContact CG2-CE1 3.42Å; V20-F36 VanDerWaalsContact CG2-CE1 3.42Å; V20-F36 HydrophobicContact CG2-CE2 4.22Å; V20-F36 HydrophobicContact CG2-CZ 3.37Å; V20-F45 HydrophobicContact CB-CZ 4.34Å; V20-F45 HydrophobicContact CG2-CE2 4.12Å; V20-F45 HydrophobicContact CG2-CZ 4.19Å; V20-Y59 CarbonylContact O-C 3.58Å; V20-Y59 WeakPolarHBondContact O-CA 3.26Å; V20-Y59 VanDerWaalsContact O-CB 3.29Å; V20-Y59 WeakPolarHBondContact O-CB 3.41Å; V20-G60 PolarHBondContact N-O 3.18Å; V20-G60 PolarHBondContact O-N 2.67Å; V20-C62 HydrophobicContact CG2-CB 4.17Å; V20-R88 CarbonylContact C-O 3.56Å; V20-R88 WeakPolarHBondContact CA-O 3.48Å
21	G	91.5	Very high	87.5	Confident	3 Å²	3	57.4 Å²	57.4	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	175	-176.6	0	0	0	0	0	113.2	I23 G58 R88	G21-I23 PolarHBondContact O-N 2.78Å; G21-G58 CarbonylContact C-O 3.58Å; G21-R88 PolarHBondContact N-O 3.29Å; G21-R88 PolarHBondContact O-N 2.91Å
22	N	91.7	Very high	88.3	Confident	82 Å²	82	55.6 Å²	55.6	44%	0.439	26%	0.26	S	S	.	.	S	Bend	trans	57.7	24.2	-171.4	-162.8	37.6	0	0	0	114.1	G58 A86	N22-G58 PolarHBondContact N-O 3.08Å; N22-G58 VanDerWaalsContact N-O 3.12Å; N22-A86 PolarHBondContact ND2-O 2.96Å
23	I	91.1	Very high	88.9	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	27%	0.271	C	S	.	.			trans	-64.7	131.8	178.9	-56.3	176.6	0	0	0	108.8	V20 G21 A27 L32 L47 G58 L87	V20-I23 HydrophobicContact CB-CD1 4.09Å; V20-I23 HydrophobicContact CG1-CD1 3.8Å; V20-I23 HydrophobicContact CG1-CG1 3.93Å; G21-I23 PolarHBondContact O-N 2.78Å; I23-A27 HydrophobicContact CG2-CB 3.47Å; I23-A27 VanDerWaalsContact CG2-CB 3.47Å; I23-L32 HydrophobicContact CD1-CD1 4.04Å; I23-L32 HydrophobicContact CD1-CD2 4.47Å; I23-L32 HydrophobicContact CG1-CD2 4.49Å; I23-L32 HydrophobicContact CG2-CD1 3.79Å; I23-L32 HydrophobicContact CG2-CD2 4.14Å; I23-L47 HydrophobicContact CD1-CD1 3.52Å; I23-L47 HydrophobicContact CG2-CD1 4.22Å; I23-G58 WeakPolarHBondContact CB-O 3.17Å; I23-G58 PolarHBondContact N-O 3.33Å; I23-G58 WeakPolarHBondContact O-CA 3.5Å; I23-L87 HydrophobicContact CG1-CD2 4.2Å
24	P	88.1	Confident	89.3	Confident	7 Å²	7	58 Å²	58	5%	0.045	28%	0.279	C	S	.	.			trans	-66.9	146	173.5	24.9	-29.2	0	0	0	111	E26 A27 F82	P24-E26 PolarHBondContact O-N 3.12Å; P24-E26 VanDerWaalsContact O-N 3.09Å; P24-A27 HydrophobicContact CG-CB 4.22Å; P24-A27 VanDerWaalsContact O-CB 3.22Å; P24-A27 WeakPolarHBondContact O-CB 3.19Å; P24-A27 PolarHBondContact O-N 2.88Å; P24-F82 HydrophobicContact CG-CD1 3.59Å; P24-F82 HydrophobicContact CG-CE1 3.91Å
25	Y	86.3	Confident	89.7	Confident	147 Å²	147	58 Å²	58	58%	0.576	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.5	-173.9	-58.4	-64.1	0	0	0	114.6	P56	Y25-P56 HydrophobicContact CD1-CG 4.3Å; Y25-P56 WeakPolarHBondContact CD1-O 3.47Å; Y25-P56 WeakPolarHBondContact CE1-O 3.43Å; Y25-P56 WeakPolarHBondContact O-CG 3.49Å
26	E	84.8	Confident	89.9	Confident	171 Å²	171	55.9 Å²	55.9	80%	0.799	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-4	176.8	-65.4	164	103	0	0	112.8	P24	P24-E26 PolarHBondContact O-N 3.12Å; P24-E26 VanDerWaalsContact O-N 3.09Å
27	A	85	Confident	90	Very high	9 Å²	9	55.1 Å²	55.1	7%	0.074	27%	0.272	C	S	.	.			trans	-67.8	130.7	177.3	0	0	0	0	0	111.7	I23 P24 L32 F82	I23-A27 HydrophobicContact CG2-CB 3.47Å; I23-A27 VanDerWaalsContact CG2-CB 3.47Å; P24-A27 HydrophobicContact CG-CB 4.22Å; P24-A27 VanDerWaalsContact O-CB 3.22Å; P24-A27 WeakPolarHBondContact O-CB 3.19Å; P24-A27 PolarHBondContact O-N 2.88Å; A27-L32 HydrophobicContact CB-CD1 4.01Å; A27-L32 HydrophobicContact CB-CG 4.28Å; A27-F82 HydrophobicContact CB-CD1 4.43Å; A27-F82 HydrophobicContact CB-CE1 3.66Å
28	T	88.1	Confident	90	Very high	47 Å²	47	61.1 Å²	61.1	29%	0.288	30%	0.298	S	S	.	.			trans	-87.9	154.1	165	76.6	0	0	0	0	111.3	E30 Q31 L32	T28-E30 PolarHBondContact O-N 3.1Å; T28-Q31 PolarHBondContact O-N 3.39Å; T28-Q31 WeakPolarHBondContact OG1-CG 3.29Å; T28-Q31 PolarHBondContact OG1-N 3.17Å; T28-L32 WeakPolarHBondContact O-CG 3.37Å; T28-L32 PolarHBondContact O-N 2.93Å
29	E	88.6	Confident	89.8	Confident	73 Å²	73	62.9 Å²	62.9	34%	0.341	31%	0.309	S	S	.	.	H	α-helix	trans	-58.1	-32	172.4	178.4	158.1	103.7	0	0	112.3	K33 F45 R46 L47	E29-K33 VanDerWaalsContact O-CB 3.23Å; E29-K33 WeakPolarHBondContact O-CB 3.32Å; E29-K33 PolarHBondContact O-N 3.27Å; E29-F45 HydrophobicContact CG-CB 4.08Å; E29-F45 HydrophobicContact CG-CD1 3.78Å; E29-F45 HydrophobicContact CG-CG 4.28Å; E29-R46 VanDerWaalsContact OE2-CA 3.28Å; E29-R46 WeakPolarHBondContact OE2-CA 3.39Å; E29-L47 PolarHBondContact OE2-N 3.24Å
30	E	89.8	Confident	89.6	Confident	154 Å²	154	61.2 Å²	61.2	72%	0.72	31%	0.306	S	S	*	.	H	α-helix	trans	-67.2	-45.1	177.9	-60.6	160.4	110.3	0	0	112	T28 L32 K33 D34	T28-E30 PolarHBondContact O-N 3.1Å; E30-L32 VanDerWaalsContact C-N 3.35Å; E30-K33 PolarHBondContact O-N 2.87Å; E30-D34 PolarHBondContact O-N 2.82Å
31	Q	90.1	Very high	89.5	Confident	87 Å²	87	64.2 Å²	64.2	41%	0.407	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-41.1	178	-67.9	158.8	8.7	0	0	111.2	T28 D34 I35 F82	T28-Q31 PolarHBondContact O-N 3.39Å; T28-Q31 WeakPolarHBondContact OG1-CG 3.29Å; T28-Q31 PolarHBondContact OG1-N 3.17Å; Q31-D34 PolarHBondContact O-N 2.82Å; Q31-I35 WeakPolarHBondContact O-CD1 3.17Å; Q31-I35 VanDerWaalsContact O-CG1 3.25Å; Q31-I35 WeakPolarHBondContact O-CG1 3.22Å; Q31-I35 PolarHBondContact O-N 3.29Å; Q31-I35 VanDerWaalsContact O-N 3.11Å; Q31-F82 HydrophobicContact CB-CZ 4.07Å
32	L	90.7	Very high	89.6	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.6	-40.8	175	-67.2	160.6	0	0	0	111.3	I23 A27 T28 E30 D34 I35 F36 F45 L47 L87	I23-L32 HydrophobicContact CD1-CD1 4.04Å; I23-L32 HydrophobicContact CD1-CD2 4.47Å; I23-L32 HydrophobicContact CG1-CD2 4.49Å; I23-L32 HydrophobicContact CG2-CD1 3.79Å; I23-L32 HydrophobicContact CG2-CD2 4.14Å; A27-L32 HydrophobicContact CB-CD1 4.01Å; A27-L32 HydrophobicContact CB-CG 4.28Å; T28-L32 WeakPolarHBondContact O-CG 3.37Å; T28-L32 PolarHBondContact O-N 2.93Å; E30-L32 VanDerWaalsContact C-N 3.35Å; L32-D34 VanDerWaalsContact C-N 3.34Å; L32-D34 PolarHBondContact O-N 2.8Å; L32-I35 PolarHBondContact O-N 2.91Å; L32-F36 WeakPolarHBondContact O-CB 3.48Å; L32-F36 WeakPolarHBondContact O-CD2 3.25Å; L32-F36 PolarHBondContact O-N 3.44Å; L32-F45 HydrophobicContact CB-CD2 4.44Å; L32-F45 HydrophobicContact CB-CE1 4.04Å; L32-F45 HydrophobicContact CB-CE2 3.83Å; L32-F45 HydrophobicContact CB-CZ 3.61Å; L32-F45 HydrophobicContact CD1-CE1 3.91Å; L32-F45 HydrophobicContact CD1-CZ 3.91Å; L32-F45 HydrophobicContact CG-CZ 4.26Å; L32-L47 HydrophobicContact CD1-CD1 3.8Å; L32-L87 HydrophobicContact CD2-CD1 4.44Å; L32-L87 HydrophobicContact CD2-CD2 4.42Å
33	K	91.2	Very high	89.5	Confident	99 Å²	99	64.6 Å²	64.6	43%	0.43	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-40.4	176	-175.6	179	179.3	-177.3	0	112	E29 E30 F36 S37 V42 F45	E29-K33 VanDerWaalsContact O-CB 3.23Å; E29-K33 WeakPolarHBondContact O-CB 3.32Å; E29-K33 PolarHBondContact O-N 3.27Å; E30-K33 PolarHBondContact O-N 2.87Å; K33-F36 PolarHBondContact O-N 2.93Å; K33-S37 WeakPolarHBondContact O-CB 3.12Å; K33-S37 PolarHBondContact O-N 3.4Å; K33-V42 HydrophobicContact CG-CB 4.3Å; K33-V42 HydrophobicContact CG-CG1 4.18Å; K33-F45 HydrophobicContact CB-CB 4.45Å
34	D	90.8	Very high	89.3	Confident	123 Å²	123	67 Å²	67	66%	0.658	35%	0.347	S	S	*	.	H	α-helix	trans	-61	-52.7	175.3	-171	-106	0	0	0	111.3	E30 Q31 L32 F36 S37 E38	E30-D34 PolarHBondContact O-N 2.82Å; Q31-D34 PolarHBondContact O-N 2.82Å; L32-D34 VanDerWaalsContact C-N 3.34Å; L32-D34 PolarHBondContact O-N 2.8Å; D34-F36 PolarHBondContact O-N 3.1Å; D34-S37 WeakPolarHBondContact O-CB 3.49Å; D34-S37 PolarHBondContact O-N 3.46Å; D34-E38 PolarHBondContact O-N 3.11Å
35	I	90.6	Very high	89.5	Confident	26 Å²	26	67.2 Å²	67.2	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-57.9	-33.8	177.4	-69.8	166.7	0	0	0	112.8	Q31 L32 R80 F82 L87	Q31-I35 WeakPolarHBondContact O-CD1 3.17Å; Q31-I35 VanDerWaalsContact O-CG1 3.25Å; Q31-I35 WeakPolarHBondContact O-CG1 3.22Å; Q31-I35 PolarHBondContact O-N 3.29Å; Q31-I35 VanDerWaalsContact O-N 3.11Å; L32-I35 PolarHBondContact O-N 2.91Å; I35-R80 PolarHBondContact O-NH2 2.78Å; I35-F82 HydrophobicContact CD1-CD2 3.26Å; I35-F82 HydrophobicContact CD1-CE2 3.42Å; I35-F82 VanDerWaalsContact CD1-CE2 3.42Å; I35-F82 HydrophobicContact CD1-CG 3.98Å; I35-F82 HydrophobicContact CD1-CZ 4.24Å; I35-L87 HydrophobicContact CG2-CD1 4.45Å
36	F	90.2	Very high	89.7	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-85.7	-22.9	177.5	-83.8	-112.7	0	0	0	112.5	V18 V20 L32 K33 D34 E38 V39 V42 F45 C62 Y64 L77 L87 V89	V18-F36 HydrophobicContact CG1-CE1 4.44Å; V20-F36 HydrophobicContact CB-CZ 4.15Å; V20-F36 HydrophobicContact CG1-CE2 3.98Å; V20-F36 HydrophobicContact CG1-CZ 3.61Å; V20-F36 HydrophobicContact CG2-CD1 4.31Å; V20-F36 HydrophobicContact CG2-CE1 3.42Å; V20-F36 VanDerWaalsContact CG2-CE1 3.42Å; V20-F36 HydrophobicContact CG2-CE2 4.22Å; V20-F36 HydrophobicContact CG2-CZ 3.37Å; L32-F36 WeakPolarHBondContact O-CB 3.48Å; L32-F36 WeakPolarHBondContact O-CD2 3.25Å; L32-F36 PolarHBondContact O-N 3.44Å; K33-F36 PolarHBondContact O-N 2.93Å; D34-F36 PolarHBondContact O-N 3.1Å; F36-E38 VanDerWaalsContact C-N 3.3Å; F36-V39 PolarHBondContact O-N 3.11Å; F36-V42 HydrophobicContact CB-CG2 3.91Å; F36-F45 HydrophobicContact CD2-CE2 4.38Å; F36-F45 HydrophobicContact CG-CE2 4.35Å; F36-C62 HydrophobicContact CD1-CB 3.9Å; F36-C62 HydrophobicContact CE1-CB 4.31Å; F36-Y64 WeakPolarHBondContact CB-OH 3.28Å; F36-Y64 HydrophobicContact CD1-CE2 4.26Å; F36-Y64 VanDerWaalsContact CD1-OH 3.28Å; F36-Y64 WeakPolarHBondContact CD1-OH 3.23Å; F36-Y64 WeakPolarHBondContact O-CE1 3.35Å; F36-Y64 PolarHBondContact O-OH 3.2Å; F36-L77 HydrophobicContact CB-CD1 4.3Å; F36-L77 HydrophobicContact CD1-CD1 3.62Å; F36-L77 HydrophobicContact CD2-CD1 3.92Å; F36-L77 HydrophobicContact CE1-CD1 3.74Å; F36-L77 HydrophobicContact CE2-CD1 4.05Å; F36-L77 HydrophobicContact CG-CD1 3.7Å; F36-L77 HydrophobicContact CZ-CB 4.35Å; F36-L77 HydrophobicContact CZ-CD1 3.94Å; F36-L87 HydrophobicContact CE2-CD1 4.29Å; F36-V89 HydrophobicContact CE1-CG1 3.98Å; F36-V89 HydrophobicContact CE1-CG2 4.39Å; F36-V89 HydrophobicContact CZ-CG1 4.17Å; F36-V89 HydrophobicContact CZ-CG2 3.76Å
37	S	91.1	Very high	90	Very high	61 Å²	61	60.9 Å²	60.9	43%	0.427	32%	0.315	S	S	.	.	H	α-helix	trans	-74.1	-18.6	175.3	-166.5	0	0	0	0	113.4	K33 D34 V39 G40	K33-S37 WeakPolarHBondContact O-CB 3.12Å; K33-S37 PolarHBondContact O-N 3.4Å; D34-S37 WeakPolarHBondContact O-CB 3.49Å; D34-S37 PolarHBondContact O-N 3.46Å; S37-V39 PolarHBondContact O-N 2.8Å; S37-G40 WeakPolarHBondContact CA-O 3.43Å; S37-G40 PolarHBondContact O-N 3.12Å
38	E	90.1	Very high	90.2	Very high	141 Å²	141	61.9 Å²	61.9	66%	0.659	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.9	172.7	-170.8	-174.9	66.9	0	0	112.2	D34 F36 R80	D34-E38 PolarHBondContact O-N 3.11Å; F36-E38 VanDerWaalsContact C-N 3.3Å; E38-R80 IonicContact OE1-CZ 3.28Å; E38-R80 IonicContact OE1-NH1 3.36Å; E38-R80 PolarHBondContact OE1-NH1 3.22Å; E38-R80 IonicContact OE1-NH2 2.67Å; E38-R80 PolarHBondContact OE1-NH2 3.46Å; E38-R80 IonicContact OE2-NH1 3.09Å
39	V	88.9	Confident	90.1	Very high	38 Å²	38	65.1 Å²	65.1	23%	0.23	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-19.7	179.7	-177.3	0	0	0	0	112.5	F36 S37 A73 L77	F36-V39 PolarHBondContact O-N 3.11Å; S37-V39 PolarHBondContact O-N 2.8Å; V39-A73 HydrophobicContact CG1-CB 4.3Å; V39-L77 HydrophobicContact CG2-CD1 3.94Å; V39-L77 HydrophobicContact CG2-CD2 3.77Å; V39-L77 HydrophobicContact CG2-CG 3.83Å
40	G	89.6	Confident	90.1	Very high	15 Å²	15	63.8 Å²	63.8	16%	0.155	32%	0.324	C	S	.	.	S	Bend	trans	155.5	-177.8	173.3	0	0	0	0	0	114.2	S37 V42 Y64	S37-G40 WeakPolarHBondContact CA-O 3.43Å; S37-G40 PolarHBondContact O-N 3.12Å; G40-V42 PolarHBondContact O-N 2.79Å; G40-V42 VanDerWaalsContact O-N 3.09Å; G40-Y64 WeakPolarHBondContact O-CE1 3.25Å
41	P	91.6	Very high	89.8	Confident	64 Å²	64	68.3 Å²	68.3	42%	0.416	33%	0.334	S	S	.	.			trans	-67.8	108.6	-168.6	25.8	-34.6	0	0	0	113.5	V43 Q65	P41-V43 PolarHBondContact O-N 2.81Å; P41-Q65 HydrophobicContact CB-CB 4.45Å; P41-Q65 HydrophobicContact CG-CB 3.89Å; P41-Q65 PolarHBondContact O-N 3.42Å; P41-Q65 VanDerWaalsContact O-N 3.15Å
42	V	92.8	Very high	89.4	Confident	17 Å²	17	73 Å²	73	10%	0.103	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	114.5	172.1	179.5	0	0	0	0	110.1	K33 F36 G40 F45 Y64	K33-V42 HydrophobicContact CG-CB 4.3Å; K33-V42 HydrophobicContact CG-CG1 4.18Å; F36-V42 HydrophobicContact CB-CG2 3.91Å; G40-V42 PolarHBondContact O-N 2.79Å; G40-V42 VanDerWaalsContact O-N 3.09Å; V42-F45 HydrophobicContact CG1-CB 4.43Å; V42-Y64 HydrophobicContact CG2-CD1 4.14Å; V42-Y64 HydrophobicContact CG2-CE1 3.6Å
43	V	91.1	Very high	89.1	Confident	76 Å²	76	77.3 Å²	77.3	46%	0.461	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-43.2	176.5	172	0	0	0	0	110.8	P41 E63 Q65	P41-V43 PolarHBondContact O-N 2.81Å; V43-E63 HydrophobicContact CB-CG 4.36Å; V43-E63 PolarHBondContact N-O 2.94Å; V43-Q65 HydrophobicContact CG2-CB 4.01Å
44	S	86.7	Confident	88.7	Confident	52 Å²	52	75.1 Å²	75.1	36%	0.364	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	138.6	177.2	-171.1	0	0	0	0	110.1	E63	S44-E63 PolarHBondContact N-O 2.84Å; S44-E63 PolarHBondContact O-N 2.77Å
45	F	91.9	Very high	88.3	Confident	12 Å²	12	76 Å²	76	5%	0.053	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.7	161.4	-160.1	-77.8	0	0	0	107.2	V20 E29 L32 K33 F36 V42 L47 F61 C62	V20-F45 HydrophobicContact CB-CZ 4.34Å; V20-F45 HydrophobicContact CG2-CE2 4.12Å; V20-F45 HydrophobicContact CG2-CZ 4.19Å; E29-F45 HydrophobicContact CG-CB 4.08Å; E29-F45 HydrophobicContact CG-CD1 3.78Å; E29-F45 HydrophobicContact CG-CG 4.28Å; L32-F45 HydrophobicContact CB-CD2 4.44Å; L32-F45 HydrophobicContact CB-CE1 4.04Å; L32-F45 HydrophobicContact CB-CE2 3.83Å; L32-F45 HydrophobicContact CB-CZ 3.61Å; L32-F45 HydrophobicContact CD1-CE1 3.91Å; L32-F45 HydrophobicContact CD1-CZ 3.91Å; L32-F45 HydrophobicContact CG-CZ 4.26Å; K33-F45 HydrophobicContact CB-CB 4.45Å; F36-F45 HydrophobicContact CD2-CE2 4.38Å; F36-F45 HydrophobicContact CG-CE2 4.35Å; V42-F45 HydrophobicContact CG1-CB 4.43Å; F45-L47 HydrophobicContact CE1-CD1 4.28Å; F45-F61 CarbonylContact C-O 3.56Å; F45-F61 WeakPolarHBondContact CA-O 3.43Å; F45-C62 HydrophobicContact CD2-CB 3.67Å; F45-C62 HydrophobicContact CE2-CB 3.79Å
46	R	90.3	Very high	88.1	Confident	178 Å²	178	75.9 Å²	75.9	67%	0.672	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	103.1	174.6	-176.3	-178	179.4	-177.2	1.3	110.6	E29 G60 F61	E29-R46 VanDerWaalsContact OE2-CA 3.28Å; E29-R46 WeakPolarHBondContact OE2-CA 3.39Å; R46-G60 CarbonylContact O-C 3.57Å; R46-G60 WeakPolarHBondContact O-CA 3.36Å; R46-F61 PolarHBondContact N-O 3.09Å; R46-F61 PolarHBondContact O-N 3.42Å
47	L	90.4	Very high	87.9	Confident	6 Å²	6	80.4 Å²	80.4	3%	0.031	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.8	168.2	-158.7	70.5	0	0	0	110.3	I23 E29 L32 F45 Y49 P56	I23-L47 HydrophobicContact CD1-CD1 3.52Å; I23-L47 HydrophobicContact CG2-CD1 4.22Å; E29-L47 PolarHBondContact OE2-N 3.24Å; L32-L47 HydrophobicContact CD1-CD1 3.8Å; F45-L47 HydrophobicContact CE1-CD1 4.28Å; L47-Y49 HydrophobicContact CB-CE2 3.87Å; L47-Y49 HydrophobicContact CD2-CE1 4.05Å; L47-Y49 HydrophobicContact CD2-CE2 4.32Å; L47-Y49 HydrophobicContact CG-CE2 4.42Å; L47-P56 HydrophobicContact CD2-CB 3.72Å; L47-P56 HydrophobicContact CG-CB 4.43Å
48	V	89.1	Confident	87.8	Confident	30 Å²	30	77.9 Å²	77.9	18%	0.182	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.7	176.8	-175.2	0	0	0	0	109.7	K57 Y59 F61	V48-K57 HydrophobicContact CG1-CD 3.87Å; V48-K57 HydrophobicContact CG1-CG 4.43Å; V48-K57 WeakPolarHBondContact O-CB 3.5Å; V48-K57 PolarHBondContact O-N 2.94Å; V48-Y59 HydrophobicContact CB-CD2 4Å; V48-Y59 HydrophobicContact CB-CE2 3.74Å; V48-Y59 HydrophobicContact CG1-CE2 3.92Å; V48-Y59 HydrophobicContact CG2-CD2 3.83Å; V48-Y59 HydrophobicContact CG2-CE2 3.62Å; V48-Y59 PolarHBondContact N-O 3.32Å; V48-F61 HydrophobicContact CG2-CD2 4.01Å; V48-F61 HydrophobicContact CG2-CE2 3.86Å
49	Y	87.7	Confident	87.8	Confident	115 Å²	115	74.4 Å²	74.4	45%	0.451	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	147.4	173.1	-58	-93	0	0	0	110.9	L47 P56	L47-Y49 HydrophobicContact CB-CE2 3.87Å; L47-Y49 HydrophobicContact CD2-CE1 4.05Å; L47-Y49 HydrophobicContact CD2-CE2 4.32Å; L47-Y49 HydrophobicContact CG-CE2 4.42Å; Y49-P56 HydrophobicContact CD1-CB 4.1Å; Y49-P56 HydrophobicContact CE1-CB 4.1Å
50	D	87	Confident	88	Confident	46 Å²	46	72.6 Å²	72.6	25%	0.246	36%	0.36	C	S	.	.			trans	-73.1	135.5	171.4	-178.3	-108	0	0	0	110.6	E52 T53 G54 K55 K57	D50-E52 PolarHBondContact OD1-N 3.12Å; D50-T53 WeakPolarHBondContact CB-OG1 3.47Å; D50-T53 WeakPolarHBondContact OD1-CB 3.49Å; D50-T53 PolarHBondContact OD1-N 3.11Å; D50-T53 PolarHBondContact OD1-OG1 2.83Å; D50-G54 VanDerWaalsContact O-CA 3.24Å; D50-G54 WeakPolarHBondContact O-CA 3.41Å; D50-G54 PolarHBondContact O-N 3.04Å; D50-K55 WeakPolarHBondContact CB-O 3.48Å; D50-K55 PolarHBondContact N-O 3.14Å; D50-K57 HydrophobicContact CB-CD 4.43Å; D50-K57 HydrophobicContact CB-CG 3.94Å
51	R	83.1	Confident	88.2	Confident	249 Å²	249	75.8 Å²	75.8	94%	0.94	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-15.2	-170.2	-62.5	-171.9	75.6	-167.8	3.7	114
52	E	83.2	Confident	88.2	Confident	186 Å²	186	72.7 Å²	72.7	87%	0.869	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-40.1	-178.3	-62.8	-176.2	80.2	0	0	111.3	D50	D50-E52 PolarHBondContact OD1-N 3.12Å
53	T	84.1	Confident	88.2	Confident	89 Å²	89	73.4 Å²	73.4	55%	0.546	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-13.7	-179.1	64.7	0	0	0	0	114.3	D50 K55	D50-T53 WeakPolarHBondContact CB-OG1 3.47Å; D50-T53 WeakPolarHBondContact OD1-CB 3.49Å; D50-T53 PolarHBondContact OD1-N 3.11Å; D50-T53 PolarHBondContact OD1-OG1 2.83Å; T53-K55 PolarHBondContact O-N 2.93Å; T53-K55 VanDerWaalsContact O-N 3.15Å; T53-K55 PolarHBondContact OG1-N 3.01Å
54	G	82.6	Confident	88.3	Confident	53 Å²	53	69.8 Å²	69.8	55%	0.546	33%	0.33	S	S	.	.			trans	69.6	-0.9	-174.9	0	0	0	0	0	114.9	D50	D50-G54 VanDerWaalsContact O-CA 3.24Å; D50-G54 WeakPolarHBondContact O-CA 3.41Å; D50-G54 PolarHBondContact O-N 3.04Å
55	K	82.3	Confident	88.5	Confident	142 Å²	142	72.4 Å²	72.4	62%	0.617	34%	0.337	S	S	*	.			trans	-80.9	146.8	-175.5	-64.1	-176	179.9	-176.5	0	111.3	D50 T53 K57	D50-K55 WeakPolarHBondContact CB-O 3.48Å; D50-K55 PolarHBondContact N-O 3.14Å; T53-K55 PolarHBondContact O-N 2.93Å; T53-K55 VanDerWaalsContact O-N 3.15Å; T53-K55 PolarHBondContact OG1-N 3.01Å; K55-K57 PolarHBondContact O-N 2.89Å
56	P	86.1	Confident	88.4	Confident	24 Å²	24	75.6 Å²	75.6	16%	0.156	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	137.9	171.7	24.5	-31.8	0	0	0	110.4	Y25 L47 Y49 G58	Y25-P56 HydrophobicContact CD1-CG 4.3Å; Y25-P56 WeakPolarHBondContact CD1-O 3.47Å; Y25-P56 WeakPolarHBondContact CE1-O 3.43Å; Y25-P56 WeakPolarHBondContact O-CG 3.49Å; L47-P56 HydrophobicContact CD2-CB 3.72Å; L47-P56 HydrophobicContact CG-CB 4.43Å; Y49-P56 HydrophobicContact CD1-CB 4.1Å; Y49-P56 HydrophobicContact CE1-CB 4.1Å; P56-G58 PolarHBondContact O-N 2.89Å
57	K	86.6	Confident	88.4	Confident	95 Å²	95	69.3 Å²	69.3	41%	0.413	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	5.3	-178.9	-62.1	-172.2	74.6	-167.4	0	114	V48 D50 K55 Y59	V48-K57 HydrophobicContact CG1-CD 3.87Å; V48-K57 HydrophobicContact CG1-CG 4.43Å; V48-K57 WeakPolarHBondContact O-CB 3.5Å; V48-K57 PolarHBondContact O-N 2.94Å; D50-K57 HydrophobicContact CB-CD 4.43Å; D50-K57 HydrophobicContact CB-CG 3.94Å; K55-K57 PolarHBondContact O-N 2.89Å; K57-Y59 VanDerWaalsContact C-N 3.29Å; K57-Y59 HydrophobicContact CB-CD1 3.67Å; K57-Y59 HydrophobicContact CB-CE1 3.43Å; K57-Y59 VanDerWaalsContact CB-CE1 3.43Å; K57-Y59 HydrophobicContact CD-CE1 3.86Å; K57-Y59 HydrophobicContact CG-CE1 4.27Å; K57-Y59 PolarHBondContact NZ-OH 2.56Å; K57-Y59 WeakPolarHBondContact O-CD1 3.32Å; K57-Y59 PolarHBondContact O-N 2.78Å
58	G	88.1	Confident	88.4	Confident	8 Å²	8	76.4 Å²	76.4	8%	0.082	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.7	17.9	-174.4	0	0	0	0	0	114.5	G21 N22 I23 P56	G21-G58 CarbonylContact C-O 3.58Å; N22-G58 PolarHBondContact N-O 3.08Å; N22-G58 VanDerWaalsContact N-O 3.12Å; I23-G58 WeakPolarHBondContact CB-O 3.17Å; I23-G58 PolarHBondContact N-O 3.33Å; I23-G58 WeakPolarHBondContact O-CA 3.5Å; P56-G58 PolarHBondContact O-N 2.89Å
59	Y	91.6	Very high	88.5	Confident	68 Å²	68	76 Å²	76	27%	0.267	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161.8	172.1	69.9	-89	0	0	0	113	F19 V20 V48 K57 F61	F19-Y59 AromaticContact CE2-CD2 3.74Å; F19-Y59 HydrophobicContact CE2-CD2 3.74Å; F19-Y59 HydrophobicContact CE2-CG 4.04Å; F19-Y59 HydrophobicContact CZ-CG 4.37Å; V20-Y59 CarbonylContact O-C 3.58Å; V20-Y59 WeakPolarHBondContact O-CA 3.26Å; V20-Y59 VanDerWaalsContact O-CB 3.29Å; V20-Y59 WeakPolarHBondContact O-CB 3.41Å; V48-Y59 HydrophobicContact CB-CD2 4Å; V48-Y59 HydrophobicContact CB-CE2 3.74Å; V48-Y59 HydrophobicContact CG1-CE2 3.92Å; V48-Y59 HydrophobicContact CG2-CD2 3.83Å; V48-Y59 HydrophobicContact CG2-CE2 3.62Å; V48-Y59 PolarHBondContact N-O 3.32Å; K57-Y59 VanDerWaalsContact C-N 3.29Å; K57-Y59 HydrophobicContact CB-CD1 3.67Å; K57-Y59 HydrophobicContact CB-CE1 3.43Å; K57-Y59 VanDerWaalsContact CB-CE1 3.43Å; K57-Y59 HydrophobicContact CD-CE1 3.86Å; K57-Y59 HydrophobicContact CG-CE1 4.27Å; K57-Y59 PolarHBondContact NZ-OH 2.56Å; K57-Y59 WeakPolarHBondContact O-CD1 3.32Å; K57-Y59 PolarHBondContact O-N 2.78Å; Y59-F61 HydrophobicContact CD2-CE2 4.48Å; Y59-F61 HydrophobicContact CE2-CE2 4.38Å
60	G	92.4	Very high	88.7	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	-179.5	-178.1	0	0	0	0	0	112.1	V20 R46	V20-G60 PolarHBondContact N-O 3.18Å; V20-G60 PolarHBondContact O-N 2.67Å; R46-G60 CarbonylContact O-C 3.57Å; R46-G60 WeakPolarHBondContact O-CA 3.36Å
61	F	92.8	Very high	88.8	Confident	81 Å²	81	72.5 Å²	72.5	36%	0.355	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.5	177.1	-61.7	-84	0	0	0	109.9	V18 F19 F45 R46 V48 Y59 A92	V18-F61 CarbonylContact O-C 3.58Å; V18-F61 WeakPolarHBondContact O-CA 3.34Å; F19-F61 HydrophobicContact CB-CD1 4.42Å; F19-F61 HydrophobicContact CB-CE1 4.37Å; F19-F61 HydrophobicContact CD2-CD1 4.35Å; F19-F61 AromaticContact CD2-CE1 3.8Å; F19-F61 HydrophobicContact CD2-CE1 3.8Å; F19-F61 HydrophobicContact CD2-CZ 4.17Å; F45-F61 CarbonylContact C-O 3.56Å; F45-F61 WeakPolarHBondContact CA-O 3.43Å; R46-F61 PolarHBondContact N-O 3.09Å; R46-F61 PolarHBondContact O-N 3.42Å; V48-F61 HydrophobicContact CG2-CD2 4.01Å; V48-F61 HydrophobicContact CG2-CE2 3.86Å; Y59-F61 HydrophobicContact CD2-CE2 4.48Å; Y59-F61 HydrophobicContact CE2-CE2 4.38Å; F61-A92 HydrophobicContact CD1-CB 3.82Å; F61-A92 HydrophobicContact CE1-CB 4.27Å
62	C	92.7	Very high	89.2	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123	179.4	-176	0	0	0	0	109.7	S17 V18 V20 F36 F45	S17-C62 CarbonylContact C-O 3.5Å; S17-C62 WeakPolarHBondContact CA-O 3.24Å; V18-C62 HydrophobicContact CB-CB 4.48Å; V18-C62 PolarHBondContact N-O 3.29Å; V18-C62 PolarHBondContact O-N 3.28Å; V20-C62 HydrophobicContact CG2-CB 4.17Å; F36-C62 HydrophobicContact CD1-CB 3.9Å; F36-C62 HydrophobicContact CE1-CB 4.31Å; F45-C62 HydrophobicContact CD2-CB 3.67Å; F45-C62 HydrophobicContact CE2-CB 3.79Å
63	E	92.2	Very high	89.7	Confident	31 Å²	31	54.1 Å²	54.1	15%	0.145	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.3	-179.1	-177.9	170.9	108.2	0	0	109.5	R13 V43 S44	R13-E63 WeakPolarHBondContact CG-OE2 3.39Å; R13-E63 IonicContact CZ-OE1 3.67Å; R13-E63 IonicContact CZ-OE2 3.74Å; R13-E63 VanDerWaalsContact NE-CD 3.31Å; R13-E63 IonicContact NE-OE1 2.7Å; R13-E63 PolarHBondContact NE-OE1 3.32Å; R13-E63 IonicContact NE-OE2 2.74Å; R13-E63 PolarHBondContact NE-OE2 2.82Å; R13-E63 IonicContact NH2-OE1 2.74Å; R13-E63 PolarHBondContact NH2-OE1 2.76Å; R13-E63 IonicContact NH2-OE2 3.48Å; R13-E63 PolarHBondContact NH2-OE2 2.96Å; V43-E63 HydrophobicContact CB-CG 4.36Å; V43-E63 PolarHBondContact N-O 2.94Å; S44-E63 PolarHBondContact N-O 2.84Å; S44-E63 PolarHBondContact O-N 2.77Å
64	Y	93.8	Very high	90	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	163.6	-179.3	-77.5	-77.9	0	0	0	112.4	R16 V18 F36 G40 V42 D66 T69 A70 A73	R16-Y64 PolarHBondContact O-N 3.12Å; V18-Y64 HydrophobicContact CG2-CD2 3.94Å; V18-Y64 HydrophobicContact CG2-CE2 3.98Å; F36-Y64 WeakPolarHBondContact CB-OH 3.28Å; F36-Y64 HydrophobicContact CD1-CE2 4.26Å; F36-Y64 VanDerWaalsContact CD1-OH 3.28Å; F36-Y64 WeakPolarHBondContact CD1-OH 3.23Å; F36-Y64 WeakPolarHBondContact O-CE1 3.35Å; F36-Y64 PolarHBondContact O-OH 3.2Å; G40-Y64 WeakPolarHBondContact O-CE1 3.25Å; V42-Y64 HydrophobicContact CG2-CD1 4.14Å; V42-Y64 HydrophobicContact CG2-CE1 3.6Å; Y64-D66 VanDerWaalsContact C-N 3.3Å; Y64-T69 HydrophobicContact CD1-CG2 3.33Å; Y64-T69 HydrophobicContact CE1-CG2 3.63Å; Y64-T69 HydrophobicContact CG-CG2 3.9Å; Y64-A70 HydrophobicContact CD2-CB 4.03Å; Y64-A73 HydrophobicContact CD2-CB 4.44Å; Y64-A73 HydrophobicContact CE2-CB 3.46Å; Y64-A73 VanDerWaalsContact CE2-CB 3.46Å; Y64-A73 WeakPolarHBondContact OH-CB 3.37Å
65	Q	90.1	Very high	90.4	Very high	107 Å²	107	59.4 Å²	59.4	50%	0.5	28%	0.277	S	S	.	.	S	Bend	trans	-66.6	-32.6	173.3	-170.8	147.3	93.8	0	0	112.3	R16 P41 V43	R16-Q65 WeakPolarHBondContact CD-O 3.42Å; R16-Q65 PolarHBondContact NH1-O 3.42Å; P41-Q65 HydrophobicContact CB-CB 4.45Å; P41-Q65 HydrophobicContact CG-CB 3.89Å; P41-Q65 PolarHBondContact O-N 3.42Å; P41-Q65 VanDerWaalsContact O-N 3.15Å; V43-Q65 HydrophobicContact CG2-CB 4.01Å
66	D	90.4	Very high	90.7	Very high	79 Å²	79	57.6 Å²	57.6	42%	0.422	28%	0.275	S	S	.	.	S	Bend	trans	-135.7	150.2	-172.3	-62.9	-78.9	0	0	0	113	Y64 E68 T69 A70	Y64-D66 VanDerWaalsContact C-N 3.3Å; D66-E68 VanDerWaalsContact C-N 3.31Å; D66-E68 PolarHBondContact O-N 2.83Å; D66-T69 PolarHBondContact O-N 3.27Å; D66-A70 PolarHBondContact O-N 3.08Å
67	Q	89.8	Confident	90.9	Very high	45 Å²	45	56.5 Å²	56.5	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-40.3	178.8	166	69.6	108.9	0	0	111	L15 R16 T69 A70 L71	L15-Q67 PolarHBondContact O-NE2 2.97Å; R16-Q67 HydrophobicContact CG-CB 4.38Å; Q67-T69 VanDerWaalsContact C-N 3.3Å; Q67-T69 PolarHBondContact O-N 3.48Å; Q67-A70 WeakPolarHBondContact O-CB 3.42Å; Q67-A70 PolarHBondContact O-N 2.77Å; Q67-A70 VanDerWaalsContact O-N 3.15Å; Q67-L71 HydrophobicContact CG-CD1 4.05Å; Q67-L71 HydrophobicContact CG-CG 4.37Å; Q67-L71 WeakPolarHBondContact O-CG 3.2Å; Q67-L71 PolarHBondContact O-N 3.29Å
68	E	90.3	Very high	91.2	Very high	155 Å²	155	56.2 Å²	56.2	72%	0.724	27%	0.271	S	S	*	.	H	α-helix	trans	-67.5	-32.7	-177.3	-67.3	171.6	75.4	0	0	111.5	D66 S72	D66-E68 VanDerWaalsContact C-N 3.31Å; D66-E68 PolarHBondContact O-N 2.83Å; E68-S72 VanDerWaalsContact O-CB 3.27Å; E68-S72 WeakPolarHBondContact O-CB 3.28Å; E68-S72 PolarHBondContact O-N 3.3Å; E68-S72 PolarHBondContact O-OG 2.93Å
69	T	91.8	Very high	91.2	Very high	21 Å²	21	57.8 Å²	57.8	13%	0.129	29%	0.287	C	S	.	.	H	α-helix	trans	-66.2	-43.6	169.7	-46.5	0	0	0	0	111.5	Y64 D66 Q67 L71 S72 A73	Y64-T69 HydrophobicContact CD1-CG2 3.33Å; Y64-T69 HydrophobicContact CE1-CG2 3.63Å; Y64-T69 HydrophobicContact CG-CG2 3.9Å; D66-T69 PolarHBondContact O-N 3.27Å; Q67-T69 VanDerWaalsContact C-N 3.3Å; Q67-T69 PolarHBondContact O-N 3.48Å; T69-L71 PolarHBondContact O-N 3.41Å; T69-S72 PolarHBondContact O-N 3.22Å; T69-A73 WeakPolarHBondContact O-CB 3.38Å; T69-A73 PolarHBondContact O-N 2.88Å
70	A	91.2	Very high	91	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-42	175.9	0	0	0	0	0	112.8	V18 Y64 D66 Q67 A73 M74	V18-A70 HydrophobicContact CG2-CB 3.57Å; Y64-A70 HydrophobicContact CD2-CB 4.03Å; D66-A70 PolarHBondContact O-N 3.08Å; Q67-A70 WeakPolarHBondContact O-CB 3.42Å; Q67-A70 PolarHBondContact O-N 2.77Å; Q67-A70 VanDerWaalsContact O-N 3.15Å; A70-A73 PolarHBondContact O-N 2.91Å; A70-M74 PolarHBondContact O-N 3.22Å; A70-M74 VanDerWaalsContact O-N 3.08Å
71	L	90.4	Very high	90.9	Very high	88 Å²	88	65.6 Å²	65.6	46%	0.461	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-42.8	172.9	-67.4	171.2	0	0	0	111.6	Q67 T69 A73 M74 R75	Q67-L71 HydrophobicContact CG-CD1 4.05Å; Q67-L71 HydrophobicContact CG-CG 4.37Å; Q67-L71 WeakPolarHBondContact O-CG 3.2Å; Q67-L71 PolarHBondContact O-N 3.29Å; T69-L71 PolarHBondContact O-N 3.41Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.27Å; L71-M74 HydrophobicContact CD2-CE 3.81Å; L71-M74 PolarHBondContact O-N 3.22Å; L71-R75 PolarHBondContact O-N 3.28Å
72	S	91.7	Very high	90.7	Very high	50 Å²	50	63.3 Å²	63.3	35%	0.35	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-36.3	177.2	-60.6	0	0	0	0	111.9	E68 T69 R75 N76	E68-S72 VanDerWaalsContact O-CB 3.27Å; E68-S72 WeakPolarHBondContact O-CB 3.28Å; E68-S72 PolarHBondContact O-N 3.3Å; E68-S72 PolarHBondContact O-OG 2.93Å; T69-S72 PolarHBondContact O-N 3.22Å; S72-R75 PolarHBondContact O-N 2.76Å; S72-N76 WeakPolarHBondContact O-CB 3.21Å; S72-N76 PolarHBondContact O-N 3.1Å; S72-N76 PolarHBondContact O-ND2 3.03Å
73	A	91.9	Very high	90.2	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.2	-46.5	175.4	0	0	0	0	0	110.9	V39 Y64 T69 A70 L71 R75 N76 L77	V39-A73 HydrophobicContact CG1-CB 4.3Å; Y64-A73 HydrophobicContact CD2-CB 4.44Å; Y64-A73 HydrophobicContact CE2-CB 3.46Å; Y64-A73 VanDerWaalsContact CE2-CB 3.46Å; Y64-A73 WeakPolarHBondContact OH-CB 3.37Å; T69-A73 WeakPolarHBondContact O-CB 3.38Å; T69-A73 PolarHBondContact O-N 2.88Å; A70-A73 PolarHBondContact O-N 2.91Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.27Å; A73-R75 VanDerWaalsContact C-N 3.27Å; A73-R75 PolarHBondContact O-N 2.7Å; A73-N76 PolarHBondContact O-N 3.2Å; A73-L77 HydrophobicContact CB-CD1 4.03Å; A73-L77 WeakPolarHBondContact O-CA 3.42Å; A73-L77 WeakPolarHBondContact O-CB 3.29Å; A73-L77 WeakPolarHBondContact O-CG 3.45Å; A73-L77 PolarHBondContact O-N 3.38Å
74	M	91.4	Very high	89.9	Confident	35 Å²	35	69.1 Å²	69.1	17%	0.172	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-36.6	173.2	-72.5	-174.9	-74.5	0	0	112.8	V18 A70 L71 N78 V89 N91	V18-M74 HydrophobicContact CG1-CG 3.85Å; V18-M74 HydrophobicContact CG2-CG 4.44Å; A70-M74 PolarHBondContact O-N 3.22Å; A70-M74 VanDerWaalsContact O-N 3.08Å; L71-M74 HydrophobicContact CD2-CE 3.81Å; L71-M74 PolarHBondContact O-N 3.22Å; M74-N78 WeakPolarHBondContact O-CB 3.26Å; M74-V89 HydrophobicContact CG-CG1 4.12Å; M74-N91 HydrophobicContact CE-CB 4.25Å; M74-N91 VanDerWaalsContact SD-CA 3.51Å; M74-N91 HydrophobicContact SD-CB 3.73Å; M74-N91 PolarHBondContact SD-N 3.13Å
75	R	89.9	Confident	89.5	Confident	217 Å²	217	73.5 Å²	73.5	82%	0.819	38%	0.384	S	S	*	.	H	α-helix	trans	-76.4	-36	-179.6	-164.3	175.5	-171.1	178.6	4.2	114.3	L71 S72 A73	L71-R75 PolarHBondContact O-N 3.28Å; S72-R75 PolarHBondContact O-N 2.76Å; A73-R75 VanDerWaalsContact C-N 3.27Å; A73-R75 PolarHBondContact O-N 2.7Å
76	N	90.1	Very high	89.6	Confident	105 Å²	105	70.6 Å²	70.6	56%	0.561	38%	0.378	S	S	*	.	H	α-helix	trans	-103.2	-20.8	-172.3	-63.2	-77.4	0	0	0	114.1	S72 A73	S72-N76 WeakPolarHBondContact O-CB 3.21Å; S72-N76 PolarHBondContact O-N 3.1Å; S72-N76 PolarHBondContact O-ND2 3.03Å; A73-N76 PolarHBondContact O-N 3.2Å
77	L	90.6	Very high	89.7	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-104.3	-16.3	-178.1	-52.3	-179	0	0	0	113.4	F36 V39 A73 G79 R80 V89	F36-L77 HydrophobicContact CB-CD1 4.3Å; F36-L77 HydrophobicContact CD1-CD1 3.62Å; F36-L77 HydrophobicContact CD2-CD1 3.92Å; F36-L77 HydrophobicContact CE1-CD1 3.74Å; F36-L77 HydrophobicContact CE2-CD1 4.05Å; F36-L77 HydrophobicContact CG-CD1 3.7Å; F36-L77 HydrophobicContact CZ-CB 4.35Å; F36-L77 HydrophobicContact CZ-CD1 3.94Å; V39-L77 HydrophobicContact CG2-CD1 3.94Å; V39-L77 HydrophobicContact CG2-CD2 3.77Å; V39-L77 HydrophobicContact CG2-CG 3.83Å; A73-L77 HydrophobicContact CB-CD1 4.03Å; A73-L77 WeakPolarHBondContact O-CA 3.42Å; A73-L77 WeakPolarHBondContact O-CB 3.29Å; A73-L77 WeakPolarHBondContact O-CG 3.45Å; A73-L77 PolarHBondContact O-N 3.38Å; L77-G79 PolarHBondContact O-N 2.68Å; L77-R80 VanDerWaalsContact CD2-CZ 3.44Å; L77-R80 WeakPolarHBondContact O-CB 3.42Å; L77-R80 PolarHBondContact O-N 3.27Å; L77-R80 VanDerWaalsContact O-N 3.08Å; L77-V89 HydrophobicContact CB-CG2 3.92Å; L77-V89 WeakPolarHBondContact O-CG2 3.34Å
78	N	91.7	Very high	89.8	Confident	89 Å²	89	71.2 Å²	71.2	48%	0.476	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	123.3	173.5	-172.2	42.3	0	0	0	110.2	M74 R88 V89	M74-N78 WeakPolarHBondContact O-CB 3.26Å; N78-R88 WeakPolarHBondContact OD1-CA 3.4Å; N78-V89 HydrophobicContact CB-CB 3.94Å; N78-V89 PolarHBondContact OD1-N 3.19Å
79	G	87.9	Confident	89.9	Confident	41 Å²	41	64.1 Å²	64.1	42%	0.423	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	-5.9	-172.7	0	0	0	0	0	114.8	L77 E81 A86 L87	L77-G79 PolarHBondContact O-N 2.68Å; G79-E81 PolarHBondContact O-N 2.74Å; G79-A86 WeakPolarHBondContact O-CB 3.49Å; G79-L87 WeakPolarHBondContact CA-O 3.22Å; G79-L87 PolarHBondContact N-O 2.96Å
80	R	88.8	Confident	89.8	Confident	74 Å²	74	66 Å²	66	28%	0.279	35%	0.349	S	S	.	.			trans	-67.1	126.2	-174.8	-147.8	-121.3	-81	-95.9	14	110.3	I35 E38 L77 L87	I35-R80 PolarHBondContact O-NH2 2.78Å; E38-R80 IonicContact OE1-CZ 3.28Å; E38-R80 IonicContact OE1-NH1 3.36Å; E38-R80 PolarHBondContact OE1-NH1 3.22Å; E38-R80 IonicContact OE1-NH2 2.67Å; E38-R80 PolarHBondContact OE1-NH2 3.46Å; E38-R80 IonicContact OE2-NH1 3.09Å; L77-R80 VanDerWaalsContact CD2-CZ 3.44Å; L77-R80 WeakPolarHBondContact O-CB 3.42Å; L77-R80 PolarHBondContact O-N 3.27Å; L77-R80 VanDerWaalsContact O-N 3.08Å; R80-L87 WeakPolarHBondContact O-CG 3.39Å; R80-L87 PolarHBondContact O-N 3.13Å
81	E	90.3	Very high	89.7	Confident	157 Å²	157	68.6 Å²	68.6	73%	0.734	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	128.8	-176.6	-66.7	-169.9	83.2	0	0	112.1	G79	G79-E81 PolarHBondContact O-N 2.74Å
82	F	87.1	Confident	89.3	Confident	33 Å²	33	64.9 Å²	64.9	15%	0.145	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	123.8	173.8	-176.6	-109.7	0	0	0	109.9	P24 A27 Q31 I35 G84 R85 L87	P24-F82 HydrophobicContact CG-CD1 3.59Å; P24-F82 HydrophobicContact CG-CE1 3.91Å; A27-F82 HydrophobicContact CB-CD1 4.43Å; A27-F82 HydrophobicContact CB-CE1 3.66Å; Q31-F82 HydrophobicContact CB-CZ 4.07Å; I35-F82 HydrophobicContact CD1-CD2 3.26Å; I35-F82 HydrophobicContact CD1-CE2 3.42Å; I35-F82 VanDerWaalsContact CD1-CE2 3.42Å; I35-F82 HydrophobicContact CD1-CG 3.98Å; I35-F82 HydrophobicContact CD1-CZ 4.24Å; F82-G84 PolarHBondContact O-N 3.06Å; F82-G84 VanDerWaalsContact O-N 3.17Å; F82-R85 PolarHBondContact N-O 3.39Å; F82-R85 PolarHBondContact O-N 3.05Å; F82-L87 HydrophobicContact CB-CD1 3.93Å; F82-L87 HydrophobicContact CB-CD2 4.17Å; F82-L87 HydrophobicContact CB-CG 3.93Å
83	S	83.9	Confident	88.2	Confident	84 Å²	84	65 Å²	65	59%	0.587	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	44.1	-173.6	-52	0	0	0	0	114.1	R85	S83-R85 VanDerWaalsContact C-N 3.35Å; S83-R85 PolarHBondContact O-N 2.94Å
84	G	84.1	Confident	86.5	Confident	69 Å²	69	67.9 Å²	67.9	71%	0.711	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	15.7	-179.8	0	0	0	0	0	115.4	F82	F82-G84 PolarHBondContact O-N 3.06Å; F82-G84 VanDerWaalsContact O-N 3.17Å
85	R	86.8	Confident	84.8	Confident	94 Å²	94	73 Å²	73	36%	0.355	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.7	172.3	-71.9	-172	171.7	-177.6	-4.9	111.4	F82 S83 L87	F82-R85 PolarHBondContact N-O 3.39Å; F82-R85 PolarHBondContact O-N 3.05Å; S83-R85 VanDerWaalsContact C-N 3.35Å; S83-R85 PolarHBondContact O-N 2.94Å; R85-L87 PolarHBondContact O-N 3.32Å
86	A	90.6	Very high	82.7	Confident	45 Å²	45	71 Å²	71	37%	0.372	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	116.5	168.5	0	0	0	0	0	110.3	N22 G79	N22-A86 PolarHBondContact ND2-O 2.96Å; G79-A86 WeakPolarHBondContact O-CB 3.49Å
87	L	93	Very high	80.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-66.5	130.3	175.1	-63.7	176	0	0	0	109.6	I23 L32 I35 F36 G79 R80 F82 R85 V89	I23-L87 HydrophobicContact CG1-CD2 4.2Å; L32-L87 HydrophobicContact CD2-CD1 4.44Å; L32-L87 HydrophobicContact CD2-CD2 4.42Å; I35-L87 HydrophobicContact CG2-CD1 4.45Å; F36-L87 HydrophobicContact CE2-CD1 4.29Å; G79-L87 WeakPolarHBondContact CA-O 3.22Å; G79-L87 PolarHBondContact N-O 2.96Å; R80-L87 WeakPolarHBondContact O-CG 3.39Å; R80-L87 PolarHBondContact O-N 3.13Å; F82-L87 HydrophobicContact CB-CD1 3.93Å; F82-L87 HydrophobicContact CB-CD2 4.17Å; F82-L87 HydrophobicContact CB-CG 3.93Å; R85-L87 PolarHBondContact O-N 3.32Å; L87-V89 HydrophobicContact CB-CG2 4.42Å
88	R	91.3	Very high	78.9	Confident	137 Å²	137	72.8 Å²	72.8	52%	0.517	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.3	168.9	178.6	177.2	169.2	-174.1	-0.8	108.7	V20 G21 N78 D90	V20-R88 CarbonylContact C-O 3.56Å; V20-R88 WeakPolarHBondContact CA-O 3.48Å; G21-R88 PolarHBondContact N-O 3.29Å; G21-R88 PolarHBondContact O-N 2.91Å; N78-R88 WeakPolarHBondContact OD1-CA 3.4Å; R88-D90 IonicContact CZ-OD2 4Å; R88-D90 VanDerWaalsContact CZ-OD2 3.28Å; R88-D90 IonicContact NE-OD2 3.2Å; R88-D90 PolarHBondContact NE-OD2 3.47Å; R88-D90 VanDerWaalsContact NE-OD2 3.09Å; R88-D90 IonicContact NH2-OD2 2.83Å; R88-D90 PolarHBondContact NH2-OD2 2.84Å
89	V	93.2	Very high	76.9	Confident	6 Å²	6	75.3 Å²	75.3	4%	0.036	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.2	-178.7	-169.8	0	0	0	0	109	V18 F19 F36 M74 L77 N78 L87	V18-V89 HydrophobicContact CG1-CG1 3.23Å; F19-V89 WeakPolarHBondContact O-CA 3.41Å; F36-V89 HydrophobicContact CE1-CG1 3.98Å; F36-V89 HydrophobicContact CE1-CG2 4.39Å; F36-V89 HydrophobicContact CZ-CG1 4.17Å; F36-V89 HydrophobicContact CZ-CG2 3.76Å; M74-V89 HydrophobicContact CG-CG1 4.12Å; L77-V89 HydrophobicContact CB-CG2 3.92Å; L77-V89 WeakPolarHBondContact O-CG2 3.34Å; N78-V89 HydrophobicContact CB-CB 3.94Å; N78-V89 PolarHBondContact OD1-N 3.19Å; L87-V89 HydrophobicContact CB-CG2 4.42Å
90	D	90.2	Very high	75	Confident	60 Å²	60	80.5 Å²	80.5	32%	0.321	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	171	-163.1	-146.1	-54	0	0	0	110.6	V18 F19 R88	V18-D90 CarbonylContact C-O 3.5Å; V18-D90 WeakPolarHBondContact CG1-O 3.08Å; F19-D90 HydrophobicContact CB-CB 4.29Å; F19-D90 HydrophobicContact CD1-CB 3.86Å; F19-D90 PolarHBondContact N-O 3.44Å; F19-D90 PolarHBondContact O-N 2.9Å; R88-D90 IonicContact CZ-OD2 4Å; R88-D90 VanDerWaalsContact CZ-OD2 3.28Å; R88-D90 IonicContact NE-OD2 3.2Å; R88-D90 PolarHBondContact NE-OD2 3.47Å; R88-D90 VanDerWaalsContact NE-OD2 3.09Å; R88-D90 IonicContact NH2-OD2 2.83Å; R88-D90 PolarHBondContact NH2-OD2 2.84Å
91	N	88.6	Confident	73.1	Confident	55 Å²	55	81.9 Å²	81.9	29%	0.294	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.1	-173.7	-166.4	86.3	0	0	0	110.9	M74 A93	M74-N91 HydrophobicContact CE-CB 4.25Å; M74-N91 VanDerWaalsContact SD-CA 3.51Å; M74-N91 HydrophobicContact SD-CB 3.73Å; M74-N91 PolarHBondContact SD-N 3.13Å; N91-A93 PolarHBondContact ND2-N 2.8Å; N91-A93 PolarHBondContact O-N 2.65Å
92	A	82.7	Confident	71.1	Confident	9 Å²	9	81.4 Å²	81.4	7%	0.074	42%	0.424	C	S	.	.			trans	-78.1	38.3	-176.8	0	0	0	0	0	114.1	S17 F19 F61 S94	S17-A92 VanDerWaalsContact O-CB 3.26Å; S17-A92 WeakPolarHBondContact O-CB 3.23Å; S17-A92 PolarHBondContact O-N 2.91Å; S17-A92 VanDerWaalsContact O-N 3.08Å; F19-A92 HydrophobicContact CB-CB 4.43Å; F61-A92 HydrophobicContact CD1-CB 3.82Å; F61-A92 HydrophobicContact CE1-CB 4.27Å; A92-S94 VanDerWaalsContact C-N 3.32Å; A92-S94 PolarHBondContact O-N 2.85Å
93	A	68.2	Low	69.1	Low	53 Å²	53	84.4 Å²	84.4	44%	0.438	45%	0.45	S	S	.	.			trans	-62.3	94.7	173.8	0	0	0	0	0	109.3	N91 E95	N91-A93 PolarHBondContact ND2-N 2.8Å; N91-A93 PolarHBondContact O-N 2.65Å; A93-E95 PolarHBondContact O-N 3.04Å
94	S	55.7	Low	67.2	Low	60 Å²	60	86.7 Å²	86.7	42%	0.42	45%	0.454	S	S	.	.			trans	-50.2	136.6	-177.3	178.6	0	0	0	0	110.5	A92 K96 N97 K98	A92-S94 VanDerWaalsContact C-N 3.32Å; A92-S94 PolarHBondContact O-N 2.85Å; S94-K96 PolarHBondContact O-N 3.32Å; S94-K96 VanDerWaalsContact O-N 3.12Å; S94-N97 CarbonylContact O-C 3.43Å; S94-N97 WeakPolarHBondContact O-CA 3.46Å; S94-N97 WeakPolarHBondContact O-CB 3.39Å; S94-N97 PolarHBondContact O-N 3.3Å; S94-K98 PolarHBondContact O-N 2.69Å; S94-K98 VanDerWaalsContact O-N 3.11Å
95	E	55.2	Low	65.5	Low	142 Å²	142	87.3 Å²	87.3	66%	0.664	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.3	-174.9	-62	-174.2	93	0	0	112	A93 N97 K98	A93-E95 PolarHBondContact O-N 3.04Å; E95-N97 VanDerWaalsContact C-N 3.32Å; E95-N97 PolarHBondContact O-N 3.42Å; E95-K98 VanDerWaalsContact O-CB 3.25Å; E95-K98 WeakPolarHBondContact O-CB 3.36Å; E95-K98 PolarHBondContact O-N 2.92Å; E95-K98 VanDerWaalsContact O-N 3.1Å; E95-K98 IonicContact OE1-NZ 3.3Å
96	K	47.8	Very low	63.4	Low	175 Å²	175	89 Å²	89	76%	0.761	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-33.9	173	-64.2	-169.3	173.2	-167.4	0	113.8	S94 K98	S94-K96 PolarHBondContact O-N 3.32Å; S94-K96 VanDerWaalsContact O-N 3.12Å; K96-K98 VanDerWaalsContact C-N 3.3Å
97	N	50.5	Low	61.2	Low	38 Å²	38	90.8 Å²	90.8	20%	0.203	51%	0.505	C	S	.	.	H	α-helix	trans	-81	-12.5	177.1	-151.7	116.2	0	0	0	111.9	S94 E95 E99 L101	S94-N97 CarbonylContact O-C 3.43Å; S94-N97 WeakPolarHBondContact O-CA 3.46Å; S94-N97 WeakPolarHBondContact O-CB 3.39Å; S94-N97 PolarHBondContact O-N 3.3Å; E95-N97 VanDerWaalsContact C-N 3.32Å; E95-N97 PolarHBondContact O-N 3.42Å; N97-E99 VanDerWaalsContact C-N 3.3Å; N97-L101 WeakPolarHBondContact O-CB 3.4Å; N97-L101 PolarHBondContact O-N 3.08Å
98	K	49.3	Very low	58.4	Low	107 Å²	107	94.1 Å²	94.1	47%	0.465	53%	0.532	S	S	.	.	H	α-helix	trans	-78.3	-13.3	-179.8	-164.9	170.9	61.5	-170.5	0	113.1	S94 E95 K96 K102	S94-K98 PolarHBondContact O-N 2.69Å; S94-K98 VanDerWaalsContact O-N 3.11Å; E95-K98 VanDerWaalsContact O-CB 3.25Å; E95-K98 WeakPolarHBondContact O-CB 3.36Å; E95-K98 PolarHBondContact O-N 2.92Å; E95-K98 VanDerWaalsContact O-N 3.1Å; E95-K98 IonicContact OE1-NZ 3.3Å; K96-K98 VanDerWaalsContact C-N 3.3Å; K98-K102 WeakPolarHBondContact O-CD 3.39Å; K98-K102 VanDerWaalsContact O-CG 3.29Å; K98-K102 WeakPolarHBondContact O-CG 3.33Å
99	E	49.7	Very low	56	Low	142 Å²	142	93.6 Å²	93.6	66%	0.664	55%	0.546	S	S	*	.	H	α-helix	trans	-96.6	-45.4	177.1	-70.6	168.6	61.9	0	0	111.7	N97 K102 S103	N97-E99 VanDerWaalsContact C-N 3.3Å; E99-K102 PolarHBondContact O-N 3.36Å; E99-S103 PolarHBondContact O-N 3.47Å; E99-S103 PolarHBondContact O-OG 2.73Å
100	E	48.4	Very low	53.6	Low	149 Å²	149	98.9 Å²	98.9	70%	0.696	58%	0.578	S	S	*	*	H	α-helix	trans	-64.1	-40.8	173.8	-74.5	-177.1	58.6	0	0	112.3	K102 S103 L104	E100-K102 PolarHBondContact O-N 3.37Å; E100-S103 WeakPolarHBondContact O-CA 3.18Å; E100-S103 WeakPolarHBondContact O-CB 3.43Å; E100-S103 PolarHBondContact O-N 2.81Å; E100-L104 PolarHBondContact O-N 2.74Å
101	L	48.5	Very low	51.7	Low	104 Å²	104	103.6 Å²	103.6	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-72.7	-6.9	177.9	-149	78.7	0	0	0	113.8	N97	N97-L101 WeakPolarHBondContact O-CB 3.4Å; N97-L101 PolarHBondContact O-N 3.08Å
102	K	47.9	Very low	49.5	Very low	146 Å²	146	108.8 Å²	108.8	64%	0.635	63%	0.625	S	S	*	*	H	α-helix	trans	-92.6	-16.1	165.8	-74.3	-176.2	177.5	-148.3	0	112.8	K98 E99 E100	K98-K102 WeakPolarHBondContact O-CD 3.39Å; K98-K102 VanDerWaalsContact O-CG 3.29Å; K98-K102 WeakPolarHBondContact O-CG 3.33Å; E99-K102 PolarHBondContact O-N 3.36Å; E100-K102 PolarHBondContact O-N 3.37Å
103	S	45.8	Very low	47.7	Very low	97 Å²	97	112 Å²	112	68%	0.678	65%	0.647	S	S	*	*	H	α-helix	trans	-90.3	-26.1	-175.8	-57.2	0	0	0	0	112.7	E99 E100	E99-S103 PolarHBondContact O-N 3.47Å; E99-S103 PolarHBondContact O-OG 2.73Å; E100-S103 WeakPolarHBondContact O-CA 3.18Å; E100-S103 WeakPolarHBondContact O-CB 3.43Å; E100-S103 PolarHBondContact O-N 2.81Å
104	L	44.3	Very low	47.2	Very low	131 Å²	131	114.9 Å²	114.9	69%	0.686	66%	0.661	S	S	*	*	S	Bend	trans	-102.7	103.3	166.6	-83.3	77	0	0	0	110	E100 T106	E100-L104 PolarHBondContact O-N 2.74Å; L104-T106 PolarHBondContact O-N 3.49Å
105	G	48.5	Very low	47.2	Very low	82 Å²	82	121.6 Å²	121.6	85%	0.845	68%	0.678	S	S	*	*			trans	-73.4	87.8	179.5	0	0	0	0	0	113.7
106	T	41.3	Very low	47.5	Very low	130 Å²	130	117.4 Å²	117.4	80%	0.798	67%	0.674	S	S	*	*			trans	-143.4	138	163.2	2	0	0	0	0	110.7	L104 A108	L104-T106 PolarHBondContact O-N 3.49Å; T106-A108 PolarHBondContact O-N 3.35Å
107	G	45.4	Very low	48.4	Very low	83 Å²	83	116.6 Å²	116.6	86%	0.856	67%	0.673	S	S	*	*			trans	-70.8	126.1	-165.3	0	0	0	0	0	115.4
108	A	34.8	Very low	49.1	Very low	70 Å²	70	121.6 Å²	121.6	58%	0.579	70%	0.704	S	S	*	*			trans	-80.1	156.6	144.4	0	0	0	0	0	109	T106 V110	T106-A108 PolarHBondContact O-N 3.35Å; A108-V110 PolarHBondContact O-N 2.82Å
109	P	39.3	Very low	50.1	Low	126 Å²	126	120.5 Å²	120.5	82%	0.818	70%	0.703	S	S	*	*			trans	-62.9	112.3	174.6	26.3	-33.7	0	0	0	109.8	I111	P109-I111 PolarHBondContact O-N 3.18Å; P109-I111 VanDerWaalsContact O-N 3.16Å
110	V	44.3	Very low	51.2	Low	117 Å²	117	116.9 Å²	116.9	71%	0.709	69%	0.693	S	S	*	*			trans	-62.6	116.5	171	173.7	0	0	0	0	107.4	A108 E112	A108-V110 PolarHBondContact O-N 2.82Å; V110-E112 HydrophobicContact CG1-CG 4.01Å; V110-E112 PolarHBondContact O-N 3.15Å
111	I	48.6	Very low	52.2	Low	159 Å²	159	115.6 Å²	115.6	82%	0.815	70%	0.698	S	S	*	*			trans	-67.7	97.3	158.2	-62	175.6	0	0	0	104.6	P109 S113	P109-I111 PolarHBondContact O-N 3.18Å; P109-I111 VanDerWaalsContact O-N 3.16Å; I111-S113 VanDerWaalsContact C-N 3.3Å; I111-S113 PolarHBondContact O-N 3.49Å
112	E	43.5	Very low	53.4	Low	165 Å²	165	118.5 Å²	118.5	77%	0.771	71%	0.709	S	S	*	*			trans	-62.1	94.2	178.8	-82.6	-175.8	59.3	0	0	109.3	V110 P114	V110-E112 HydrophobicContact CG1-CG 4.01Å; V110-E112 PolarHBondContact O-N 3.15Å; E112-P114 WeakPolarHBondContact O-CD 3.35Å
113	S	44.2	Very low	54.8	Low	77 Å²	77	114.7 Å²	114.7	54%	0.538	70%	0.695	S	S	.	*			trans	-58.9	116.6	149.2	-65.8	0	0	0	0	105.6	I111 Y115 G116	I111-S113 VanDerWaalsContact C-N 3.3Å; I111-S113 PolarHBondContact O-N 3.49Å; S113-Y115 PolarHBondContact O-N 3.09Å; S113-G116 PolarHBondContact O-N 3.25Å
114	P	57.8	Low	56.3	Low	113 Å²	113	111.3 Å²	111.3	73%	0.734	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	13.9	-168.2	27.4	-35.3	0	0	0	114.4	E112	E112-P114 WeakPolarHBondContact O-CD 3.35Å
115	Y	55.8	Low	58	Low	200 Å²	200	107.7 Å²	107.7	78%	0.784	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	1.9	176.8	-64.6	-84.1	0	0	0	113	S113	S113-Y115 PolarHBondContact O-N 3.09Å
116	G	62.3	Low	59.5	Low	55 Å²	55	110.5 Å²	110.5	57%	0.567	65%	0.648	S	S	*	*			trans	80.6	-162.8	177.4	0	0	0	0	0	115.2	S113	S113-G116 PolarHBondContact O-N 3.25Å
117	E	66.2	Low	61.4	Low	158 Å²	158	106 Å²	106	74%	0.738	62%	0.622	S	S	*	*	S	Bend	trans	-78	149.9	173.9	-169.4	162.1	116.8	0	0	110.6	I119	E117-I119 PolarHBondContact O-N 3Å; E117-I119 VanDerWaalsContact O-N 3.14Å
118	T	64.4	Low	63.2	Low	142 Å²	142	103.6 Å²	103.6	87%	0.871	59%	0.59	S	S	*	*			trans	-77.2	101.3	-174.9	53.1	0	0	0	0	112
119	I	70.5	Confident	65.5	Low	84 Å²	84	101.5 Å²	101.5	43%	0.431	57%	0.57	S	S	.	*			trans	-81.6	142.1	-178.4	-44	155.9	0	0	0	111.2	E117 D123 A124	E117-I119 PolarHBondContact O-N 3Å; E117-I119 VanDerWaalsContact O-N 3.14Å; I119-D123 HydrophobicContact CG2-CB 3.82Å; I119-D123 WeakPolarHBondContact CG2-OD1 3.47Å; I119-A124 HydrophobicContact CG2-CB 4.5Å
120	S	73.4	Confident	67.6	Low	67 Å²	67	102.4 Å²	102.4	47%	0.469	56%	0.561	S	S	.	*			trans	-64.4	145.7	168.1	-65.1	0	0	0	0	111.7	E122 D123 A124	S120-E122 PolarHBondContact O-N 3.4Å; S120-E122 VanDerWaalsContact O-N 3.1Å; S120-D123 PolarHBondContact O-N 2.86Å; S120-A124 PolarHBondContact O-N 3.38Å
121	P	69.8	Low	69.4	Low	121 Å²	121	99.6 Å²	99.6	79%	0.786	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-19.2	-175.7	26.6	-35.6	0	0	0	114.4
122	E	74	Confident	71.1	Confident	166 Å²	166	92.4 Å²	92.4	78%	0.776	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-33.7	173.1	65.6	-157	84.1	0	0	113.7	S120	S120-E122 PolarHBondContact O-N 3.4Å; S120-E122 VanDerWaalsContact O-N 3.1Å
123	D	77.5	Confident	72.9	Confident	66 Å²	66	87.4 Å²	87.4	35%	0.353	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-25.6	-178.3	-179.3	-83.2	0	0	0	112.2	I119 S120 P125 E126 S127	I119-D123 HydrophobicContact CG2-CB 3.82Å; I119-D123 WeakPolarHBondContact CG2-OD1 3.47Å; S120-D123 PolarHBondContact O-N 2.86Å; D123-P125 VanDerWaalsContact C-CD 3.41Å; D123-P125 VanDerWaalsContact C-N 3.35Å; D123-P125 VanDerWaalsContact O-N 3.08Å; D123-E126 WeakPolarHBondContact O-CA 3.45Å; D123-E126 PolarHBondContact O-N 2.93Å; D123-S127 PolarHBondContact O-N 3.17Å; D123-S127 VanDerWaalsContact OD1-CB 3.26Å; D123-S127 WeakPolarHBondContact OD1-CB 3.43Å; D123-S127 PolarHBondContact OD1-OG 2.98Å
124	A	77.1	Confident	74.8	Confident	26 Å²	26	88.2 Å²	88.2	22%	0.215	51%	0.507	C	S	.	.	H	α-helix	trans	-38.8	-47.9	178	0	0	0	0	0	115.9	I119 S120 E126 I128	I119-A124 HydrophobicContact CG2-CB 4.5Å; S120-A124 PolarHBondContact O-N 3.38Å; A124-E126 PolarHBondContact O-N 2.67Å; A124-I128 WeakPolarHBondContact O-CB 3.46Å; A124-I128 WeakPolarHBondContact O-CD1 3.18Å; A124-I128 WeakPolarHBondContact O-CG1 3.11Å; A124-I128 PolarHBondContact O-N 3.03Å
125	P	78.7	Confident	76.1	Confident	54 Å²	54	86.2 Å²	86.2	35%	0.351	49%	0.489	S	S	.	.	H	α-helix	trans	-65.4	-34.2	177.2	25.7	-35.2	0	0	0	113.9	D123 S129 Y170	D123-P125 VanDerWaalsContact C-CD 3.41Å; D123-P125 VanDerWaalsContact C-N 3.35Å; D123-P125 VanDerWaalsContact O-N 3.08Å; P125-S129 WeakPolarHBondContact O-CB 3.45Å; P125-S129 PolarHBondContact O-N 2.76Å; P125-S129 VanDerWaalsContact O-N 3.13Å; P125-S129 PolarHBondContact O-OG 3.15Å; P125-Y170 HydrophobicContact CB-CE1 4.18Å; P125-Y170 HydrophobicContact CB-CE2 4.4Å; P125-Y170 WeakPolarHBondContact CB-OH 3.46Å
126	E	80.8	Confident	77.6	Confident	141 Å²	141	79.7 Å²	79.7	66%	0.659	47%	0.471	S	S	*	.	H	α-helix	trans	-76.3	-45	176.3	-173.4	165	128.1	0	0	110.9	D123 A124 I128 S129 K130	D123-E126 WeakPolarHBondContact O-CA 3.45Å; D123-E126 PolarHBondContact O-N 2.93Å; A124-E126 PolarHBondContact O-N 2.67Å; E126-I128 PolarHBondContact O-N 3.42Å; E126-S129 CarbonylContact O-C 3.56Å; E126-S129 WeakPolarHBondContact O-CA 3.39Å; E126-S129 WeakPolarHBondContact O-CB 3.32Å; E126-S129 PolarHBondContact O-N 2.96Å; E126-K130 WeakPolarHBondContact O-CB 3.44Å; E126-K130 PolarHBondContact O-N 2.83Å
127	S	81.4	Confident	78.5	Confident	35 Å²	35	81.4 Å²	81.4	25%	0.245	47%	0.473	C	S	.	.	H	α-helix	trans	-60.9	-41	175.1	-89.2	0	0	0	0	113	D123 S129 K130 A131	D123-S127 PolarHBondContact O-N 3.17Å; D123-S127 VanDerWaalsContact OD1-CB 3.26Å; D123-S127 WeakPolarHBondContact OD1-CB 3.43Å; D123-S127 PolarHBondContact OD1-OG 2.98Å; S127-S129 VanDerWaalsContact C-N 3.34Å; S127-K130 PolarHBondContact O-N 3.43Å; S127-A131 VanDerWaalsContact O-CB 3.32Å; S127-A131 WeakPolarHBondContact O-CB 3.42Å; S127-A131 PolarHBondContact O-N 2.87Å
128	I	83.4	Confident	79.5	Confident	34 Å²	34	81 Å²	81	17%	0.174	47%	0.471	C	S	.	.	H	α-helix	trans	-64.3	-40.8	172	-65.2	163	0	0	0	110.4	A124 E126 K130 A131 V132 Q167 Y170 A171	A124-I128 WeakPolarHBondContact O-CB 3.46Å; A124-I128 WeakPolarHBondContact O-CD1 3.18Å; A124-I128 WeakPolarHBondContact O-CG1 3.11Å; A124-I128 PolarHBondContact O-N 3.03Å; E126-I128 PolarHBondContact O-N 3.42Å; I128-K130 VanDerWaalsContact C-N 3.34Å; I128-K130 PolarHBondContact O-N 2.89Å; I128-A131 PolarHBondContact O-N 3.24Å; I128-V132 HydrophobicContact CG2-CG2 4.19Å; I128-V132 WeakPolarHBondContact O-CB 3.44Å; I128-V132 WeakPolarHBondContact O-CG2 3.46Å; I128-V132 PolarHBondContact O-N 3Å; I128-Q167 HydrophobicContact CD1-CB 4.4Å; I128-Y170 HydrophobicContact CB-CD1 4.13Å; I128-Y170 HydrophobicContact CB-CE1 4.4Å; I128-Y170 HydrophobicContact CD1-CD1 4.23Å; I128-Y170 HydrophobicContact CG2-CD1 3.77Å; I128-Y170 HydrophobicContact CG2-CE1 4.35Å; I128-A171 HydrophobicContact CG2-CB 3.77Å
129	S	82.5	Confident	80.5	Confident	25 Å²	25	79.9 Å²	79.9	18%	0.175	46%	0.456	C	S	.	.	H	α-helix	trans	-63.7	-39.8	178.3	-60.4	0	0	0	0	112.6	P125 E126 S127 A133	P125-S129 WeakPolarHBondContact O-CB 3.45Å; P125-S129 PolarHBondContact O-N 2.76Å; P125-S129 VanDerWaalsContact O-N 3.13Å; P125-S129 PolarHBondContact O-OG 3.15Å; E126-S129 CarbonylContact O-C 3.56Å; E126-S129 WeakPolarHBondContact O-CA 3.39Å; E126-S129 WeakPolarHBondContact O-CB 3.32Å; E126-S129 PolarHBondContact O-N 2.96Å; S127-S129 VanDerWaalsContact C-N 3.34Å; S129-A133 WeakPolarHBondContact O-CB 3.36Å; S129-A133 PolarHBondContact O-N 2.96Å
130	K	82.4	Confident	81.1	Confident	145 Å²	145	76.3 Å²	76.3	63%	0.63	44%	0.437	S	S	*	.	H	α-helix	trans	-67.9	-42.4	175.2	-176	179	179.4	-178.4	0	112.2	E126 S127 I128 S134	E126-K130 WeakPolarHBondContact O-CB 3.44Å; E126-K130 PolarHBondContact O-N 2.83Å; S127-K130 PolarHBondContact O-N 3.43Å; I128-K130 VanDerWaalsContact C-N 3.34Å; I128-K130 PolarHBondContact O-N 2.89Å; K130-S134 WeakPolarHBondContact O-CB 3.3Å; K130-S134 PolarHBondContact O-N 3.41Å; K130-S134 PolarHBondContact O-OG 2.69Å
131	A	83.6	Confident	81.7	Confident	58 Å²	58	79 Å²	79	48%	0.479	44%	0.441	S	S	.	.	H	α-helix	trans	-63.3	-49.5	175.7	0	0	0	0	0	111.3	S127 I128 A133 S134 L135	S127-A131 VanDerWaalsContact O-CB 3.32Å; S127-A131 WeakPolarHBondContact O-CB 3.42Å; S127-A131 PolarHBondContact O-N 2.87Å; I128-A131 PolarHBondContact O-N 3.24Å; A131-A133 PolarHBondContact O-N 3.1Å; A131-S134 WeakPolarHBondContact O-CB 3.41Å; A131-S134 PolarHBondContact O-N 3.07Å; A131-S134 VanDerWaalsContact O-N 3.13Å; A131-L135 PolarHBondContact O-N 3.09Å
132	V	84.1	Confident	82.6	Confident	8 Å²	8	77 Å²	77	5%	0.048	42%	0.421	C	S	.	.	H	α-helix	trans	-62.1	-43.1	177	171.7	0	0	0	0	111.4	I128 S134 L135 M140 A171 Q174 A175	I128-V132 HydrophobicContact CG2-CG2 4.19Å; I128-V132 WeakPolarHBondContact O-CB 3.44Å; I128-V132 WeakPolarHBondContact O-CG2 3.46Å; I128-V132 PolarHBondContact O-N 3Å; V132-S134 PolarHBondContact O-N 3.31Å; V132-L135 WeakPolarHBondContact O-CB 3.08Å; V132-L135 PolarHBondContact O-N 3.42Å; V132-M140 HydrophobicContact CG1-SD 4.48Å; V132-M140 VanDerWaalsContact O-CE 3.26Å; V132-M140 WeakPolarHBondContact O-CE 3.31Å; V132-A171 HydrophobicContact CG2-CB 3.87Å; V132-Q174 HydrophobicContact CB-CG 4.3Å; V132-Q174 HydrophobicContact CG1-CG 4.23Å; V132-A175 HydrophobicContact CG1-CB 3.85Å
133	A	81.6	Confident	83.2	Confident	60 Å²	60	71.6 Å²	71.6	50%	0.496	40%	0.397	S	S	.	.	H	α-helix	trans	-69.6	-15.8	177.4	0	0	0	0	0	113.9	S129 A131	S129-A133 WeakPolarHBondContact O-CB 3.36Å; S129-A133 PolarHBondContact O-N 2.96Å; A131-A133 PolarHBondContact O-N 3.1Å
134	S	84.5	Confident	83.7	Confident	94 Å²	94	69.5 Å²	69.5	66%	0.657	39%	0.386	S	S	*	.	H	α-helix	trans	-88.1	-10.6	175.2	-59	0	0	0	0	113.2	K130 A131 V132	K130-S134 WeakPolarHBondContact O-CB 3.3Å; K130-S134 PolarHBondContact O-N 3.41Å; K130-S134 PolarHBondContact O-OG 2.69Å; A131-S134 WeakPolarHBondContact O-CB 3.41Å; A131-S134 PolarHBondContact O-N 3.07Å; A131-S134 VanDerWaalsContact O-N 3.13Å; V132-S134 PolarHBondContact O-N 3.31Å
135	L	83.4	Confident	84.2	Confident	71 Å²	71	73.3 Å²	73.3	37%	0.372	40%	0.397	S	S	.	.	S	Bend	trans	-72.1	142.7	172.9	-64.5	174.6	0	0	0	110.7	A131 V132 M140	A131-L135 PolarHBondContact O-N 3.09Å; V132-L135 WeakPolarHBondContact O-CB 3.08Å; V132-L135 PolarHBondContact O-N 3.42Å; L135-M140 HydrophobicContact CB-CE 4.28Å; L135-M140 HydrophobicContact CB-CG 4.02Å; L135-M140 WeakPolarHBondContact O-CE 3.47Å
136	P	87.6	Confident	84.7	Confident	63 Å²	63	77 Å²	77	41%	0.409	41%	0.41	S	S	.	.			trans	-65.9	150.3	168.3	29.4	-34.3	0	0	0	110.2	E138 Q139 M140	P136-E138 PolarHBondContact O-N 3.18Å; P136-E138 VanDerWaalsContact O-N 3.12Å; P136-Q139 HydrophobicContact CG-CB 4.06Å; P136-Q139 HydrophobicContact CG-CG 3.64Å; P136-Q139 PolarHBondContact O-N 2.9Å; P136-M140 PolarHBondContact O-N 3.45Å
137	P	81.2	Confident	85.1	Confident	91 Å²	91	71.6 Å²	71.6	59%	0.591	39%	0.385	S	S	*	.	H	α-helix	trans	-61.4	-26.8	-173.4	24.6	-34.8	0	0	0	113.3	M140 F141	P137-M140 PolarHBondContact O-N 3.25Å; P137-F141 WeakPolarHBondContact O-CB 3.33Å; P137-F141 PolarHBondContact O-N 3.13Å
138	E	87.8	Confident	85.4	Confident	151 Å²	151	76.9 Å²	76.9	71%	0.706	40%	0.403	S	S	*	.	H	α-helix	trans	-62.2	-44.2	174	-64.3	168.4	102	0	0	111.8	P136 F141 E142	P136-E138 PolarHBondContact O-N 3.18Å; P136-E138 VanDerWaalsContact O-N 3.12Å; E138-F141 PolarHBondContact O-N 2.98Å; E138-E142 PolarHBondContact O-N 3.22Å
139	Q	86.1	Confident	85.8	Confident	117 Å²	117	80 Å²	80	55%	0.547	42%	0.42	S	S	.	.	H	α-helix	trans	-70.2	-34.7	177.7	-67.9	-69.1	96.4	0	0	111.6	P136 L143	P136-Q139 HydrophobicContact CG-CB 4.06Å; P136-Q139 HydrophobicContact CG-CG 3.64Å; P136-Q139 PolarHBondContact O-N 2.9Å; Q139-L143 VanDerWaalsContact O-CB 3.28Å; Q139-L143 WeakPolarHBondContact O-CB 3.33Å; Q139-L143 PolarHBondContact O-N 3.33Å
140	M	83.3	Confident	86.1	Confident	10 Å²	10	80.5 Å²	80.5	5%	0.049	42%	0.423	C	S	.	.	H	α-helix	trans	-64.8	-41.3	171.4	-57.7	-167.6	-144.8	0	0	111.7	V132 L135 P136 P137 M144 V178 M179	V132-M140 HydrophobicContact CG1-SD 4.48Å; V132-M140 VanDerWaalsContact O-CE 3.26Å; V132-M140 WeakPolarHBondContact O-CE 3.31Å; L135-M140 HydrophobicContact CB-CE 4.28Å; L135-M140 HydrophobicContact CB-CG 4.02Å; L135-M140 WeakPolarHBondContact O-CE 3.47Å; P136-M140 PolarHBondContact O-N 3.45Å; P137-M140 PolarHBondContact O-N 3.25Å; M140-M144 WeakPolarHBondContact O-CG 3.45Å; M140-M144 PolarHBondContact O-N 2.89Å; M140-V178 HydrophobicContact CE-CG1 3.91Å; M140-V178 HydrophobicContact SD-CB 4.41Å; M140-V178 HydrophobicContact SD-CG1 3.9Å; M140-M179 HydrophobicContact CB-CE 4.43Å; M140-M179 HydrophobicContact CB-CG 4.23Å; M140-M179 HydrophobicContact CB-SD 3.66Å; M140-M179 HydrophobicContact SD-CG 4.15Å
141	F	85.2	Confident	86.6	Confident	124 Å²	124	76.9 Å²	76.9	54%	0.544	41%	0.413	S	S	.	.	H	α-helix	trans	-65.8	-42.9	177.2	-177.3	-92.8	0	0	0	112.1	P137 E138 M144 K145 M179	P137-F141 WeakPolarHBondContact O-CB 3.33Å; P137-F141 PolarHBondContact O-N 3.13Å; E138-F141 PolarHBondContact O-N 2.98Å; F141-M144 PolarHBondContact O-N 2.97Å; F141-K145 HydrophobicContact CE1-CD 4.21Å; F141-K145 VanDerWaalsContact O-CB 3.32Å; F141-K145 WeakPolarHBondContact O-CB 3.47Å; F141-K145 PolarHBondContact O-N 3.07Å; F141-M179 HydrophobicContact CB-CE 3.89Å; F141-M179 HydrophobicContact CD2-CE 4.13Å
142	E	88	Confident	87	Confident	78 Å²	78	80.7 Å²	80.7	36%	0.364	42%	0.421	S	S	.	.	H	α-helix	trans	-67.5	-38.5	178.3	-161.1	58.9	82.8	0	0	111.5	E138 M144 K145 Q146	E138-E142 PolarHBondContact O-N 3.22Å; E142-M144 PolarHBondContact O-N 3.17Å; E142-K145 PolarHBondContact O-N 3.4Å; E142-K145 IonicContact OE1-NZ 3.92Å; E142-K145 PolarHBondContact OE1-NZ 3.05Å; E142-K145 WeakPolarHBondContact OE2-CD 3.25Å; E142-K145 WeakPolarHBondContact OE2-CE 3.48Å; E142-K145 IonicContact OE2-NZ 2.88Å; E142-K145 PolarHBondContact OE2-NZ 3.28Å; E142-Q146 WeakPolarHBondContact O-CB 3.45Å; E142-Q146 PolarHBondContact O-N 3.01Å
143	L	88	Confident	87.4	Confident	52 Å²	52	85.9 Å²	85.9	27%	0.272	45%	0.448	S	S	.	.	H	α-helix	trans	-58.2	-46	169.3	177.2	64.5	0	0	0	112	Q139 M147 L172	Q139-L143 VanDerWaalsContact O-CB 3.28Å; Q139-L143 WeakPolarHBondContact O-CB 3.33Å; Q139-L143 PolarHBondContact O-N 3.33Å; L143-M147 VanDerWaalsContact O-CB 3.29Å; L143-M147 WeakPolarHBondContact O-CB 3.49Å; L143-M147 PolarHBondContact O-N 3.25Å; L143-L172 HydrophobicContact CD1-CD2 3.93Å; L143-L172 HydrophobicContact CD2-CD2 4.02Å; L143-L172 HydrophobicContact CG-CD2 3.74Å
144	M	86.1	Confident	88.1	Confident	23 Å²	23	85.1 Å²	85.1	11%	0.113	44%	0.439	C	S	.	.	H	α-helix	trans	-64	-38.8	175.4	-74.8	-61.4	107.8	0	0	112.7	M140 F141 E142 K148 L172 A175 Q176 M179	M140-M144 WeakPolarHBondContact O-CG 3.45Å; M140-M144 PolarHBondContact O-N 2.89Å; F141-M144 PolarHBondContact O-N 2.97Å; E142-M144 PolarHBondContact O-N 3.17Å; M144-K148 VanDerWaalsContact O-CB 3.27Å; M144-K148 WeakPolarHBondContact O-CB 3.48Å; M144-K148 PolarHBondContact O-N 2.91Å; M144-L172 HydrophobicContact CE-CB 4.03Å; M144-L172 HydrophobicContact CE-CD2 3.38Å; M144-L172 HydrophobicContact CE-CG 4.31Å; M144-L172 WeakPolarHBondContact CE-O 3.43Å; M144-A175 HydrophobicContact CE-CB 4.01Å; M144-Q176 HydrophobicContact CE-CG 4.31Å; M144-Q176 HydrophobicContact SD-CG 3.49Å; M144-Q176 WeakPolarHBondContact SD-CG 3.46Å; M144-Q176 PolarHBondContact SD-NE2 2.74Å; M144-M179 HydrophobicContact CG-SD 4.03Å
145	K	88.8	Confident	88.4	Confident	106 Å²	106	84 Å²	84	46%	0.461	43%	0.43	S	S	.	.	H	α-helix	trans	-67.7	-45.8	178.2	175.3	175.2	141.1	-142.8	0	111.2	F141 E142 K148 L149	F141-K145 HydrophobicContact CE1-CD 4.21Å; F141-K145 VanDerWaalsContact O-CB 3.32Å; F141-K145 WeakPolarHBondContact O-CB 3.47Å; F141-K145 PolarHBondContact O-N 3.07Å; E142-K145 PolarHBondContact O-N 3.4Å; E142-K145 IonicContact OE1-NZ 3.92Å; E142-K145 PolarHBondContact OE1-NZ 3.05Å; E142-K145 WeakPolarHBondContact OE2-CD 3.25Å; E142-K145 WeakPolarHBondContact OE2-CE 3.48Å; E142-K145 IonicContact OE2-NZ 2.88Å; E142-K145 PolarHBondContact OE2-NZ 3.28Å; K145-K148 PolarHBondContact O-N 3.38Å; K145-L149 WeakPolarHBondContact O-CB 3.39Å; K145-L149 PolarHBondContact O-N 2.9Å
146	Q	89.4	Confident	88.8	Confident	132 Å²	132	87.4 Å²	87.4	62%	0.617	44%	0.444	S	S	*	.	H	α-helix	trans	-66	-40.3	176.6	-168.2	173.3	9.1	0	0	111.8	E142 L149 C150	E142-Q146 WeakPolarHBondContact O-CB 3.45Å; E142-Q146 PolarHBondContact O-N 3.01Å; Q146-L149 PolarHBondContact O-N 3.36Å; Q146-C150 WeakPolarHBondContact O-CB 3.39Å; Q146-C150 PolarHBondContact O-N 2.95Å
147	M	89.4	Confident	88.8	Confident	27 Å²	27	90.1 Å²	90.1	13%	0.133	45%	0.451	C	S	.	.	H	α-helix	trans	-62.4	-45.2	173	-173.7	55.2	45.4	0	0	112	L143 L149 C150 V151 M161 L162 L168 L172	L143-M147 VanDerWaalsContact O-CB 3.29Å; L143-M147 WeakPolarHBondContact O-CB 3.49Å; L143-M147 PolarHBondContact O-N 3.25Å; M147-L149 VanDerWaalsContact C-N 3.29Å; M147-L149 PolarHBondContact O-N 3.36Å; M147-C150 PolarHBondContact O-N 2.76Å; M147-V151 WeakPolarHBondContact O-CG2 3.39Å; M147-V151 PolarHBondContact O-N 2.89Å; M147-M161 HydrophobicContact CE-CE 3.57Å; M147-M161 HydrophobicContact SD-CE 4.03Å; M147-L162 HydrophobicContact SD-CD1 4.39Å; M147-L162 HydrophobicContact SD-CD2 4.32Å; M147-L168 HydrophobicContact CE-CD2 4.48Å; M147-L172 HydrophobicContact CB-CD2 4.17Å; M147-L172 HydrophobicContact CE-CD1 3.54Å; M147-L172 HydrophobicContact CE-CD2 4.11Å; M147-L172 HydrophobicContact CE-CG 4.47Å; M147-L172 HydrophobicContact CG-CD1 4.05Å; M147-L172 HydrophobicContact CG-CD2 4.11Å; M147-L172 HydrophobicContact SD-CD1 3.9Å
148	K	87.9	Confident	89.3	Confident	145 Å²	145	85.9 Å²	85.9	63%	0.63	42%	0.423	S	S	*	.	H	α-helix	trans	-62.9	-35.5	175	-170.3	-177.2	-67.8	-177.3	0	111.8	M144 K145 Q152	M144-K148 VanDerWaalsContact O-CB 3.27Å; M144-K148 WeakPolarHBondContact O-CB 3.48Å; M144-K148 PolarHBondContact O-N 2.91Å; K145-K148 PolarHBondContact O-N 3.38Å; K148-Q152 WeakPolarHBondContact O-CB 3.38Å; K148-Q152 VanDerWaalsContact O-CG 3.25Å; K148-Q152 WeakPolarHBondContact O-CG 3.32Å; K148-Q152 PolarHBondContact O-N 3.03Å; K148-Q152 VanDerWaalsContact O-N 3.12Å; K148-Q152 PolarHBondContact O-NE2 3.06Å
149	L	91	Very high	89.2	Confident	100 Å²	100	86.7 Å²	86.7	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-68.1	-43.7	175	-172.9	64.7	0	0	0	111.7	K145 Q146 M147 Q152 N153	K145-L149 WeakPolarHBondContact O-CB 3.39Å; K145-L149 PolarHBondContact O-N 2.9Å; Q146-L149 PolarHBondContact O-N 3.36Å; M147-L149 VanDerWaalsContact C-N 3.29Å; M147-L149 PolarHBondContact O-N 3.36Å; L149-Q152 PolarHBondContact O-N 2.68Å; L149-N153 WeakPolarHBondContact CD1-ND2 3.43Å; L149-N153 PolarHBondContact O-N 2.93Å; L149-N153 VanDerWaalsContact O-N 3.08Å; L149-N153 PolarHBondContact O-ND2 3.45Å
150	C	89.4	Confident	89.4	Confident	35 Å²	35	85 Å²	85	24%	0.236	42%	0.415	C	S	.	.	H	α-helix	trans	-57.7	-48.9	174.7	-179.4	0	0	0	0	111.6	Q146 M147 Q152 N153 S154	Q146-C150 WeakPolarHBondContact O-CB 3.39Å; Q146-C150 PolarHBondContact O-N 2.95Å; M147-C150 PolarHBondContact O-N 2.76Å; C150-Q152 VanDerWaalsContact C-N 3.32Å; C150-Q152 PolarHBondContact O-N 3.42Å; C150-N153 PolarHBondContact O-N 2.79Å; C150-S154 CarbonylContact O-C 3.58Å; C150-S154 PolarHBondContact O-N 2.96Å
151	V	92.3	Very high	89.6	Confident	70 Å²	70	87.3 Å²	87.3	42%	0.424	43%	0.426	S	S	.	.	H	α-helix	trans	-63	-34.4	177.7	173.6	0	0	0	0	112.8	M147 P155 A158	M147-V151 WeakPolarHBondContact O-CG2 3.39Å; M147-V151 PolarHBondContact O-N 2.89Å; V151-P155 WeakPolarHBondContact O-CB 3.35Å; V151-A158 HydrophobicContact CB-CB 4.44Å; V151-A158 HydrophobicContact CG2-CB 3.71Å
152	Q	91.6	Very high	89.7	Confident	138 Å²	138	83.7 Å²	83.7	65%	0.645	41%	0.412	S	S	*	.	H	α-helix	trans	-73.5	-33.7	178.3	-76.8	171.2	112.8	0	0	113.6	K148 L149 C150	K148-Q152 WeakPolarHBondContact O-CB 3.38Å; K148-Q152 VanDerWaalsContact O-CG 3.25Å; K148-Q152 WeakPolarHBondContact O-CG 3.32Å; K148-Q152 PolarHBondContact O-N 3.03Å; K148-Q152 VanDerWaalsContact O-N 3.12Å; K148-Q152 PolarHBondContact O-NE2 3.06Å; L149-Q152 PolarHBondContact O-N 2.68Å; C150-Q152 VanDerWaalsContact C-N 3.32Å; C150-Q152 PolarHBondContact O-N 3.42Å
153	N	93.9	Very high	89.7	Confident	117 Å²	117	86.6 Å²	86.6	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-85	-48.4	178.8	-72.1	-89.5	0	0	0	111.8	L149 C150	L149-N153 WeakPolarHBondContact CD1-ND2 3.43Å; L149-N153 PolarHBondContact O-N 2.93Å; L149-N153 VanDerWaalsContact O-N 3.08Å; L149-N153 PolarHBondContact O-ND2 3.45Å; C150-N153 PolarHBondContact O-N 2.79Å
154	S	94.7	Very high	89.6	Confident	44 Å²	44	90.4 Å²	90.4	31%	0.308	45%	0.446	S	S	.	.			trans	-132.2	69.7	-170.4	-54.8	0	0	0	0	111.7	C150 Q156 E157 A158	C150-S154 CarbonylContact O-C 3.58Å; C150-S154 PolarHBondContact O-N 2.96Å; S154-Q156 VanDerWaalsContact C-N 3.28Å; S154-Q156 PolarHBondContact O-N 2.96Å; S154-E157 WeakPolarHBondContact CB-OE1 3.32Å; S154-E157 PolarHBondContact O-N 3.16Å; S154-E157 VanDerWaalsContact O-N 3.11Å; S154-E157 PolarHBondContact OG-OE1 3.03Å; S154-A158 WeakPolarHBondContact O-CB 3.32Å; S154-A158 PolarHBondContact O-N 2.81Å
155	P	91.5	Very high	89.6	Confident	71 Å²	71	91.8 Å²	91.8	46%	0.461	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-28.3	-172.9	22.1	-33.5	0	0	0	114.7	V151 R159	V151-P155 WeakPolarHBondContact O-CB 3.35Å; P155-R159 WeakPolarHBondContact O-CB 3.45Å; P155-R159 VanDerWaalsContact O-CG 3.28Å; P155-R159 WeakPolarHBondContact O-CG 3.27Å; P155-R159 PolarHBondContact O-N 2.71Å
156	Q	90.9	Very high	89.4	Confident	141 Å²	141	91 Å²	91	66%	0.659	46%	0.46	S	S	*	.	H	α-helix	trans	-77.3	-38	175.3	-59.2	-66.8	11.1	0	0	112.1	S154 R159 N160	S154-Q156 VanDerWaalsContact C-N 3.28Å; S154-Q156 PolarHBondContact O-N 2.96Å; Q156-R159 PolarHBondContact O-N 2.92Å; Q156-N160 PolarHBondContact O-N 2.91Å
157	E	88.8	Confident	89.2	Confident	121 Å²	121	89.8 Å²	89.8	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-67.8	-45.4	177.1	-173.1	171.6	58.7	0	0	110.9	S154 R159 N160 M161	S154-E157 WeakPolarHBondContact CB-OE1 3.32Å; S154-E157 PolarHBondContact O-N 3.16Å; S154-E157 VanDerWaalsContact O-N 3.11Å; S154-E157 PolarHBondContact OG-OE1 3.03Å; E157-R159 VanDerWaalsContact C-N 3.29Å; E157-R159 PolarHBondContact O-N 3.23Å; E157-N160 PolarHBondContact O-N 3.44Å; E157-N160 VanDerWaalsContact O-N 3.13Å; E157-M161 WeakPolarHBondContact O-CB 3.17Å; E157-M161 PolarHBondContact O-N 3.44Å
158	A	90.4	Very high	89.1	Confident	1 Å²	1	90.9 Å²	90.9	1%	0.008	46%	0.46	C	S	.	.	H	α-helix	trans	-57.2	-42.3	173.7	0	0	0	0	0	111.8	V151 S154 L162	V151-A158 HydrophobicContact CB-CB 4.44Å; V151-A158 HydrophobicContact CG2-CB 3.71Å; S154-A158 WeakPolarHBondContact O-CB 3.32Å; S154-A158 PolarHBondContact O-N 2.81Å; A158-L162 WeakPolarHBondContact O-CB 3.5Å; A158-L162 WeakPolarHBondContact O-CD1 3.2Å; A158-L162 WeakPolarHBondContact O-CG 3.48Å; A158-L162 PolarHBondContact O-N 3.27Å
159	R	87.6	Confident	89	Confident	169 Å²	169	85.8 Å²	85.8	64%	0.638	45%	0.445	S	S	*	.	H	α-helix	trans	-62.4	-46.5	173.4	-81.2	174.7	137.3	-159.6	-5.5	112.4	P155 Q156 E157 L162 L163	P155-R159 WeakPolarHBondContact O-CB 3.45Å; P155-R159 VanDerWaalsContact O-CG 3.28Å; P155-R159 WeakPolarHBondContact O-CG 3.27Å; P155-R159 PolarHBondContact O-N 2.71Å; Q156-R159 PolarHBondContact O-N 2.92Å; E157-R159 VanDerWaalsContact C-N 3.29Å; E157-R159 PolarHBondContact O-N 3.23Å; R159-L162 PolarHBondContact O-N 3.45Å; R159-L163 WeakPolarHBondContact O-CB 3.44Å; R159-L163 VanDerWaalsContact O-CG 3.31Å; R159-L163 WeakPolarHBondContact O-CG 3.39Å; R159-L163 PolarHBondContact O-N 2.96Å
160	N	88.9	Confident	88.7	Confident	81 Å²	81	84 Å²	84	43%	0.433	43%	0.431	S	S	.	.	H	α-helix	trans	-63.6	-43.8	178	179.3	68	0	0	0	111.7	Q156 E157 L162 L163 Q164	Q156-N160 PolarHBondContact O-N 2.91Å; E157-N160 PolarHBondContact O-N 3.44Å; E157-N160 VanDerWaalsContact O-N 3.13Å; N160-L162 PolarHBondContact O-N 3.35Å; N160-L163 PolarHBondContact O-N 3.13Å; N160-Q164 PolarHBondContact ND2-NE2 3.35Å; N160-Q164 WeakPolarHBondContact O-CB 3.39Å; N160-Q164 WeakPolarHBondContact O-CG 3.48Å; N160-Q164 PolarHBondContact O-N 3.41Å; N160-Q164 PolarHBondContact OD1-NE2 3.03Å; N160-Q164 VanDerWaalsContact OD1-NE2 3.17Å
161	M	87.2	Confident	88.6	Confident	58 Å²	58	83.1 Å²	83.1	29%	0.286	43%	0.427	S	S	.	.	H	α-helix	trans	-57.8	-45.5	176.1	-179.2	-174.8	63.8	0	0	111.8	M147 E157 Q164 N165 L168	M147-M161 HydrophobicContact CE-CE 3.57Å; M147-M161 HydrophobicContact SD-CE 4.03Å; E157-M161 WeakPolarHBondContact O-CB 3.17Å; E157-M161 PolarHBondContact O-N 3.44Å; M161-Q164 PolarHBondContact O-N 3.3Å; M161-N165 WeakPolarHBondContact O-CB 3.28Å; M161-N165 PolarHBondContact O-N 2.88Å; M161-N165 PolarHBondContact O-ND2 2.9Å; M161-L168 HydrophobicContact CE-CD2 4.24Å; M161-L168 HydrophobicContact CG-CD2 4.33Å; M161-L168 HydrophobicContact SD-CD2 4.27Å
162	L	88.9	Confident	88.4	Confident	49 Å²	49	80.1 Å²	80.1	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-69.4	-32.9	178.5	-68.9	169	0	0	0	113.1	M147 A158 R159 N160 N165 L168 A169 L172	M147-L162 HydrophobicContact SD-CD1 4.39Å; M147-L162 HydrophobicContact SD-CD2 4.32Å; A158-L162 WeakPolarHBondContact O-CB 3.5Å; A158-L162 WeakPolarHBondContact O-CD1 3.2Å; A158-L162 WeakPolarHBondContact O-CG 3.48Å; A158-L162 PolarHBondContact O-N 3.27Å; R159-L162 PolarHBondContact O-N 3.45Å; N160-L162 PolarHBondContact O-N 3.35Å; L162-N165 CarbonylContact O-C 3.56Å; L162-L168 HydrophobicContact CD2-CG 4.39Å; L162-A169 HydrophobicContact CD2-CB 4.11Å; L162-L172 HydrophobicContact CD2-CD1 3.46Å; L162-L172 VanDerWaalsContact CD2-CD1 3.46Å
163	L	87	Confident	88.2	Confident	139 Å²	139	74.6 Å²	74.6	73%	0.728	38%	0.383	S	S	*	.	H	α-helix	trans	-71.3	-37.5	173.5	-74.7	167.5	0	0	0	112.4	R159 N160	R159-L163 WeakPolarHBondContact O-CB 3.44Å; R159-L163 VanDerWaalsContact O-CG 3.31Å; R159-L163 WeakPolarHBondContact O-CG 3.39Å; R159-L163 PolarHBondContact O-N 2.96Å; N160-L163 PolarHBondContact O-N 3.13Å
164	Q	86.9	Confident	87.6	Confident	131 Å²	131	71.2 Å²	71.2	61%	0.612	36%	0.364	S	S	*	.	H	α-helix	trans	-75.4	-24.4	176.5	-69.5	-177.6	2.3	0	0	112.8	N160 M161 P166	N160-Q164 PolarHBondContact ND2-NE2 3.35Å; N160-Q164 WeakPolarHBondContact O-CB 3.39Å; N160-Q164 WeakPolarHBondContact O-CG 3.48Å; N160-Q164 PolarHBondContact O-N 3.41Å; N160-Q164 PolarHBondContact OD1-NE2 3.03Å; N160-Q164 VanDerWaalsContact OD1-NE2 3.17Å; M161-Q164 PolarHBondContact O-N 3.3Å; Q164-P166 WeakPolarHBondContact O-CD 3.45Å
165	N	84.9	Confident	87.2	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.283	35%	0.349	S	S	.	.			trans	-122.8	73.5	-176.6	-63.2	-89.8	0	0	0	111.4	M161 L162 Q167 L168 A169	M161-N165 WeakPolarHBondContact O-CB 3.28Å; M161-N165 PolarHBondContact O-N 2.88Å; M161-N165 PolarHBondContact O-ND2 2.9Å; L162-N165 CarbonylContact O-C 3.56Å; N165-Q167 PolarHBondContact O-N 2.8Å; N165-L168 HydrophobicContact CB-CB 3.82Å; N165-L168 HydrophobicContact CB-CD2 4.42Å; N165-L168 WeakPolarHBondContact O-CB 3.44Å; N165-L168 PolarHBondContact O-N 3.13Å; N165-A169 PolarHBondContact O-N 3.06Å; N165-A169 VanDerWaalsContact O-N 3.13Å
166	P	84.4	Confident	86.8	Confident	89 Å²	89	68.4 Å²	68.4	58%	0.578	34%	0.34	S	S	*	.	H	α-helix	trans	-59.8	-33.2	-178.6	23.8	-34.1	0	0	0	112.9	Q164 L168 A169 Y170	Q164-P166 WeakPolarHBondContact O-CD 3.45Å; P166-L168 VanDerWaalsContact C-N 3.34Å; P166-L168 PolarHBondContact O-N 3.44Å; P166-A169 PolarHBondContact O-N 3.16Å; P166-Y170 PolarHBondContact O-N 3.45Å
167	Q	84.9	Confident	86.5	Confident	106 Å²	106	62.8 Å²	62.8	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-58.8	-39	172.3	62.4	-148.4	2.6	0	0	113.4	I128 N165 A171	I128-Q167 HydrophobicContact CD1-CB 4.4Å; N165-Q167 PolarHBondContact O-N 2.8Å; Q167-A171 WeakPolarHBondContact O-CB 3.38Å; Q167-A171 PolarHBondContact O-N 3.45Å
168	L	87.4	Confident	86.2	Confident	51 Å²	51	59.8 Å²	59.8	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-70.2	-44.3	174.8	174.9	61.9	0	0	0	110.4	M147 M161 L162 N165 P166 Y170 A171 L172	M147-L168 HydrophobicContact CE-CD2 4.48Å; M161-L168 HydrophobicContact CE-CD2 4.24Å; M161-L168 HydrophobicContact CG-CD2 4.33Å; M161-L168 HydrophobicContact SD-CD2 4.27Å; L162-L168 HydrophobicContact CD2-CG 4.39Å; N165-L168 HydrophobicContact CB-CB 3.82Å; N165-L168 HydrophobicContact CB-CD2 4.42Å; N165-L168 WeakPolarHBondContact O-CB 3.44Å; N165-L168 PolarHBondContact O-N 3.13Å; P166-L168 VanDerWaalsContact C-N 3.34Å; P166-L168 PolarHBondContact O-N 3.44Å; L168-Y170 VanDerWaalsContact C-N 3.3Å; L168-Y170 PolarHBondContact O-N 3.5Å; L168-A171 PolarHBondContact O-N 2.92Å; L168-L172 HydrophobicContact CD1-CD1 3.9Å; L168-L172 HydrophobicContact CD1-CD2 4.44Å; L168-L172 HydrophobicContact CD1-CG 3.99Å; L168-L172 HydrophobicContact CG-CD1 3.79Å; L168-L172 HydrophobicContact CG-CG 4.36Å; L168-L172 WeakPolarHBondContact O-CB 3.44Å; L168-L172 WeakPolarHBondContact O-CD1 3.26Å; L168-L172 WeakPolarHBondContact O-CG 3.37Å; L168-L172 PolarHBondContact O-N 3.22Å
169	A	86.6	Confident	85.8	Confident	37 Å²	37	62.3 Å²	62.3	31%	0.306	32%	0.317	S	S	.	.	H	α-helix	trans	-59.1	-40.9	176.3	0	0	0	0	0	112.4	L162 N165 P166 L173	L162-A169 HydrophobicContact CD2-CB 4.11Å; N165-A169 PolarHBondContact O-N 3.06Å; N165-A169 VanDerWaalsContact O-N 3.13Å; P166-A169 PolarHBondContact O-N 3.16Å; A169-L173 PolarHBondContact O-N 3.45Å
170	Y	85.8	Confident	85.4	Confident	62 Å²	62	64.1 Å²	64.1	24%	0.243	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-48.7	174.8	-168.1	-86.9	0	0	0	111.9	P125 I128 P166 L168 L172 L173 Q174 L191	P125-Y170 HydrophobicContact CB-CE1 4.18Å; P125-Y170 HydrophobicContact CB-CE2 4.4Å; P125-Y170 WeakPolarHBondContact CB-OH 3.46Å; I128-Y170 HydrophobicContact CB-CD1 4.13Å; I128-Y170 HydrophobicContact CB-CE1 4.4Å; I128-Y170 HydrophobicContact CD1-CD1 4.23Å; I128-Y170 HydrophobicContact CG2-CD1 3.77Å; I128-Y170 HydrophobicContact CG2-CE1 4.35Å; P166-Y170 PolarHBondContact O-N 3.45Å; L168-Y170 VanDerWaalsContact C-N 3.3Å; L168-Y170 PolarHBondContact O-N 3.5Å; Y170-L172 VanDerWaalsContact C-N 3.32Å; Y170-L172 PolarHBondContact O-N 2.94Å; Y170-L173 PolarHBondContact O-N 2.93Å; Y170-Q174 WeakPolarHBondContact O-CB 3.16Å; Y170-Q174 PolarHBondContact O-N 3.03Å; Y170-L191 HydrophobicContact CD2-CD1 4.37Å; Y170-L191 HydrophobicContact CD2-CD2 3.66Å; Y170-L191 HydrophobicContact CE2-CD1 3.84Å; Y170-L191 HydrophobicContact CE2-CD2 3.92Å
171	A	86.6	Confident	85	Confident	17 Å²	17	65.4 Å²	65.4	14%	0.14	33%	0.33	C	S	.	.	H	α-helix	trans	-59.3	-40	178.4	0	0	0	0	0	112.9	I128 V132 Q167 L168 Q174 A175	I128-A171 HydrophobicContact CG2-CB 3.77Å; V132-A171 HydrophobicContact CG2-CB 3.87Å; Q167-A171 WeakPolarHBondContact O-CB 3.38Å; Q167-A171 PolarHBondContact O-N 3.45Å; L168-A171 PolarHBondContact O-N 2.92Å; A171-Q174 PolarHBondContact O-N 3.29Å; A171-A175 WeakPolarHBondContact O-CB 3.35Å; A171-A175 PolarHBondContact O-N 3.36Å
172	L	88.3	Confident	84.5	Confident	7 Å²	7	64 Å²	64	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-41.5	177.5	-69.1	164	0	0	0	112.4	L143 M144 M147 L162 L168 Y170 A175 Q176	L143-L172 HydrophobicContact CD1-CD2 3.93Å; L143-L172 HydrophobicContact CD2-CD2 4.02Å; L143-L172 HydrophobicContact CG-CD2 3.74Å; M144-L172 HydrophobicContact CE-CB 4.03Å; M144-L172 HydrophobicContact CE-CD2 3.38Å; M144-L172 HydrophobicContact CE-CG 4.31Å; M144-L172 WeakPolarHBondContact CE-O 3.43Å; M147-L172 HydrophobicContact CB-CD2 4.17Å; M147-L172 HydrophobicContact CE-CD1 3.54Å; M147-L172 HydrophobicContact CE-CD2 4.11Å; M147-L172 HydrophobicContact CE-CG 4.47Å; M147-L172 HydrophobicContact CG-CD1 4.05Å; M147-L172 HydrophobicContact CG-CD2 4.11Å; M147-L172 HydrophobicContact SD-CD1 3.9Å; L162-L172 HydrophobicContact CD2-CD1 3.46Å; L162-L172 VanDerWaalsContact CD2-CD1 3.46Å; L168-L172 HydrophobicContact CD1-CD1 3.9Å; L168-L172 HydrophobicContact CD1-CD2 4.44Å; L168-L172 HydrophobicContact CD1-CG 3.99Å; L168-L172 HydrophobicContact CG-CD1 3.79Å; L168-L172 HydrophobicContact CG-CG 4.36Å; L168-L172 WeakPolarHBondContact O-CB 3.44Å; L168-L172 WeakPolarHBondContact O-CD1 3.26Å; L168-L172 WeakPolarHBondContact O-CG 3.37Å; L168-L172 PolarHBondContact O-N 3.22Å; Y170-L172 VanDerWaalsContact C-N 3.32Å; Y170-L172 PolarHBondContact O-N 2.94Å; L172-A175 PolarHBondContact O-N 3.41Å; L172-Q176 WeakPolarHBondContact O-CG 3.35Å; L172-Q176 PolarHBondContact O-N 3.13Å; L172-Q176 VanDerWaalsContact O-N 3.16Å
173	L	86.1	Confident	84	Confident	23 Å²	23	65.7 Å²	65.7	12%	0.12	33%	0.333	C	S	.	.	H	α-helix	trans	-67.4	-41.8	175.7	-178.6	60.3	0	0	0	111.1	A169 Y170 A175 Q176 V177 V182 A187 I190 L191	A169-L173 PolarHBondContact O-N 3.45Å; Y170-L173 PolarHBondContact O-N 2.93Å; L173-A175 VanDerWaalsContact C-N 3.33Å; L173-A175 PolarHBondContact O-N 3.22Å; L173-Q176 WeakPolarHBondContact O-CB 3.48Å; L173-Q176 PolarHBondContact O-N 3.47Å; L173-Q176 VanDerWaalsContact O-N 3.13Å; L173-V177 PolarHBondContact O-N 3.39Å; L173-V182 HydrophobicContact CD1-CG1 4.37Å; L173-A187 HydrophobicContact CD1-CB 3.96Å; L173-A187 HydrophobicContact CD2-CB 4.11Å; L173-A187 HydrophobicContact CG-CB 4.03Å; L173-I190 HydrophobicContact CD2-CG2 4.41Å; L173-L191 HydrophobicContact CD2-CD1 4Å; L173-L191 HydrophobicContact CD2-CD2 3.87Å; L173-L191 HydrophobicContact CD2-CG 3.63Å
174	Q	83.1	Confident	83.1	Confident	45 Å²	45	61.6 Å²	61.6	21%	0.21	32%	0.315	C	S	.	.	H	α-helix	trans	-62.5	-40.2	176.8	-176.7	59	15.2	0	0	111.8	V132 Y170 A171 Q176 V177 V178	V132-Q174 HydrophobicContact CB-CG 4.3Å; V132-Q174 HydrophobicContact CG1-CG 4.23Å; Y170-Q174 WeakPolarHBondContact O-CB 3.16Å; Y170-Q174 PolarHBondContact O-N 3.03Å; A171-Q174 PolarHBondContact O-N 3.29Å; Q174-Q176 VanDerWaalsContact C-N 3.33Å; Q174-Q176 PolarHBondContact O-N 3.13Å; Q174-V177 PolarHBondContact O-N 3.3Å; Q174-V178 WeakPolarHBondContact O-CG2 3.5Å; Q174-V178 PolarHBondContact O-N 3.17Å
175	A	85.1	Confident	82.3	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-40.6	172.8	0	0	0	0	0	111.8	V132 M144 A171 L172 L173 V177 V178 M179	V132-A175 HydrophobicContact CG1-CB 3.85Å; M144-A175 HydrophobicContact CE-CB 4.01Å; A171-A175 WeakPolarHBondContact O-CB 3.35Å; A171-A175 PolarHBondContact O-N 3.36Å; L172-A175 PolarHBondContact O-N 3.41Å; L173-A175 VanDerWaalsContact C-N 3.33Å; L173-A175 PolarHBondContact O-N 3.22Å; A175-V177 VanDerWaalsContact C-N 3.32Å; A175-V177 PolarHBondContact O-N 2.83Å; A175-V178 PolarHBondContact O-N 2.9Å; A175-M179 VanDerWaalsContact O-CB 3.3Å; A175-M179 WeakPolarHBondContact O-CB 3.49Å; A175-M179 WeakPolarHBondContact O-CG 3.12Å; A175-M179 PolarHBondContact O-N 3.03Å
176	Q	83.8	Confident	81.7	Confident	56 Å²	56	63.3 Å²	63.3	26%	0.262	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-33.6	176.2	-68.7	166.5	21.4	0	0	113	M144 L172 L173 Q174 R180 I181 V182	M144-Q176 HydrophobicContact CE-CG 4.31Å; M144-Q176 HydrophobicContact SD-CG 3.49Å; M144-Q176 WeakPolarHBondContact SD-CG 3.46Å; M144-Q176 PolarHBondContact SD-NE2 2.74Å; L172-Q176 WeakPolarHBondContact O-CG 3.35Å; L172-Q176 PolarHBondContact O-N 3.13Å; L172-Q176 VanDerWaalsContact O-N 3.16Å; L173-Q176 WeakPolarHBondContact O-CB 3.48Å; L173-Q176 PolarHBondContact O-N 3.47Å; L173-Q176 VanDerWaalsContact O-N 3.13Å; Q174-Q176 VanDerWaalsContact C-N 3.33Å; Q174-Q176 PolarHBondContact O-N 3.13Å; Q176-R180 PolarHBondContact O-N 3.39Å; Q176-I181 HydrophobicContact CB-CB 4.39Å; Q176-I181 PolarHBondContact O-N 3.49Å; Q176-V182 HydrophobicContact CB-CB 4.08Å; Q176-V182 HydrophobicContact CB-CG2 3.86Å; Q176-V182 PolarHBondContact O-N 3.18Å; Q176-V182 VanDerWaalsContact O-N 3.09Å
177	V	84.7	Confident	80.7	Confident	22 Å²	22	59.3 Å²	59.3	13%	0.133	30%	0.298	C	S	.	.	H	α-helix	trans	-71.7	-46	174.2	174.6	0	0	0	0	111.3	L173 Q174 A175 M179 R180 P184 A187	L173-V177 PolarHBondContact O-N 3.39Å; Q174-V177 PolarHBondContact O-N 3.3Å; A175-V177 VanDerWaalsContact C-N 3.32Å; A175-V177 PolarHBondContact O-N 2.83Å; V177-M179 VanDerWaalsContact C-N 3.34Å; V177-M179 PolarHBondContact O-N 3.2Å; V177-R180 PolarHBondContact O-N 3.11Å; V177-P184 HydrophobicContact CG1-CB 3.97Å; V177-A187 HydrophobicContact CG2-CB 3.45Å; V177-A187 VanDerWaalsContact CG2-CB 3.45Å
178	V	81.9	Confident	79.7	Confident	59 Å²	59	58.6 Å²	58.6	36%	0.358	30%	0.297	S	S	.	.	H	α-helix	trans	-60.8	-42.7	176.9	171.6	0	0	0	0	111.1	M140 Q174 A175 R180	M140-V178 HydrophobicContact CE-CG1 3.91Å; M140-V178 HydrophobicContact SD-CB 4.41Å; M140-V178 HydrophobicContact SD-CG1 3.9Å; Q174-V178 WeakPolarHBondContact O-CG2 3.5Å; Q174-V178 PolarHBondContact O-N 3.17Å; A175-V178 PolarHBondContact O-N 2.9Å; V178-R180 PolarHBondContact O-N 3Å
179	M	80.9	Confident	78.5	Confident	54 Å²	54	62.3 Å²	62.3	27%	0.266	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	2.1	175.5	-63.9	179.8	83.3	0	0	114.1	M140 F141 M144 A175 V177 I181	M140-M179 HydrophobicContact CB-CE 4.43Å; M140-M179 HydrophobicContact CB-CG 4.23Å; M140-M179 HydrophobicContact CB-SD 3.66Å; M140-M179 HydrophobicContact SD-CG 4.15Å; F141-M179 HydrophobicContact CB-CE 3.89Å; F141-M179 HydrophobicContact CD2-CE 4.13Å; M144-M179 HydrophobicContact CG-SD 4.03Å; A175-M179 VanDerWaalsContact O-CB 3.3Å; A175-M179 WeakPolarHBondContact O-CB 3.49Å; A175-M179 WeakPolarHBondContact O-CG 3.12Å; A175-M179 PolarHBondContact O-N 3.03Å; V177-M179 VanDerWaalsContact C-N 3.34Å; V177-M179 PolarHBondContact O-N 3.2Å; M179-I181 HydrophobicContact CB-CD1 3.78Å; M179-I181 HydrophobicContact CB-CG1 3.87Å; M179-I181 HydrophobicContact CE-CD1 4.29Å; M179-I181 PolarHBondContact O-N 3.41Å; M179-I181 VanDerWaalsContact O-N 3.17Å; M179-I181 HydrophobicContact SD-CD1 4.07Å
180	R	79.4	Confident	77.4	Confident	206 Å²	206	65.4 Å²	65.4	78%	0.777	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	26	-177.4	-58.7	-64.5	-173.3	142.3	-0.9	114.7	Q176 V177 V178	Q176-R180 PolarHBondContact O-N 3.39Å; V177-R180 PolarHBondContact O-N 3.11Å; V178-R180 PolarHBondContact O-N 3Å
181	I	80.4	Confident	76.3	Confident	108 Å²	108	66 Å²	66	55%	0.554	33%	0.328	S	S	*	.	S	Bend	trans	-80.6	-34.4	174.7	-59	171.6	0	0	0	110.3	Q176 M179	Q176-I181 HydrophobicContact CB-CB 4.39Å; Q176-I181 PolarHBondContact O-N 3.49Å; M179-I181 HydrophobicContact CB-CD1 3.78Å; M179-I181 HydrophobicContact CB-CG1 3.87Å; M179-I181 HydrophobicContact CE-CD1 4.29Å; M179-I181 PolarHBondContact O-N 3.41Å; M179-I181 VanDerWaalsContact O-N 3.17Å; M179-I181 HydrophobicContact SD-CD1 4.07Å
182	V	77.7	Confident	74.7	Confident	29 Å²	29	72 Å²	72	18%	0.176	35%	0.354	C	S	.	.	S	Bend	trans	-122.4	135.2	176	173.7	0	0	0	0	108.8	L173 Q176 I186 A187	L173-V182 HydrophobicContact CD1-CG1 4.37Å; Q176-V182 HydrophobicContact CB-CB 4.08Å; Q176-V182 HydrophobicContact CB-CG2 3.86Å; Q176-V182 PolarHBondContact O-N 3.18Å; Q176-V182 VanDerWaalsContact O-N 3.09Å; V182-I186 HydrophobicContact CG1-CB 4.32Å; V182-I186 HydrophobicContact CG1-CG2 4.4Å; V182-A187 HydrophobicContact CG1-CB 4.19Å
183	D	79.3	Confident	72.7	Confident	84 Å²	84	81.4 Å²	81.4	45%	0.449	39%	0.388	S	S	.	.			trans	-70.8	135.1	176.8	-165.3	-76.6	0	0	0	110.8	E185 I186 A187	D183-E185 PolarHBondContact O-N 3.17Å; D183-E185 VanDerWaalsContact O-N 3.17Å; D183-E185 WeakPolarHBondContact OD1-CB 3.41Å; D183-E185 PolarHBondContact OD1-N 3.32Å; D183-I186 HydrophobicContact CB-CD1 3.99Å; D183-I186 HydrophobicContact CB-CG1 4.13Å; D183-I186 WeakPolarHBondContact O-CA 3.46Å; D183-I186 WeakPolarHBondContact O-CB 3.29Å; D183-I186 PolarHBondContact O-N 3.25Å; D183-A187 PolarHBondContact O-N 3.06Å
184	P	67.5	Low	70.3	Confident	53 Å²	53	89.6 Å²	89.6	34%	0.344	43%	0.426	S	S	.	.	H	α-helix	trans	-55.4	-33.3	-179.9	21.8	-34.7	0	0	0	113.3	V177 I186 A187 L188	V177-P184 HydrophobicContact CG1-CB 3.97Å; P184-I186 PolarHBondContact O-N 2.97Å; P184-A187 PolarHBondContact O-N 3.09Å; P184-L188 WeakPolarHBondContact O-CG 3.35Å; P184-L188 PolarHBondContact O-N 2.86Å; P184-L188 VanDerWaalsContact O-N 3.07Å
185	E	70	Confident	68.2	Low	125 Å²	125	92.7 Å²	92.7	58%	0.584	45%	0.448	S	S	*	.	H	α-helix	trans	-66.1	-25.1	175.6	-89.5	-144.7	64.8	0	0	113.5	D183 K189	D183-E185 PolarHBondContact O-N 3.17Å; D183-E185 VanDerWaalsContact O-N 3.17Å; D183-E185 WeakPolarHBondContact OD1-CB 3.41Å; D183-E185 PolarHBondContact OD1-N 3.32Å; E185-K189 VanDerWaalsContact O-CD 3.25Å; E185-K189 WeakPolarHBondContact O-CD 3.5Å; E185-K189 WeakPolarHBondContact O-CE 3.44Å; E185-K189 VanDerWaalsContact O-CG 3.23Å; E185-K189 WeakPolarHBondContact O-CG 3.28Å; E185-K189 PolarHBondContact O-NZ 3.4Å; E185-K189 IonicContact OE1-NZ 3.19Å; E185-K189 PolarHBondContact OE1-NZ 3.26Å
186	I	72.6	Confident	65.7	Low	95 Å²	95	100.1 Å²	100.1	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-85.5	-42	177.4	-61.2	174.9	0	0	0	109.5	V182 D183 P184 L188 K189 I190	V182-I186 HydrophobicContact CG1-CB 4.32Å; V182-I186 HydrophobicContact CG1-CG2 4.4Å; D183-I186 HydrophobicContact CB-CD1 3.99Å; D183-I186 HydrophobicContact CB-CG1 4.13Å; D183-I186 WeakPolarHBondContact O-CA 3.46Å; D183-I186 WeakPolarHBondContact O-CB 3.29Å; D183-I186 PolarHBondContact O-N 3.25Å; P184-I186 PolarHBondContact O-N 2.97Å; I186-L188 PolarHBondContact O-N 3.47Å; I186-K189 PolarHBondContact O-N 3.24Å; I186-K189 VanDerWaalsContact O-N 3.09Å; I186-I190 HydrophobicContact CG2-CD1 4.1Å; I186-I190 WeakPolarHBondContact O-CG1 3.3Å; I186-I190 PolarHBondContact O-N 3.12Å; I186-I190 VanDerWaalsContact O-N 3.07Å
187	A	63.5	Low	63.6	Low	5 Å²	5	103.4 Å²	103.4	4%	0.041	51%	0.506	C	S	.	.	H	α-helix	trans	-57.5	-45.4	176	0	0	0	0	0	112.3	L173 V177 V182 D183 P184 K189 I190 L191	L173-A187 HydrophobicContact CD1-CB 3.96Å; L173-A187 HydrophobicContact CD2-CB 4.11Å; L173-A187 HydrophobicContact CG-CB 4.03Å; V177-A187 HydrophobicContact CG2-CB 3.45Å; V177-A187 VanDerWaalsContact CG2-CB 3.45Å; V182-A187 HydrophobicContact CG1-CB 4.19Å; D183-A187 PolarHBondContact O-N 3.06Å; P184-A187 PolarHBondContact O-N 3.09Å; A187-K189 VanDerWaalsContact C-N 3.27Å; A187-K189 PolarHBondContact O-N 2.87Å; A187-I190 WeakPolarHBondContact O-CB 3.21Å; A187-I190 PolarHBondContact O-N 3.01Å; A187-I190 VanDerWaalsContact O-N 3.1Å; A187-L191 WeakPolarHBondContact O-CG 3.49Å; A187-L191 PolarHBondContact O-N 2.87Å
188	L	63.3	Low	61	Low	92 Å²	92	107.6 Å²	107.6	48%	0.482	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-31.8	176.3	-70.2	167.9	0	0	0	113	P184 I186 H192	P184-L188 WeakPolarHBondContact O-CG 3.35Å; P184-L188 PolarHBondContact O-N 2.86Å; P184-L188 VanDerWaalsContact O-N 3.07Å; I186-L188 PolarHBondContact O-N 3.47Å; L188-H192 WeakPolarHBondContact O-CB 3.04Å; L188-H192 PolarHBondContact O-N 3.33Å; L188-H192 VanDerWaalsContact O-N 3.13Å; L188-H192 PolarHBondContact O-ND1 2.83Å
189	K	62.3	Low	58.6	Low	129 Å²	129	110.6 Å²	110.6	56%	0.561	55%	0.552	S	S	*	*	H	α-helix	trans	-77.8	-21.1	176.9	-67.6	173.1	-171.8	105.1	0	112.6	E185 I186 A187	E185-K189 VanDerWaalsContact O-CD 3.25Å; E185-K189 WeakPolarHBondContact O-CD 3.5Å; E185-K189 WeakPolarHBondContact O-CE 3.44Å; E185-K189 VanDerWaalsContact O-CG 3.23Å; E185-K189 WeakPolarHBondContact O-CG 3.28Å; E185-K189 PolarHBondContact O-NZ 3.4Å; E185-K189 IonicContact OE1-NZ 3.19Å; E185-K189 PolarHBondContact OE1-NZ 3.26Å; I186-K189 PolarHBondContact O-N 3.24Å; I186-K189 VanDerWaalsContact O-N 3.09Å; A187-K189 VanDerWaalsContact C-N 3.27Å; A187-K189 PolarHBondContact O-N 2.87Å
190	I	63.9	Low	56.5	Low	102 Å²	102	116.1 Å²	116.1	52%	0.523	58%	0.582	S	S	.	*	H	α-helix	trans	-79	-47.5	170.9	-66.6	165.4	0	0	0	110.1	L173 I186 A187 R193	L173-I190 HydrophobicContact CD2-CG2 4.41Å; I186-I190 HydrophobicContact CG2-CD1 4.1Å; I186-I190 WeakPolarHBondContact O-CG1 3.3Å; I186-I190 PolarHBondContact O-N 3.12Å; I186-I190 VanDerWaalsContact O-N 3.07Å; A187-I190 WeakPolarHBondContact O-CB 3.21Å; A187-I190 PolarHBondContact O-N 3.01Å; A187-I190 VanDerWaalsContact O-N 3.1Å; I190-R193 PolarHBondContact O-N 3.08Å
191	L	61.6	Low	54.6	Low	73 Å²	73	113.4 Å²	113.4	38%	0.382	58%	0.581	S	S	.	*	H	α-helix	trans	-63.6	-43.9	-178.6	-72.5	168.1	0	0	0	113.4	Y170 L173 A187 R193	Y170-L191 HydrophobicContact CD2-CD1 4.37Å; Y170-L191 HydrophobicContact CD2-CD2 3.66Å; Y170-L191 HydrophobicContact CE2-CD1 3.84Å; Y170-L191 HydrophobicContact CE2-CD2 3.92Å; L173-L191 HydrophobicContact CD2-CD1 4Å; L173-L191 HydrophobicContact CD2-CD2 3.87Å; L173-L191 HydrophobicContact CD2-CG 3.63Å; A187-L191 WeakPolarHBondContact O-CG 3.49Å; A187-L191 PolarHBondContact O-N 2.87Å; L191-R193 VanDerWaalsContact C-N 3.26Å; L191-R193 PolarHBondContact O-N 3.12Å
192	H	53.3	Low	52.4	Low	145 Å²	145	112.4 Å²	112.4	67%	0.671	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	5.9	-177.9	-62.4	120	0	0	0	114.4	L188 Q194	L188-H192 WeakPolarHBondContact O-CB 3.04Å; L188-H192 PolarHBondContact O-N 3.33Å; L188-H192 VanDerWaalsContact O-N 3.13Å; L188-H192 PolarHBondContact O-ND1 2.83Å; H192-Q194 VanDerWaalsContact C-N 3.31Å; H192-Q194 PolarHBondContact O-N 3.37Å
193	R	46.4	Very low	50.2	Low	203 Å²	203	114.7 Å²	114.7	77%	0.766	62%	0.618	S	S	*	*	S	Bend	trans	-79	84.6	176.1	-159.3	175.8	-162.9	-146.2	3	110.2	I190 L191 T195	I190-R193 PolarHBondContact O-N 3.08Å; L191-R193 VanDerWaalsContact C-N 3.26Å; L191-R193 PolarHBondContact O-N 3.12Å; R193-T195 PolarHBondContact O-N 3.26Å; R193-T195 PolarHBondContact O-OG1 2.94Å
194	Q	35.2	Very low	48	Very low	195 Å²	195	117.4 Å²	117.4	91%	0.911	63%	0.633	S	S	*	*			trans	-43.6	94.9	-175.5	-167	171.4	61.5	0	0	112.5	H192 N196	H192-Q194 VanDerWaalsContact C-N 3.31Å; H192-Q194 PolarHBondContact O-N 3.37Å; Q194-N196 PolarHBondContact O-N 2.89Å
195	T	38.4	Very low	46.5	Very low	111 Å²	111	120.6 Å²	120.6	68%	0.681	65%	0.653	S	S	*	*			trans	-89.9	103.5	-177.4	-65.5	0	0	0	0	107.7	R193 I197	R193-T195 PolarHBondContact O-N 3.26Å; R193-T195 PolarHBondContact O-OG1 2.94Å; T195-I197 HydrophobicContact CG2-CG1 4.39Å; T195-I197 WeakPolarHBondContact O-CG1 3.25Å; T195-I197 PolarHBondContact O-N 3.29Å; T195-I197 VanDerWaalsContact O-N 3.12Å
196	N	34.1	Very low	44.6	Very low	156 Å²	156	123.3 Å²	123.3	83%	0.834	67%	0.666	S	S	*	*			trans	-72.8	102.6	-180	-169.7	23.7	0	0	0	109.8	Q194 P198	Q194-N196 PolarHBondContact O-N 2.89Å; N196-P198 WeakPolarHBondContact O-CD 3.47Å
197	I	38.7	Very low	43	Very low	126 Å²	126	123.8 Å²	123.8	65%	0.646	68%	0.676	S	S	*	*			trans	-89.4	119.1	-177.3	-43.4	179.8	0	0	0	109.3	T195 T199	T195-I197 HydrophobicContact CG2-CG1 4.39Å; T195-I197 WeakPolarHBondContact O-CG1 3.25Å; T195-I197 PolarHBondContact O-N 3.29Å; T195-I197 VanDerWaalsContact O-N 3.12Å; I197-T199 PolarHBondContact O-N 2.82Å
198	P	30.9	Very low	41.6	Very low	109 Å²	109	130.7 Å²	130.7	71%	0.708	72%	0.717	S	S	*	*			trans	-62.4	121.7	169.8	-20.2	33.3	0	0	0	110.1	N196 L200	N196-P198 WeakPolarHBondContact O-CD 3.47Å; P198-L200 PolarHBondContact O-N 2.93Å; P198-L200 VanDerWaalsContact O-N 3.11Å
199	T	31	Very low	40.3	Very low	123 Å²	123	135.8 Å²	135.8	76%	0.755	74%	0.738	S	S	*	*			trans	-69.2	107.9	-178.1	-43.1	0	0	0	0	110.6	I197 I201	I197-T199 PolarHBondContact O-N 2.82Å; T199-I201 PolarHBondContact O-N 3.35Å; T199-I201 VanDerWaalsContact O-N 3.12Å
200	L	37.9	Very low	38.8	Very low	169 Å²	169	133.2 Å²	133.2	89%	0.885	75%	0.748	S	S	*	*			trans	-75.1	99.9	168.7	-66.3	-177.4	0	0	0	109	P198 A202	P198-L200 PolarHBondContact O-N 2.93Å; P198-L200 VanDerWaalsContact O-N 3.11Å; L200-A202 PolarHBondContact O-N 3.26Å
201	I	38	Very low	37.1	Very low	150 Å²	150	133.6 Å²	133.6	77%	0.769	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.2	121.5	-178.1	-69.9	166.7	0	0	0	110	T199	T199-I201 PolarHBondContact O-N 3.35Å; T199-I201 VanDerWaalsContact O-N 3.12Å
202	A	34.9	Very low	35.5	Very low	87 Å²	87	133.5 Å²	133.5	72%	0.719	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-68.4	148.6	165	0	0	0	0	0	110.4	L200	L200-A202 PolarHBondContact O-N 3.26Å
203	G	31.6	Very low	35	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	79%	0.794	S	S	*	*	S	Bend	trans	-59.5	133.2	-165.4	0	0	0	0	0	116
204	N	34	Very low	34.3	Very low	142 Å²	142	126.5 Å²	126.5	76%	0.759	79%	0.788	S	S	*	*			trans	17.9	104.1	161.3	-76.9	27.9	0	0	0	119.4
205	P	34.8	Very low	34.2	Very low	119 Å²	119	124 Å²	124	77%	0.773	79%	0.792	S	S	*	*			trans	-70.6	140.7	135.5	32.1	-32.3	0	0	0	110.3	P207	P205-P207 WeakPolarHBondContact O-CD 3.27Å
206	Q	30.9	Very low	33.8	Very low	182 Å²	182	121.7 Å²	121.7	85%	0.85	79%	0.791	S	S	*	*			trans	-103.9	113.2	171.2	-73.3	-167.8	-87.3	0	0	111.7
207	P	37.4	Very low	33.8	Very low	106 Å²	106	120.3 Å²	120.3	69%	0.688	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-95.1	132.2	163.8	33.8	-29.8	0	0	0	111.6	P205	P205-P207 WeakPolarHBondContact O-CD 3.27Å
208	V	34.9	Very low	33.3	Very low	149 Å²	149	121.8 Å²	121.8	90%	0.903	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-87.9	150.3	167.6	-70	0	0	0	0	111
209	H	36.6	Very low	33.6	Very low	199 Å²	199	122.5 Å²	122.5	92%	0.921	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.2	159.3	-164.4	-77.7	48.2	0	0	0	115.2
210	G	29.7	Very low	33.4	Very low	76 Å²	76	122 Å²	122	78%	0.784	81%	0.806	S	S	*	*			trans	175.6	85.5	159.4	0	0	0	0	0	116.6
211	A	28.8	Very low	32.9	Very low	109 Å²	109	122.9 Å²	122.9	90%	0.901	81%	0.808	S	S	*	*			trans	43.9	136.6	161.8	0	0	0	0	0	120.5
212	G	28.3	Very low	32.6	Very low	71 Å²	71	121.1 Å²	121.1	73%	0.732	80%	0.8	S	S	*	*			cis	99.3	143.9	9.7	0	0	0	0	0	113
213	P	42.7	Very low	32.5	Very low	139 Å²	139	123.8 Å²	123.8	90%	0.903	80%	0.798	S	S	*	*			cis	-105.1	-162.4	-10.9	43	-32.7	0	0	0	111.6
214	G	32.1	Very low	32.6	Very low	62 Å²	62	128.4 Å²	128.4	64%	0.639	80%	0.799	S	S	*	*			cis	139.4	142.3	-12.8	0	0	0	0	0	114.9
215	S	32.6	Very low	32.4	Very low	142 Å²	142	127.8 Å²	127.8	99%	0.993	80%	0.796	S	S	*	*			trans	76.1	148.2	-176.7	-45	0	0	0	0	116.9
216	G	30.7	Very low	33.3	Very low	64 Å²	64	127.1 Å²	127.1	66%	0.66	79%	0.791	S	S	*	*			cis	164.8	156.2	-9.9	0	0	0	0	0	114.2
217	S	32.8	Very low	33.2	Very low	127 Å²	127	126.2 Å²	126.2	89%	0.888	79%	0.787	S	S	*	*			trans	70.1	162.2	175.4	-40.3	0	0	0	0	116.2
218	N	29.2	Very low	33.2	Very low	156 Å²	156	125.4 Å²	125.4	83%	0.834	79%	0.789	S	S	*	*			cis	-148.1	172.8	3.9	-156.7	-1.8	0	0	0	112.1
219	V	37.1	Very low	33.8	Very low	125 Å²	125	123.4 Å²	123.4	76%	0.758	78%	0.779	S	S	*	*			trans	-105.7	147.2	-176.8	175.1	0	0	0	0	112.8
220	S	26	Very low	33.8	Very low	112 Å²	112	122.9 Å²	122.9	78%	0.783	78%	0.777	S	S	*	*			trans	-168.2	161.3	154.2	-90.5	0	0	0	0	115
221	M	28.7	Very low	34.2	Very low	187 Å²	187	123.1 Å²	123.1	92%	0.921	77%	0.771	S	S	*	*			trans	73.3	137.5	172.7	-71.8	-171.6	172	0	0	117.7
222	N	30.1	Very low	34.5	Very low	113 Å²	113	126.4 Å²	126.4	60%	0.604	77%	0.768	S	S	*	*			cis	-164.8	141.8	-7	170.8	57.3	0	0	0	112.9
223	Q	34.1	Very low	34.7	Very low	144 Å²	144	128.2 Å²	128.2	67%	0.673	77%	0.77	S	S	*	*			trans	62	156	165.5	-80	160.7	52.3	0	0	117.7
224	Q	33.1	Very low	34.4	Very low	173 Å²	173	129.3 Å²	129.3	81%	0.808	77%	0.767	S	S	*	*			cis	-146.5	164.3	9.4	-142.1	157	-1.8	0	0	111.9
225	N	30.3	Very low	34.5	Very low	129 Å²	129	130 Å²	130	69%	0.69	78%	0.775	S	S	*	*			trans	-127.8	156.4	-179	-168.6	24.3	0	0	0	109.3	Q227	N225-Q227 PolarHBondContact OD1-N 2.86Å; N225-Q227 VanDerWaalsContact OD1-N 3.09Å
226	P	52.8	Low	34.4	Very low	105 Å²	105	127.2 Å²	127.2	68%	0.682	77%	0.768	S	S	*	*				-150.9	130.5	91.9	35.1	-14.9	0	0	0	118
227	Q	30.1	Very low	34.8	Very low	163 Å²	163	131.7 Å²	131.7	76%	0.762	77%	0.773	S	S	*	*			trans	59.8	123.5	134.9	-65.9	166	-98.2	0	0	120.1	N225	N225-Q227 PolarHBondContact OD1-N 2.86Å; N225-Q227 VanDerWaalsContact OD1-N 3.09Å
228	A	35.8	Very low	35	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	77%	0.767	S	S	*	*				81.3	150.9	60.7	0	0	0	0	0	113.5
229	P	48.6	Very low	35.5	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	77%	0.765	S	S	*	*			cis	-123.2	155.2	22.8	41.3	-26.2	0	0	0	116.4
230	Q	36	Very low	35.4	Very low	188 Å²	188	133.9 Å²	133.9	88%	0.879	77%	0.77	S	S	*	*				61.4	151.8	87.3	-46.2	-174.1	-82.2	0	0	116.5
231	A	37.8	Very low	35.6	Very low	80 Å²	80	132.4 Å²	132.4	66%	0.661	77%	0.773	S	S	*	*			cis	-143.4	-164.5	13.9	0	0	0	0	0	111.2
232	Q	36	Very low	35.7	Very low	179 Å²	179	128.3 Å²	128.3	84%	0.836	77%	0.768	S	S	*	*			cis	-145.9	-128.2	7.1	-165.2	119.4	-26.9	0	0	112.8
233	S	32.8	Very low	37.5	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	78%	0.776	S	S	*	*			trans	-167.8	-162.9	-168.3	-156.2	0	0	0	0	115.2
234	L	36.8	Very low	38.7	Very low	162 Å²	162	126.8 Å²	126.8	85%	0.848	78%	0.777	S	S	*	*			trans	85.2	141.5	175.3	-60.6	114.3	0	0	0	118.6
235	G	32.1	Very low	39	Very low	77 Å²	77	125.3 Å²	125.3	79%	0.794	77%	0.774	S	S	*	*			cis	158.4	132.2	-16.4	0	0	0	0	0	117.7
236	G	32.2	Very low	39.3	Very low	83 Å²	83	126.4 Å²	126.4	86%	0.856	78%	0.777	S	S	*	*			trans	80.9	169.4	159.1	0	0	0	0	0	119.6
237	M	39.1	Very low	38.4	Very low	157 Å²	157	129.1 Å²	129.1	77%	0.773	78%	0.781	S	S	*	*			cis	-172.1	132.2	-22.7	-174	165.9	-176.9	0	0	113.4
238	H	36.9	Very low	38.7	Very low	162 Å²	162	125.4 Å²	125.4	75%	0.75	78%	0.778	S	S	*	*			trans	62.7	169.9	163.8	-73.9	-155.5	0	0	0	117.8
239	V	39.4	Very low	38.7	Very low	131 Å²	131	125.3 Å²	125.3	79%	0.794	77%	0.772	S	S	*	*			cis	-141.6	171.1	18.9	-76.6	0	0	0	0	115
240	N	33.7	Very low	38.3	Very low	161 Å²	161	127.7 Å²	127.7	86%	0.861	78%	0.775	S	S	*	*			trans	-41.7	160.7	176.8	-56	-86.5	0	0	0	121.5
241	G	31.5	Very low	38.3	Very low	82 Å²	82	127.6 Å²	127.6	85%	0.845	78%	0.775	S	S	*	*			trans	-170.3	153.8	160.2	0	0	0	0	0	112.8
242	A	31.2	Very low	37.9	Very low	100 Å²	100	127.3 Å²	127.3	83%	0.826	78%	0.779	S	S	*	*			trans	-131.9	166.1	-169.9	0	0	0	0	0	113.6
243	P	68	Low	37.7	Very low	117 Å²	117	122 Å²	122	76%	0.76	77%	0.773	S	S	*	*			trans	-90	-176	-169.7	43.8	-40.2	0	0	0	111.7
244	P	59.2	Low	37.9	Very low	108 Å²	108	124 Å²	124	70%	0.701	78%	0.78	S	S	*	*				-161.5	-160.7	57.8	42.3	-15.9	0	0	0	118.4
245	L	38.7	Very low	38.6	Very low	143 Å²	143	122.3 Å²	122.3	75%	0.749	78%	0.779	S	S	*	*			trans	75.6	121.4	155.9	-68.4	169.2	0	0	0	119
246	M	36.2	Very low	39	Very low	151 Å²	151	122.8 Å²	122.8	74%	0.744	78%	0.776	S	S	*	*				83.8	151.3	86.3	-120.1	-175.1	-176.8	0	0	112.9
247	Q	34.8	Very low	40.1	Very low	163 Å²	163	125.2 Å²	125.2	76%	0.762	78%	0.776	S	S	*	*			cis	-150.5	177.6	8.7	-165.7	162.4	8.2	0	0	112.2
248	A	35.3	Very low	40	Very low	85 Å²	85	121.1 Å²	121.1	70%	0.702	78%	0.775	S	S	*	*			trans	-75.2	-161.3	-175.4	0	0	0	0	0	114.7
249	S	36.1	Very low	39.9	Very low	87 Å²	87	122.1 Å²	122.1	61%	0.608	78%	0.779	S	S	*	*			cis	-172	-179	26.6	-1.4	0	0	0	0	114.4
250	M	39.9	Very low	39.8	Very low	156 Å²	156	122.6 Å²	122.6	77%	0.768	78%	0.776	S	S	*	*			trans	85.1	130.3	167.7	-44.6	-56.1	173.3	0	0	115.7
251	Q	36.5	Very low	40.7	Very low	187 Å²	187	119.6 Å²	119.6	87%	0.874	77%	0.765	S	S	*	*			cis	-160.5	176.7	-9.3	-117	176	79.6	0	0	106.9
252	G	30.5	Very low	40.9	Very low	73 Å²	73	122 Å²	122	75%	0.753	76%	0.764	S	S	*	*			cis	149	140.7	3.7	0	0	0	0	0	108.9
253	G	30.2	Very low	41	Very low	68 Å²	68	121.6 Å²	121.6	70%	0.701	76%	0.761	S	S	*	*			cis	178.5	-151.2	0.8	0	0	0	0	0	113
254	V	37.6	Very low	39.4	Very low	150 Å²	150	122.3 Å²	122.3	91%	0.909	76%	0.763	S	S	*	*			trans	69.6	144	168.1	-61	0	0	0	0	120.8
255	P	52	Low	38.1	Very low	127 Å²	127	123.6 Å²	123.6	83%	0.825	77%	0.769	S	S	*	*			trans	-140.7	-172.5	-138.3	42.9	-22.3	0	0	0	118.6
256	A	40.7	Very low	37.9	Very low	88 Å²	88	119.8 Å²	119.8	73%	0.727	76%	0.764	S	S	*	*			trans	-85.9	-176.5	172.7	0	0	0	0	0	114.1
257	P	54.7	Low	38.5	Very low	133 Å²	133	119 Å²	119	86%	0.864	77%	0.77	S	S	*	*				-159.2	169.8	96.9	41.2	-22.2	0	0	0	119.9
258	G	36.9	Very low	38.4	Very low	72 Å²	72	114.3 Å²	114.3	74%	0.742	77%	0.765	S	S	*	*			trans	98.8	162.2	140.4	0	0	0	0	0	120.6
259	Q	35.6	Very low	39.6	Very low	182 Å²	182	117 Å²	117	85%	0.85	78%	0.775	S	S	*	*			cis	-161.2	-145.8	-24.8	-136.6	-166.3	104.1	0	0	114.2
260	I	35.8	Very low	39.4	Very low	141 Å²	141	116.5 Å²	116.5	72%	0.723	78%	0.784	S	S	*	*			trans	-130.8	-171.9	-168.8	60.6	173.8	0	0	0	111.3
261	P	54.1	Low	39.5	Very low	98 Å²	98	114.8 Å²	114.8	64%	0.636	79%	0.788	S	S	*	*			cis	-147	174.1	2.8	41.8	-20.1	0	0	0	120.6
262	T	34.9	Very low	39.6	Very low	134 Å²	134	114.3 Å²	114.3	82%	0.822	79%	0.79	S	S	*	*			trans	63	141.9	142.4	47.5	0	0	0	0	127.5
263	A	32.8	Very low	39.9	Very low	91 Å²	91	114.7 Å²	114.7	75%	0.752	79%	0.786	S	S	*	*			trans	97	109.5	135.1	0	0	0	0	0	124.5
264	V	35.9	Very low	41.1	Very low	132 Å²	132	117.6 Å²	117.6	80%	0.8	79%	0.793	S	S	*	*			trans	3	135.6	144.5	54.6	0	0	0	0	122.8
265	T	30.5	Very low	40.9	Very low	135 Å²	135	114.5 Å²	114.5	83%	0.828	79%	0.791	S	S	*	*				179.5	149.4	129.5	-77.7	0	0	0	0	112.1
266	G	33.9	Very low	40	Very low	63 Å²	63	112.5 Å²	112.5	65%	0.649	79%	0.794	S	S	*	*			trans	-109.6	-157.7	170.2	0	0	0	0	0	112.1
267	P	50.4	Low	39.7	Very low	133 Å²	133	111.7 Å²	111.7	86%	0.864	79%	0.794	S	S	*	*			cis	-126.8	-159.5	-0.1	41.7	-23.3	0	0	0	112.8
268	G	33	Very low	39.1	Very low	65 Å²	65	113.6 Å²	113.6	67%	0.67	79%	0.793	S	S	*	*			trans	-103.7	-159.2	158.6	0	0	0	0	0	111.4
269	P	59.8	Low	39.2	Very low	141 Å²	141	118.7 Å²	118.7	92%	0.916	80%	0.798	S	S	*	*			cis	-126.4	-165.8	-9.2	42.6	-27	0	0	0	112.3
270	G	31.1	Very low	39.5	Very low	77 Å²	77	114.3 Å²	114.3	79%	0.794	79%	0.793	S	S	*	*			trans	174.4	141.5	165.7	0	0	0	0	0	116.5
271	S	42.6	Very low	39.4	Very low	120 Å²	120	116.6 Å²	116.6	84%	0.839	80%	0.8	S	S	*	*			trans	-124.2	156.7	177.7	-51	0	0	0	0	111
272	L	37.7	Very low	38.6	Very low	177 Å²	177	118.7 Å²	118.7	93%	0.927	81%	0.811	S	S	*	*			trans	-171.6	151	148.6	-105.6	159.3	0	0	0	112.7
273	A	38	Very low	38.4	Very low	81 Å²	81	115.8 Å²	115.8	67%	0.669	81%	0.808	S	S	*	*			trans	-123.6	-177.4	167.6	0	0	0	0	0	108.5
274	P	55.6	Low	38.7	Very low	129 Å²	129	120.3 Å²	120.3	84%	0.838	82%	0.816	S	S	*	*				-159.7	168.6	80	40.9	-20.3	0	0	0	118.9
275	G	33.8	Very low	39.5	Very low	85 Å²	85	120.2 Å²	120.2	88%	0.876	82%	0.818	S	S	*	*			trans	84.2	146	155.6	0	0	0	0	0	117.6
276	G	32.4	Very low	39.7	Very low	86 Å²	86	116.8 Å²	116.8	89%	0.887	81%	0.809	S	S	*	*			cis	155.6	147.6	-6	0	0	0	0	0	110.3
277	G	33.5	Very low	39.8	Very low	70 Å²	70	119.7 Å²	119.7	72%	0.722	82%	0.82	S	S	*	*			cis	175.9	-176.6	-5	0	0	0	0	0	111.1
278	M	43.4	Very low	38.8	Very low	174 Å²	174	116.7 Å²	116.7	86%	0.857	81%	0.813	S	S	*	*			trans	68.3	149.1	170.4	-60.5	179.9	174.5	0	0	117.9
279	Q	38.9	Very low	39.9	Very low	178 Å²	178	119 Å²	119	83%	0.832	82%	0.816	S	S	*	*			cis	-157.5	174.4	-19.6	-117.7	172.3	13.4	0	0	109.7
280	A	40.8	Very low	39	Very low	90 Å²	90	118.4 Å²	118.4	74%	0.744	81%	0.809	S	S	*	*			trans	-120.9	163	178.1	0	0	0	0	0	111.8
281	Q	33.7	Very low	39.1	Very low	189 Å²	189	119 Å²	119	88%	0.883	80%	0.802	S	S	*	*			trans	-152	157.7	171.5	-161.1	65	-12	0	0	112.2
282	V	38.6	Very low	38.8	Very low	142 Å²	142	121.4 Å²	121.4	86%	0.861	80%	0.802	S	S	*	*			trans	-105.3	150.9	-168	179.5	0	0	0	0	112.1
283	G	30.1	Very low	38.8	Very low	74 Å²	74	122 Å²	122	76%	0.763	80%	0.8	S	S	*	*			trans	-170	107.6	172.4	0	0	0	0	0	118
284	M	39.9	Very low	38.7	Very low	186 Å²	186	128.7 Å²	128.7	92%	0.916	81%	0.808	S	S	*	*			trans	-137.8	164.7	151.6	-93.7	-163.5	172.3	0	0	106.4
285	P	51.8	Low	37.6	Very low	130 Å²	130	126.4 Å²	126.4	84%	0.844	81%	0.807	S	S	*	*			cis	-134.6	-166.1	14.9	43.5	-26.4	0	0	0	114.3
286	G	35.2	Very low	37.7	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	81%	0.807	S	S	*	*			trans	151.2	111	149.8	0	0	0	0	0	119.4
287	S	36.3	Very low	37.7	Very low	124 Å²	124	130.1 Å²	130.1	87%	0.867	80%	0.796	S	S	*	*			trans	46.3	132.5	144.2	50.3	0	0	0	0	123.4
288	G	29.7	Very low	37.7	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	80%	0.801	S	S	*	*			trans	-85.1	-141.6	158.9	0	0	0	0	0	112.7
289	P	55.3	Low	37.2	Very low	113 Å²	113	131.7 Å²	131.7	73%	0.734	80%	0.795	S	S	*	*			cis	-141.5	-158.1	11.7	39.3	-16.3	0	0	0	115.4
290	V	39.9	Very low	37	Very low	128 Å²	128	131.1 Å²	131.1	78%	0.776	79%	0.793	S	S	*	*			trans	66	150.5	159.7	-65.8	0	0	0	0	119.9
291	S	34.2	Very low	36.6	Very low	91 Å²	91	135.7 Å²	135.7	64%	0.636	80%	0.798	S	S	*	*			cis	-165.7	165.3	-9.9	-110	0	0	0	0	113.3
292	M	36	Very low	36.9	Very low	170 Å²	170	131.8 Å²	131.8	84%	0.837	79%	0.792	S	S	*	*			trans	64.3	161.1	158.5	-88.4	58	177.6	0	0	117.5
293	E	38.1	Very low	37.6	Very low	189 Å²	189	131.1 Å²	131.1	88%	0.883	79%	0.791	S	S	*	*			cis	-132.4	175.6	11.9	-167.4	158.7	78.8	0	0	113.8
294	R	34.7	Very low	37.8	Very low	222 Å²	222	134.6 Å²	134.6	84%	0.838	80%	0.797	S	S	*	*			trans	-128.3	121	-170.3	174.7	-161.4	-163.9	-179.7	7.2	110.4
295	G	33.8	Very low	37.4	Very low	80 Å²	80	128.8 Å²	128.8	83%	0.825	78%	0.784	S	S	*	*			trans	-121.1	125.8	177.1	0	0	0	0	0	113.8
296	Q	35.2	Very low	37.6	Very low	186 Å²	186	128.9 Å²	128.9	87%	0.869	79%	0.785	S	S	*	*			trans	-132.7	146.6	168.1	-77.5	-176.6	-17.9	0	0	109.5
297	G	32.8	Very low	37.5	Very low	64 Å²	64	131 Å²	131	66%	0.66	80%	0.796	S	S	*	*			trans	132.4	111.3	-179.8	0	0	0	0	0	109.9
298	T	33.4	Very low	37.2	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	79%	0.79	S	S	*	*			cis	82.5	138.7	37.7	78.2	0	0	0	0	115.8
299	L	33.3	Very low	38.2	Very low	143 Å²	143	131.7 Å²	131.7	75%	0.749	80%	0.798	S	S	*	*			trans	79.4	99.3	174.7	-65	115.6	0	0	0	120.6
300	Q	33.7	Very low	37.1	Very low	167 Å²	167	131.2 Å²	131.2	78%	0.78	80%	0.804	S	S	*	*				49.4	126.1	125.7	-51.2	-166.3	118	0	0	121.3
301	H	33.9	Very low	36.8	Very low	185 Å²	185	130.5 Å²	130.5	86%	0.856	80%	0.804	S	S	*	*				-161.7	145.2	113.9	-118.4	-131.9	0	0	0	114.3
302	S	38.8	Very low	36.8	Very low	108 Å²	108	134 Å²	134	76%	0.755	81%	0.814	S	S	*	*			trans	-159.2	148.7	167.6	-78.9	0	0	0	0	104.7
303	P	52.9	Low	36.7	Very low	127 Å²	127	134.2 Å²	134.2	83%	0.825	81%	0.813	S	S	*	*			cis	-149.4	-179.1	48.1	42.5	-23.6	0	0	0	116.4
304	V	36.1	Very low	36.7	Very low	148 Å²	148	135.9 Å²	135.9	90%	0.897	81%	0.812	S	S	*	*			trans	-158.2	147.9	141.5	68.6	0	0	0	0	112
305	G	30.8	Very low	36.5	Very low	63 Å²	63	132 Å²	132	65%	0.649	81%	0.812	S	S	*	*			trans	-165.2	-164.5	165.4	0	0	0	0	0	107.4
306	P	54.9	Low	36.3	Very low	132 Å²	132	135.1 Å²	135.1	86%	0.857	81%	0.805	S	S	*	*			cis	-125.4	170.9	-8.9	41.2	-28.3	0	0	0	112.9
307	A	33.6	Very low	36.5	Very low	108 Å²	108	131.8 Å²	131.8	89%	0.893	80%	0.797	S	S	*	*			trans	-164.1	138.2	155.4	0	0	0	0	0	114.2
308	G	30.8	Very low	37.2	Very low	72 Å²	72	134 Å²	134	74%	0.742	80%	0.8	S	S	*	*			trans	-158.4	-172.2	154.9	0	0	0	0	0	106.9
309	P	51.2	Low	37.3	Very low	136 Å²	136	135.2 Å²	135.2	88%	0.883	80%	0.798	S	S	*	*			cis	-124.5	170.6	-6.8	41	-27.9	0	0	0	113.3
310	A	30.2	Very low	37.3	Very low	103 Å²	103	136.1 Å²	136.1	85%	0.851	80%	0.799	S	S	*	*			trans	-161.9	156.5	160.1	0	0	0	0	0	112.2
311	S	35.5	Very low	37.6	Very low	113 Å²	113	134 Å²	134	79%	0.79	79%	0.793	S	S	*	*			trans	-129.6	143.3	178	-52.8	0	0	0	0	110.7
312	I	34.3	Very low	38.4	Very low	164 Å²	164	131 Å²	131	84%	0.841	79%	0.79	S	S	*	*			trans	169.9	161.1	163.5	-115.1	59.6	0	0	0	106
313	E	33.1	Very low	38	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	79%	0.794	S	S	*	*			cis	-167.2	174.4	-39	-180	162.1	78.7	0	0	106.4
314	R	38.5	Very low	36.9	Very low	224 Å²	224	134.6 Å²	134.6	85%	0.845	79%	0.788	S	S	*	*			trans	-100.8	131.2	-175.2	-68	174.7	171.2	164.5	-5.7	114.6
315	V	30.3	Very low	36.8	Very low	139 Å²	139	132.3 Å²	132.3	84%	0.842	79%	0.785	S	S	*	*			trans	-147.7	130.2	154.1	-175.5	0	0	0	0	108.5
316	Q	29.9	Very low	36.9	Very low	146 Å²	146	138.7 Å²	138.7	68%	0.682	80%	0.8	S	S	*	*			cis	103.7	73.2	-1.3	-150.7	67.3	49.1	0	0	118.7
317	V	38.4	Very low	36.2	Very low	117 Å²	117	141.3 Å²	141.3	71%	0.709	80%	0.801	S	S	*	*			trans	60.3	-174.1	161.4	-51.1	0	0	0	0	115.4
318	P	48.3	Very low	36	Very low	109 Å²	109	148.4 Å²	148.4	71%	0.708	81%	0.805	S	S	*	*			cis	-98.3	-165.1	33.5	45.4	-42.1	0	0	0	112.8
319	M	34.8	Very low	35.9	Very low	160 Å²	160	148.4 Å²	148.4	79%	0.788	81%	0.805	S	S	*	*			cis	-158.4	-178.9	0.4	-137.4	166.7	-169.2	0	0	107.6
320	Q	33.5	Very low	35	Very low	161 Å²	161	147.9 Å²	147.9	75%	0.752	80%	0.804	S	S	*	*			cis	-154.3	176.5	1.5	-161.6	170.5	97.2	0	0	108.9
321	D	39.8	Very low	35.2	Very low	123 Å²	123	151 Å²	151	66%	0.658	81%	0.806	S	S	*	*			trans	-145.5	161.2	176	-167.3	-99.5	0	0	0	108.9	R323	D321-R323 PolarHBondContact OD1-N 2.95Å
322	P	50.5	Low	35.8	Very low	123 Å²	123	151.1 Å²	151.1	80%	0.799	80%	0.804	S	S	*	*				-154.2	107	116	35.4	-14.8	0	0	0	117.7
323	R	30	Very low	35.7	Very low	225 Å²	225	147.7 Å²	147.7	85%	0.849	80%	0.8	S	S	*	*				23.5	136.1	123.7	-157.2	-166.6	162.2	148.5	-1.1	122.5	D321	D321-R323 PolarHBondContact OD1-N 2.95Å
324	A	31.1	Very low	35.7	Very low	84 Å²	84	147 Å²	147	69%	0.694	80%	0.802	S	S	*	*			trans	95.6	110	144.3	0	0	0	0	0	123.9
325	A	32.6	Very low	35.7	Very low	101 Å²	101	142.3 Å²	142.3	84%	0.835	80%	0.798	S	S	*	*				42	124	125.9	0	0	0	0	0	123.6
326	M	33.9	Very low	36.6	Very low	196 Å²	196	140.8 Å²	140.8	97%	0.966	79%	0.791	S	S	*	*			trans	-157.8	157.8	138.3	-119.3	-173.6	-168.5	0	0	113.3
327	Q	39.3	Very low	36.9	Very low	187 Å²	187	140 Å²	140	87%	0.874	80%	0.796	S	S	*	*			trans	-106.5	132	170	-65.8	177.2	5.1	0	0	110.9
328	R	29.1	Very low	37.5	Very low	258 Å²	258	140.5 Å²	140.5	97%	0.974	80%	0.802	S	S	*	*			trans	-177.7	153.4	134.8	-107.3	176.8	171.9	-129.2	-5.7	110
329	G	29.1	Very low	36.8	Very low	71 Å²	71	146 Å²	146	73%	0.732	81%	0.809	S	S	*	*			trans	-127.5	167.9	177.1	0	0	0	0	0	112.6
330	S	32.4	Very low	36.6	Very low	126 Å²	126	141 Å²	141	88%	0.881	80%	0.798	S	S	*	*			trans	-154.6	146.9	162.6	-84.4	0	0	0	0	109.5
331	L	34.9	Very low	36.8	Very low	167 Å²	167	140.5 Å²	140.5	87%	0.874	80%	0.8	S	S	*	*			trans	-95	174.2	169.6	-70.7	172	0	0	0	108.9
332	P	47.1	Very low	36.7	Very low	116 Å²	116	143 Å²	143	75%	0.753	81%	0.812	S	S	*	*			cis	-144.8	-174.5	18.1	44.3	-24.7	0	0	0	118.3
333	A	33.3	Very low	35.9	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	81%	0.805	S	S	*	*			trans	69.5	96.7	146.3	0	0	0	0	0	121.3
334	N	33.5	Very low	36.1	Very low	161 Å²	161	137.1 Å²	137.1	86%	0.861	81%	0.806	S	S	*	*				-155.1	172.9	91.7	-156.2	4.3	0	0	0	110.4
335	V	38.5	Very low	36.3	Very low	125 Å²	125	137.4 Å²	137.4	76%	0.758	81%	0.808	S	S	*	*			trans	-149.1	159.3	-156.8	113.4	0	0	0	0	112.3
336	P	48.7	Very low	37.2	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	81%	0.806	S	S	*	*			cis	-130.9	177.6	-15.7	40	-24.8	0	0	0	114.5
337	T	35.3	Very low	37.3	Very low	128 Å²	128	136.3 Å²	136.3	79%	0.785	80%	0.799	S	S	*	*			trans	-118.6	139	154.5	-45.2	0	0	0	0	108.3
338	P	52.6	Low	37.2	Very low	129 Å²	129	134 Å²	134	84%	0.838	79%	0.792	S	S	*	*			trans	-65.7	151.5	176.3	26.6	-34.1	0	0	0	112.3
339	R	32.5	Very low	38.6	Very low	225 Å²	225	126.1 Å²	126.1	85%	0.849	78%	0.775	S	S	*	*			trans	-123.2	151.3	-164	155.7	-178.7	169	153	-0.2	111.1	L341	R339-L341 PolarHBondContact NH2-O 3.09Å
340	G	29.9	Very low	38.8	Very low	54 Å²	54	134.1 Å²	134.1	56%	0.557	78%	0.783	S	S	*	*			trans	-101.4	-176.5	167.2	0	0	0	0	0	115.4
341	L	39.2	Very low	38.5	Very low	150 Å²	150	132.3 Å²	132.3	79%	0.785	78%	0.784	S	S	*	*			trans	72.4	113.5	160.4	-63.2	173.9	0	0	0	120.2	R339	R339-L341 PolarHBondContact NH2-O 3.09Å
342	L	38.2	Very low	38.3	Very low	177 Å²	177	127.7 Å²	127.7	93%	0.927	78%	0.777	S	S	*	*				87.9	138.9	112.1	-168.1	66	0	0	0	120.3
343	G	31.9	Very low	37.8	Very low	63 Å²	63	128.6 Å²	128.6	65%	0.649	78%	0.78	S	S	*	*			trans	132.2	146.9	171.9	0	0	0	0	0	110.8
344	D	34.5	Very low	37.9	Very low	160 Å²	160	130.7 Å²	130.7	86%	0.856	78%	0.778	S	S	*	*			cis	-159	164.5	-20.1	-162.5	-103.1	0	0	0	107.5
345	A	36.3	Very low	37.9	Very low	91 Å²	91	130.2 Å²	130.2	75%	0.752	78%	0.775	S	S	*	*			trans	-131.1	122.5	-166.3	0	0	0	0	0	115.4
346	P	51.7	Low	37.6	Very low	121 Å²	121	129 Å²	129	79%	0.786	77%	0.772	S	S	*	*			trans	-134.1	110	157.4	33.7	-16.6	0	0	0	114.9
347	N	36.3	Very low	36.7	Very low	152 Å²	152	129.7 Å²	129.7	81%	0.813	77%	0.774	S	S	*	*			trans	51.5	97.3	130.5	-157.2	64.8	0	0	0	122.4
348	D	36.4	Very low	36.5	Very low	139 Å²	139	130 Å²	130	74%	0.743	78%	0.776	S	S	*	*			trans	68.2	173.2	132.9	-138.5	-128.1	0	0	0	119.5
349	P	58	Low	35.4	Very low	92 Å²	92	127.8 Å²	127.8	60%	0.597	78%	0.776	S	S	*	*				-119.9	-172.9	-71.3	40.8	-32.4	0	0	0	115.4
350	R	33	Very low	35.5	Very low	239 Å²	239	126 Å²	126	90%	0.902	78%	0.778	S	S	*	*			trans	77.3	83.7	157	-64.3	173	67.6	170.9	2.7	120.2
351	G	27.6	Very low	35.7	Very low	88 Å²	88	130.2 Å²	130.2	91%	0.907	79%	0.792	S	S	*	*				75	169.6	124.8	0	0	0	0	0	120.2
352	G	29.7	Very low	35.6	Very low	71 Å²	71	131.6 Å²	131.6	73%	0.732	80%	0.795	S	S	*	*			trans	140.6	64.4	165.9	0	0	0	0	0	119.1
353	T	35.8	Very low	36.1	Very low	134 Å²	134	127.9 Å²	127.9	82%	0.822	78%	0.781	S	S	*	*			trans	-153.9	92	150.3	-52	0	0	0	0	106.8
354	L	35.9	Very low	36.3	Very low	137 Å²	137	136.8 Å²	136.8	72%	0.717	80%	0.795	S	S	*	*				55.4	100.2	89.7	-69	161.3	0	0	0	111.7
355	L	32.9	Very low	36.1	Very low	151 Å²	151	132.8 Å²	132.8	79%	0.791	79%	0.791	S	S	*	*				67	128.3	85	-88.6	74.3	0	0	0	112.1
356	S	33.3	Very low	36.1	Very low	100 Å²	100	139 Å²	139	70%	0.699	80%	0.797	S	S	*	*			cis	-156.4	-171	2.3	-68.3	0	0	0	0	108.2
357	V	30.4	Very low	35.4	Very low	122 Å²	122	141.8 Å²	141.8	74%	0.739	80%	0.804	S	S	*	*			cis	-158.2	139.2	15.4	79	0	0	0	0	112.6
358	T	30.3	Very low	35.3	Very low	135 Å²	135	137.8 Å²	137.8	83%	0.828	80%	0.799	S	S	*	*			trans	27.9	137	154.3	60.2	0	0	0	0	123.6
359	G	29.1	Very low	36.3	Very low	82 Å²	82	137.1 Å²	137.1	85%	0.845	80%	0.802	S	S	*	*			trans	179.9	76.3	157.6	0	0	0	0	0	114.8
360	E	35.5	Very low	35.9	Very low	189 Å²	189	138.6 Å²	138.6	88%	0.883	81%	0.812	S	S	*	*			trans	-76.6	146.5	166.4	-75.9	-165.8	84.4	0	0	111.7
361	V	34.1	Very low	36.2	Very low	141 Å²	141	135.7 Å²	135.7	86%	0.855	81%	0.808	S	S	*	*				-175.5	156.2	103.1	-78.2	0	0	0	0	111.3
362	E	36.1	Very low	36.6	Very low	180 Å²	180	140.5 Å²	140.5	84%	0.841	81%	0.807	S	S	*	*			trans	-111.1	172.4	163	-114.5	-159.1	106.7	0	0	109.2
363	P	49.2	Very low	36.7	Very low	98 Å²	98	140.3 Å²	140.3	64%	0.636	81%	0.805	S	S	*	*			cis	-137.4	178.4	-14.7	40.6	-24	0	0	0	115.3
364	R	35.3	Very low	37.4	Very low	250 Å²	250	140.3 Å²	140.3	94%	0.943	81%	0.807	S	S	*	*			trans	66.6	113.9	145.3	-157.1	-179.8	-166.4	104.8	0.7	120.6
365	G	31.2	Very low	37.8	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	81%	0.81	S	S	*	*			trans	-148.9	156	162	0	0	0	0	0	111.5
366	Y	37.1	Very low	38	Very low	223 Å²	223	140.1 Å²	140.1	88%	0.875	81%	0.811	S	S	*	*			trans	-142.2	127.3	-166.9	-164.4	-82.8	0	0	0	111.7
367	L	37	Very low	38.5	Very low	179 Å²	179	142 Å²	142	94%	0.937	81%	0.808	S	S	*	*			trans	-160.7	164.1	163.1	-135.7	71.3	0	0	0	111.8
368	G	33.9	Very low	38.9	Very low	67 Å²	67	143.1 Å²	143.1	69%	0.691	81%	0.805	S	S	*	*			trans	-107.4	-170.8	-160.8	0	0	0	0	0	118.7
369	P	57.1	Low	39.3	Very low	126 Å²	126	141.5 Å²	141.5	82%	0.818	80%	0.795	S	S	*	*			trans	-112	172.7	-162.1	41.9	-35.9	0	0	0	115.9
370	P	48.9	Very low	40.4	Very low	123 Å²	123	143.5 Å²	143.5	80%	0.799	79%	0.793	S	S	*	*			trans	-131.8	120.1	158.3	35.8	-20.1	0	0	0	116.2
371	H	39.9	Very low	40.1	Very low	178 Å²	178	137.8 Å²	137.8	82%	0.824	79%	0.785	S	S	*	*			trans	14.3	158.5	137.2	-131.4	-117.7	0	0	0	125
372	Q	35.9	Very low	40.5	Very low	189 Å²	189	139.8 Å²	139.8	88%	0.883	79%	0.785	S	S	*	*			trans	85.4	150.5	169	-53.4	172.6	108.2	0	0	116.8
373	G	32.4	Very low	40.3	Very low	67 Å²	67	139.3 Å²	139.3	69%	0.691	78%	0.782	S	S	*	*			cis	151	120.7	-5.7	0	0	0	0	0	112.7
374	P	50.4	Low	39.7	Very low	133 Å²	133	139.2 Å²	139.2	86%	0.864	78%	0.784	S	S	*	*			trans	-102.4	150.2	-169	37.4	-34.7	0	0	0	116.3
375	P	43.7	Very low	39.6	Very low	121 Å²	121	139.7 Å²	139.7	79%	0.786	79%	0.786	S	S	*	*			trans	-112	164.7	173.5	39.3	-32.1	0	0	0	116.1
376	M	36.6	Very low	39.5	Very low	163 Å²	163	139.2 Å²	139.2	80%	0.803	78%	0.78	S	S	*	*			trans	-110	-174.1	173.7	-58.2	-80.2	-85.9	0	0	109.3
377	H	44.8	Very low	40.9	Very low	139 Å²	139	134.7 Å²	134.7	64%	0.644	78%	0.778	S	S	*	*			cis	-158.7	-160	9.5	-147.4	175.2	0	0	0	106.6
378	H	39.5	Very low	41.6	Very low	146 Å²	146	131.8 Å²	131.8	68%	0.676	77%	0.77	S	S	*	*			cis	-165.5	-174.7	-3.5	-142.7	4.9	0	0	0	104.8
379	V	36.9	Very low	42.6	Very low	102 Å²	102	134.7 Å²	134.7	62%	0.618	78%	0.777	S	S	*	*			cis	-152.4	-127.9	-8.4	66.1	0	0	0	0	104
380	P	53.9	Low	42.1	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	77%	0.774	S	S	*	*			cis	-63.9	-159.5	-48.7	-16	34.7	0	0	0	113.2
381	G	28.7	Very low	41.2	Very low	70 Å²	70	139.1 Å²	139.1	72%	0.722	78%	0.776	S	S	*	*			cis	-157.9	169.1	-3.3	0	0	0	0	0	110.3
382	H	41.9	Very low	41.4	Very low	183 Å²	183	137.7 Å²	137.7	85%	0.847	77%	0.774	S	S	*	*			trans	-143.8	-175.5	-151.5	-155.2	-102.3	0	0	0	115.6
383	E	31.9	Very low	41.3	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	78%	0.777	S	S	*	*			trans	95	150.8	166	-59.1	-165.1	63.1	0	0	119.4
384	S	36.2	Very low	41.2	Very low	95 Å²	95	141 Å²	141	66%	0.664	78%	0.78	S	S	*	*			cis	-175.9	169.9	-23.3	-91.9	0	0	0	0	111.6
385	R	34.1	Very low	40.4	Very low	261 Å²	261	138.5 Å²	138.5	99%	0.985	78%	0.778	S	S	*	*			trans	92.8	159.8	157.5	-145.2	170.6	-172.3	164.4	1.9	118.5
386	G	29.7	Very low	40.8	Very low	65 Å²	65	139.2 Å²	139.2	67%	0.67	78%	0.783	S	S	*	*			trans	-146.9	-141.8	-159.4	0	0	0	0	0	119.5
387	P	64.9	Low	41.1	Very low	128 Å²	128	138.3 Å²	138.3	83%	0.831	78%	0.78	S	S	*	*			trans	-79.1	-178	-152.5	36.3	-41.7	0	0	0	115.7
388	P	53.2	Low	41.4	Very low	118 Å²	118	137.7 Å²	137.7	77%	0.766	79%	0.788	S	S	*	*			cis	-132.6	-153.2	21	44.3	-22.8	0	0	0	113.4
389	P	53.2	Low	41.3	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	78%	0.784	S	S	*	*			cis	-133.8	-124.6	0.5	42.5	-19.6	0	0	0	116.4
390	H	46.7	Very low	42.1	Very low	162 Å²	162	137.9 Å²	137.9	75%	0.75	79%	0.794	S	S	*	*			trans	-159.5	143.1	-161.3	178.5	88.9	0	0	0	112.1
391	E	30.9	Very low	41.5	Very low	181 Å²	181	141.8 Å²	141.8	85%	0.846	79%	0.793	S	S	*	*			trans	-162.4	179.1	159.2	-126.1	-171	118.7	0	0	114.6
392	L	44.2	Very low	42.6	Very low	148 Å²	148	143.9 Å²	143.9	78%	0.775	79%	0.793	S	S	*	*			trans	-117.1	-175.4	-162.8	-72	160.1	0	0	0	114.1
393	R	32.8	Very low	42.4	Very low	253 Å²	253	142.8 Å²	142.8	96%	0.955	79%	0.793	S	S	*	*			trans	86.5	139.9	160.6	-157	170.5	175.1	173.9	-4.2	115.3
394	G	30.6	Very low	42.7	Very low	73 Å²	73	143.6 Å²	143.6	75%	0.753	80%	0.799	S	S	*	*			cis	-171.7	175.4	-4.4	0	0	0	0	0	111.5
395	G	34.8	Very low	42.5	Very low	80 Å²	80	144.1 Å²	144.1	83%	0.825	81%	0.809	S	S	*	*			trans	-77.5	-172.4	-179.8	0	0	0	0	0	115.3
396	P	52.6	Low	42.9	Very low	136 Å²	136	139.8 Å²	139.8	88%	0.883	80%	0.8	S	S	*	*				-144.6	-173.3	50.4	42.8	-23.9	0	0	0	118
397	L	42	Very low	43.9	Very low	143 Å²	143	141.9 Å²	141.9	75%	0.749	80%	0.802	S	S	*	*			trans	-80.7	166.9	175.1	-111.6	159.1	0	0	0	112.2
398	P	51.2	Low	42.3	Very low	126 Å²	126	146.9 Å²	146.9	82%	0.818	80%	0.804	S	S	*	*				-144.6	171.8	79.5	38.2	-19.3	0	0	0	117.7
399	E	37.8	Very low	41.3	Very low	127 Å²	127	144.7 Å²	144.7	59%	0.593	80%	0.803	S	S	*	*			trans	-96.7	-178.7	-178.8	-150	-168.9	101.1	0	0	111.1	R401	E399-R401 VanDerWaalsContact OE1-CB 3.26Å; E399-R401 WeakPolarHBondContact OE1-CB 3.4Å; E399-R401 WeakPolarHBondContact OE1-CD 3.3Å; E399-R401 VanDerWaalsContact OE1-CG 3.22Å; E399-R401 WeakPolarHBondContact OE1-CG 3.48Å; E399-R401 PolarHBondContact OE1-N 2.95Å
400	P	52.3	Low	41.3	Very low	125 Å²	125	144.3 Å²	144.3	81%	0.812	80%	0.8	S	S	*	*				-150.5	148.1	82.5	38.2	-19.3	0	0	0	117.9
401	R	41.3	Very low	40.8	Very low	205 Å²	205	144.7 Å²	144.7	77%	0.774	81%	0.805	S	S	*	*			trans	-98.6	169.8	159.3	-68.2	165.5	157.8	-162.9	-4.6	112.7	E399	E399-R401 VanDerWaalsContact OE1-CB 3.26Å; E399-R401 WeakPolarHBondContact OE1-CB 3.4Å; E399-R401 WeakPolarHBondContact OE1-CD 3.3Å; E399-R401 VanDerWaalsContact OE1-CG 3.22Å; E399-R401 WeakPolarHBondContact OE1-CG 3.48Å; E399-R401 PolarHBondContact OE1-N 2.95Å
402	P	53	Low	41.7	Very low	114 Å²	114	144.4 Å²	144.4	74%	0.74	81%	0.808	S	S	*	*			trans	-109.2	137	133.1	-6.8	26.8	0	0	0	110.6
403	L	36.6	Very low	41.5	Very low	161 Å²	161	143.2 Å²	143.2	84%	0.843	80%	0.803	S	S	*	*				57.5	110.6	77.2	-61.9	172.2	0	0	0	112.2
404	M	38.7	Very low	41.8	Very low	187 Å²	187	138.8 Å²	138.8	92%	0.921	79%	0.793	S	S	*	*			cis	85.2	138.7	26.6	-143	-177	-159.7	0	0	115.3
405	A	32.5	Very low	42.2	Very low	106 Å²	106	146.9 Å²	146.9	88%	0.876	80%	0.8	S	S	*	*			trans	106.6	143.7	173	0	0	0	0	0	118.5
406	E	41.9	Very low	42.1	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	80%	0.795	S	S	*	*			trans	-104.6	164	-174.2	-157.6	-157.8	104.8	0	0	110.8	R408	E406-R408 PolarHBondContact OE1-N 3.44Å
407	P	50.4	Low	42.6	Very low	108 Å²	108	145.8 Å²	145.8	70%	0.701	79%	0.791	S	S	*	*				-159.6	150.3	105.4	37.6	-17.8	0	0	0	119.2
408	R	31.3	Very low	43.2	Very low	233 Å²	233	144.3 Å²	144.3	88%	0.879	79%	0.791	S	S	*	*			trans	63.9	139.6	144	-63.3	172.2	96.6	117.2	0.5	121.1	E406	E406-R408 PolarHBondContact OE1-N 3.44Å
409	G	31.8	Very low	42.7	Very low	72 Å²	72	145.8 Å²	145.8	74%	0.742	79%	0.79	S	S	*	*			trans	-86.3	-151.8	167.9	0	0	0	0	0	114.2
410	P	53	Low	42.7	Very low	120 Å²	120	147.1 Å²	147.1	78%	0.779	80%	0.802	S	S	*	*			cis	-144.5	-173.6	36.5	44.8	-26.2	0	0	0	117
411	M	37.8	Very low	41.8	Very low	170 Å²	170	144.2 Å²	144.2	84%	0.837	80%	0.795	S	S	*	*			trans	39.7	130.3	151.6	-69.6	176.6	79.1	0	0	121.7
412	L	49.3	Very low	41.5	Very low	176 Å²	176	146.2 Å²	146.2	92%	0.921	80%	0.802	S	S	*	*				-155.6	132.5	116.6	-108.7	169.1	0	0	0	111
413	D	39.9	Very low	40.5	Very low	123 Å²	123	144.6 Å²	144.6	66%	0.658	81%	0.806	S	S	*	*			trans	-116.6	141.1	177.8	179.6	-81.3	0	0	0	109.1
414	Q	40.2	Very low	40.3	Very low	159 Å²	159	140.9 Å²	140.9	74%	0.743	81%	0.807	S	S	*	*			trans	162.4	154.1	135	-92.7	171.5	90.4	0	0	115.4
415	R	37.1	Very low	40.2	Very low	243 Å²	243	143.2 Å²	143.2	92%	0.917	81%	0.805	S	S	*	*			trans	69.2	132.6	167.9	-64.3	173.6	178.7	-168.1	-2.4	116.6
416	G	32.8	Very low	40.7	Very low	69 Å²	69	145.2 Å²	145.2	71%	0.711	80%	0.801	S	S	*	*			cis	161.7	142.1	-7.3	0	0	0	0	0	112.4
417	P	64.6	Low	41	Very low	124 Å²	124	142.9 Å²	142.9	81%	0.805	80%	0.801	S	S	*	*			trans	-85.3	167	178.6	39.3	-38.4	0	0	0	111.6
418	P	53.2	Low	40.4	Very low	113 Å²	113	149.2 Å²	149.2	73%	0.734	81%	0.811	S	S	*	*				-153.5	149.4	89.1	39.3	-20.1	0	0	0	118.6
419	L	41.2	Very low	40.6	Very low	156 Å²	156	141.6 Å²	141.6	82%	0.817	80%	0.804	S	S	*	*			trans	56.7	130.1	131.5	-61	172.9	0	0	0	124.9
420	D	37.1	Very low	40.8	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	81%	0.811	S	S	*	*			trans	67.9	145.9	138	-109.5	-77.8	0	0	0	124
421	G	34.3	Very low	39.8	Very low	65 Å²	65	147.8 Å²	147.8	67%	0.67	81%	0.812	S	S	*	*			trans	-177	-8.5	-178.2	0	0	0	0	0	124.3
422	R	35.1	Very low	39.7	Very low	247 Å²	247	144.1 Å²	144.1	93%	0.932	81%	0.809	S	S	*	*			trans	79.3	141.9	171.2	-47.9	179.5	176.1	-154.2	-1.3	121
423	G	31.9	Very low	38.8	Very low	80 Å²	80	147.4 Å²	147.4	83%	0.825	81%	0.809	S	S	*	*			trans	88.6	114.8	164	0	0	0	0	0	113.9
424	G	31.8	Very low	38.3	Very low	82 Å²	82	144.7 Å²	144.7	85%	0.845	81%	0.81	S	S	*	*			cis	101.5	125.6	19.6	0	0	0	0	0	109.7
425	R	37.1	Very low	38.1	Very low	237 Å²	237	145.5 Å²	145.5	89%	0.894	82%	0.816	S	S	*	*			cis	-158.3	124.4	22.1	163.9	-161.3	-69.5	169.5	-4.6	110.9
426	D	42.2	Very low	37.8	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	81%	0.805	S	S	*	*			trans	-73.7	156.8	156.8	-59.8	-102	0	0	0	111.1
427	P	48.1	Very low	37.9	Very low	121 Å²	121	141.8 Å²	141.8	79%	0.786	81%	0.806	S	S	*	*				-143.9	166	97.4	38.6	-24.7	0	0	0	115.3
428	R	37.7	Very low	36.3	Very low	242 Å²	242	146.4 Å²	146.4	91%	0.913	81%	0.807	S	S	*	*			trans	-91.2	138	172.7	-63.8	173.9	173.9	175.2	-3.8	112
429	G	36	Very low	35.3	Very low	72 Å²	72	145.3 Å²	145.3	74%	0.742	81%	0.808	S	S	*	*			trans	66.6	148.6	138.4	0	0	0	0	0	120.8
430	I	36.6	Very low	35	Very low	171 Å²	171	146.3 Å²	146.3	88%	0.877	81%	0.81	S	S	*	*			trans	-171.3	147.6	142.6	-101.2	156.8	0	0	0	108.4
431	D	32.4	Very low	34.7	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	80%	0.804	S	S	*	*			trans	-90.3	159	-170	-68.8	-105.9	0	0	0	116
432	A	34.3	Very low	34.6	Very low	92 Å²	92	147.8 Å²	147.8	76%	0.76	81%	0.813	S	S	*	*			trans	80.2	139.8	140.8	0	0	0	0	0	122.6
433	R	31.3	Very low	34.6	Very low	245 Å²	245	146.4 Å²	146.4	93%	0.925	81%	0.808	S	S	*	*			trans	98.8	113.2	134.8	-160.5	-167.4	-51.1	-146	2.4	119
434	G	29.3	Very low	34.5	Very low	67 Å²	67	146 Å²	146	69%	0.691	80%	0.804	S	S	*	*			trans	140.6	130.5	130.7	0	0	0	0	0	118.2
435	M	36.3	Very low	34.8	Very low	176 Å²	176	150.7 Å²	150.7	87%	0.867	81%	0.809	S	S	*	*			trans	68	148.5	151.6	-65.9	172.9	169.9	0	0	121.1
436	E	30.2	Very low	34.7	Very low	144 Å²	144	146 Å²	146	67%	0.673	80%	0.801	S	S	*	*				-177	123.8	-50.5	-112.5	179	98.6	0	0	111.7	R438	E436-R438 IonicContact OE1-NH2 3.27Å
437	A	35	Very low	34.4	Very low	90 Å²	90	143.7 Å²	143.7	74%	0.744	80%	0.802	S	S	*	*			trans	-179.1	123.7	152.4	0	0	0	0	0	107.6
438	R	31.6	Very low	33.8	Very low	220 Å²	220	148.6 Å²	148.6	83%	0.83	81%	0.805	S	S	*	*				61.3	127.8	57.5	-60.4	-170.7	-167.4	-167.9	6.4	112.6	E436	E436-R438 IonicContact OE1-NH2 3.27Å
439	A	31.7	Very low	33.4	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	80%	0.799	S	S	*	*			cis	-152.9	-175.3	-5.6	0	0	0	0	0	107.4
440	M	34.8	Very low	33.6	Very low	177 Å²	177	145.8 Å²	145.8	87%	0.872	81%	0.808	S	S	*	*			cis	-163.3	141.9	26.7	173.7	173.9	-78.1	0	0	110.2
441	E	31	Very low	33.5	Very low	147 Å²	147	145.2 Å²	145.2	69%	0.687	80%	0.802	S	S	*	*			trans	-79.6	146.9	167.4	-111	-173.8	100.2	0	0	111	R443	E441-R443 WeakPolarHBondContact OE1-CG 3.25Å; E441-R443 IonicContact OE1-CZ 2.68Å; E441-R443 IonicContact OE1-NE 2.74Å; E441-R443 PolarHBondContact OE1-NE 3.25Å; E441-R443 IonicContact OE1-NH2 3.41Å
442	A	32.6	Very low	33.5	Very low	105 Å²	105	142.9 Å²	142.9	87%	0.868	80%	0.804	S	S	*	*			trans	-131.8	93.9	165.4	0	0	0	0	0	109.8
443	R	33.8	Very low	33.3	Very low	217 Å²	217	149.1 Å²	149.1	82%	0.819	81%	0.807	S	S	*	*			trans	-97.7	140.6	170.7	-72.3	-171.2	-174.6	-147.8	-1.3	111.2	E441	E441-R443 WeakPolarHBondContact OE1-CG 3.25Å; E441-R443 IonicContact OE1-CZ 2.68Å; E441-R443 IonicContact OE1-NE 2.74Å; E441-R443 PolarHBondContact OE1-NE 3.25Å; E441-R443 IonicContact OE1-NH2 3.41Å
444	G	30.7	Very low	33.3	Very low	72 Å²	72	142.2 Å²	142.2	74%	0.742	80%	0.803	S	S	*	*			trans	94	103	142.8	0	0	0	0	0	116.9
445	L	38.4	Very low	33.5	Very low	181 Å²	181	147.8 Å²	147.8	95%	0.948	81%	0.813	S	S	*	*			trans	-126.6	122	134.8	-74.1	177.8	0	0	0	107.6
446	D	34.9	Very low	33.6	Very low	139 Å²	139	145.9 Å²	145.9	74%	0.743	80%	0.802	S	S	*	*			trans	-80.4	133.4	172	-177.9	-106.8	0	0	0	109.1	R448	D446-R448 WeakPolarHBondContact OD1-CG 3.32Å; D446-R448 IonicContact OD1-NE 3.2Å
447	A	36.1	Very low	33.6	Very low	97 Å²	97	143.9 Å²	143.9	80%	0.802	81%	0.81	S	S	*	*			trans	-134.7	92.2	177.2	0	0	0	0	0	109.2
448	R	33.9	Very low	33.6	Very low	224 Å²	224	149 Å²	149	85%	0.845	81%	0.81	S	S	*	*			trans	-62.8	138.1	-178	-62.4	179.9	178.7	179.7	-4.4	112.6	D446	D446-R448 WeakPolarHBondContact OD1-CG 3.32Å; D446-R448 IonicContact OD1-NE 3.2Å
449	G	30.8	Very low	33.7	Very low	77 Å²	77	143.5 Å²	143.5	79%	0.794	81%	0.812	S	S	*	*			trans	16.9	119.2	152.8	0	0	0	0	0	120.3
450	L	39	Very low	33.9	Very low	178 Å²	178	147.9 Å²	147.9	93%	0.932	82%	0.819	S	S	*	*			trans	-123.1	128.9	146.3	-94.8	165.4	0	0	0	108.6
451	E	34.5	Very low	34	Very low	160 Å²	160	146.3 Å²	146.3	75%	0.748	81%	0.81	S	S	*	*			trans	-73.3	132.9	174.8	-74.3	-180	65.3	0	0	111	R453	E451-R453 IonicContact OE1-NE 2.69Å
452	A	32.4	Very low	34.1	Very low	102 Å²	102	144.1 Å²	144.1	84%	0.843	82%	0.817	S	S	*	*			trans	-128.4	92.7	161.9	0	0	0	0	0	108.5
453	R	30.8	Very low	34.2	Very low	223 Å²	223	148.8 Å²	148.8	84%	0.842	81%	0.812	S	S	*	*			trans	-68.6	140.5	176.2	-75.5	-178.6	179.3	-176.8	-3.8	110.9	E451	E451-R453 IonicContact OE1-NE 2.69Å
454	A	31.8	Very low	34.3	Very low	100 Å²	100	143.2 Å²	143.2	83%	0.826	81%	0.813	S	S	*	*			trans	8.9	125.8	155.1	0	0	0	0	0	118.9
455	M	33.2	Very low	34.6	Very low	185 Å²	185	148.7 Å²	148.7	91%	0.911	82%	0.821	S	S	*	*			trans	-125.1	125.6	137.5	-170.1	159.6	-75.4	0	0	109.2
456	E	37.3	Very low	34.6	Very low	136 Å²	136	146.8 Å²	146.8	64%	0.636	81%	0.807	S	S	*	*			trans	-78.4	122.8	176.2	-177.5	-177.3	66.4	0	0	109.4	R458	E456-R458 HydrophobicContact CG-CG 3.93Å; E456-R458 IonicContact OE1-CZ 3.92Å; E456-R458 IonicContact OE1-NE 2.83Å; E456-R458 PolarHBondContact OE1-NE 2.97Å; E456-R458 IonicContact OE1-NH2 3.13Å; E456-R458 PolarHBondContact OE1-NH2 3.41Å; E456-R458 IonicContact OE2-CZ 2.69Å; E456-R458 IonicContact OE2-NE 2.67Å; E456-R458 PolarHBondContact OE2-NE 3.5Å; E456-R458 IonicContact OE2-NH2 2.74Å; E456-R458 PolarHBondContact OE2-NH2 2.83Å
457	A	31.3	Very low	34.5	Very low	101 Å²	101	145 Å²	145	84%	0.835	81%	0.812	S	S	*	*			trans	-119	81.8	174	0	0	0	0	0	109.7
458	R	33.8	Very low	34.4	Very low	197 Å²	197	150.4 Å²	150.4	74%	0.743	81%	0.812	S	S	*	*			trans	-70.6	153.2	173.4	-68.1	-174.7	-170.4	168.6	12.1	111.2	E456	E456-R458 HydrophobicContact CG-CG 3.93Å; E456-R458 IonicContact OE1-CZ 3.92Å; E456-R458 IonicContact OE1-NE 2.83Å; E456-R458 PolarHBondContact OE1-NE 2.97Å; E456-R458 IonicContact OE1-NH2 3.13Å; E456-R458 PolarHBondContact OE1-NH2 3.41Å; E456-R458 IonicContact OE2-CZ 2.69Å; E456-R458 IonicContact OE2-NE 2.67Å; E456-R458 PolarHBondContact OE2-NE 3.5Å; E456-R458 IonicContact OE2-NH2 2.74Å; E456-R458 PolarHBondContact OE2-NH2 2.83Å
459	A	34.1	Very low	34.4	Very low	105 Å²	105	144.9 Å²	144.9	87%	0.868	81%	0.814	S	S	*	*			trans	-23.1	133	173.3	0	0	0	0	0	117.1
460	M	35.9	Very low	34.8	Very low	182 Å²	182	150.1 Å²	150.1	90%	0.897	82%	0.82	S	S	*	*			trans	-118	123.1	150.9	-173.5	165	-74.7	0	0	108.8	A462	M460-A462 PolarHBondContact O-N 3.23Å
461	E	37.8	Very low	34.5	Very low	144 Å²	144	149.4 Å²	149.4	67%	0.673	81%	0.812	S	S	*	*			trans	-74.4	114.6	176.5	178.9	179.3	118.6	0	0	109.8	R463	E461-R463 HydrophobicContact CG-CG 4.37Å; E461-R463 WeakPolarHBondContact OE1-CD 3.38Å; E461-R463 IonicContact OE1-CZ 3.8Å; E461-R463 IonicContact OE1-NE 3.23Å; E461-R463 IonicContact OE1-NH1 3.85Å; E461-R463 PolarHBondContact OE1-NH1 2.82Å
462	A	33.3	Very low	34.4	Very low	102 Å²	102	146.8 Å²	146.8	84%	0.843	82%	0.817	S	S	*	*			trans	-100.4	80.2	176.5	0	0	0	0	0	111.1	M460	M460-A462 PolarHBondContact O-N 3.23Å
463	R	35.2	Very low	34.4	Very low	202 Å²	202	152.3 Å²	152.3	76%	0.762	82%	0.816	S	S	*	*			trans	-78.3	124.1	169.3	-93.4	-176.8	168.1	130.8	-11.3	111	E461	E461-R463 HydrophobicContact CG-CG 4.37Å; E461-R463 WeakPolarHBondContact OE1-CD 3.38Å; E461-R463 IonicContact OE1-CZ 3.8Å; E461-R463 IonicContact OE1-NE 3.23Å; E461-R463 IonicContact OE1-NH1 3.85Å; E461-R463 PolarHBondContact OE1-NH1 2.82Å
464	A	34.1	Very low	34.6	Very low	101 Å²	101	146.5 Å²	146.5	84%	0.835	82%	0.816	S	S	*	*			trans	33.1	119.3	153	0	0	0	0	0	119.7
465	M	38	Very low	34.6	Very low	186 Å²	186	150.3 Å²	150.3	92%	0.916	82%	0.819	S	S	*	*			trans	-132.3	133.5	143.3	-170.3	162.1	-74.8	0	0	110.1
466	E	37.3	Very low	34.5	Very low	141 Å²	141	148.6 Å²	148.6	66%	0.659	81%	0.809	S	S	*	*			trans	-73.9	125.8	179.9	179.7	-178.6	121.4	0	0	110.7	R468	E466-R468 HydrophobicContact CG-CG 4.41Å; E466-R468 IonicContact OE1-CZ 3.68Å; E466-R468 VanDerWaalsContact OE1-CZ 3.23Å; E466-R468 IonicContact OE1-NE 3.14Å; E466-R468 PolarHBondContact OE1-NE 2.98Å; E466-R468 IonicContact OE1-NH2 3.87Å; E466-R468 PolarHBondContact OE1-NH2 2.87Å
467	A	34.2	Very low	34.4	Very low	102 Å²	102	149.1 Å²	149.1	84%	0.843	82%	0.821	S	S	*	*			trans	-111.6	98.8	174.9	0	0	0	0	0	110.1
468	R	34.7	Very low	34.4	Very low	211 Å²	211	154.4 Å²	154.4	80%	0.796	82%	0.819	S	S	*	*			trans	-72.8	159.2	171.4	-64.8	-175	-174.3	-173.5	0.4	111	E466	E466-R468 HydrophobicContact CG-CG 4.41Å; E466-R468 IonicContact OE1-CZ 3.68Å; E466-R468 VanDerWaalsContact OE1-CZ 3.23Å; E466-R468 IonicContact OE1-NE 3.14Å; E466-R468 PolarHBondContact OE1-NE 2.98Å; E466-R468 IonicContact OE1-NH2 3.87Å; E466-R468 PolarHBondContact OE1-NH2 2.87Å
469	A	33.7	Very low	34.2	Very low	107 Å²	107	148.1 Å²	148.1	88%	0.884	82%	0.816	S	S	*	*			trans	-57.5	142.5	178	0	0	0	0	0	112.8
470	M	37.5	Very low	34.2	Very low	187 Å²	187	152.9 Å²	152.9	92%	0.921	82%	0.823	S	S	*	*			trans	-137.9	139.2	161.9	-172.2	161.8	-74.6	0	0	110
471	E	33.4	Very low	33.9	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	82%	0.82	S	S	*	*			trans	-75.6	121.8	-171.8	-176.2	-178.3	96.7	0	0	112	R473	E471-R473 PolarHBondContact O-N 3.34Å
472	A	32.7	Very low	33.6	Very low	105 Å²	105	150.9 Å²	150.9	87%	0.868	83%	0.828	S	S	*	*			trans	-83	73.6	-177.4	0	0	0	0	0	112.5	A474	A472-A474 PolarHBondContact O-N 3.02Å; A472-A474 VanDerWaalsContact O-N 3.16Å
473	R	33.5	Very low	33.6	Very low	218 Å²	218	157.3 Å²	157.3	82%	0.823	83%	0.831	S	S	*	*			trans	-79.5	93	177.7	-162.3	174.1	-169.7	172.1	4.6	111.2	E471	E471-R473 PolarHBondContact O-N 3.34Å
474	A	33.3	Very low	33.4	Very low	101 Å²	101	151 Å²	151	84%	0.835	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-62.2	144.4	-179.8	0	0	0	0	0	112.7	A472	A472-A474 PolarHBondContact O-N 3.02Å; A472-A474 VanDerWaalsContact O-N 3.16Å
475	M	33.1	Very low	33.2	Very low	181 Å²	181	155.3 Å²	155.3	89%	0.892	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-103.8	137.8	-166.1	-160.7	167.3	-173.4	0	0	112.8
476	E	30	Very low	33	Very low	149 Å²	149	153.4 Å²	153.4	70%	0.696	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-66.4	125.8	-179.2	179.5	-174.1	106.9	0	0	112.1	R478	E476-R478 IonicContact OE1-CZ 3.21Å; E476-R478 IonicContact OE1-NE 2.74Å; E476-R478 IonicContact OE1-NH2 3.46Å; E476-R478 PolarHBondContact OE1-NH2 3.28Å; E476-R478 VanDerWaalsContact OE1-NH2 3.14Å
477	V	34.9	Very low	32.8	Very low	147 Å²	147	152.5 Å²	152.5	89%	0.891	83%	0.832	S	S	*	*			trans	-93.8	112.3	171.6	-178.4	0	0	0	0	109.3
478	R	31.8	Very low	32.6	Very low	212 Å²	212	159.2 Å²	159.2	80%	0.8	84%	0.835	S	S	*	*			trans	-96.8	133.2	-176.4	176.9	175.1	-61.1	-178.4	2.7	112.5	E476	E476-R478 IonicContact OE1-CZ 3.21Å; E476-R478 IonicContact OE1-NE 2.74Å; E476-R478 IonicContact OE1-NH2 3.46Å; E476-R478 PolarHBondContact OE1-NH2 3.28Å; E476-R478 VanDerWaalsContact OE1-NH2 3.14Å
479	G	30.7	Very low	32.3	Very low	65 Å²	65	152.6 Å²	152.6	67%	0.67	83%	0.832	S	S	*	*			trans	134.8	101.9	145.9	0	0	0	0	0	116.4
480	M	33	Very low	33	Very low	205 Å²	205	153.8 Å²	153.8	100%	1.01	83%	0.831	S	S	*	*				-167.6	144.7	114.7	-102.2	174.4	177.5	0	0	109.8
481	E	30	Very low	33.2	Very low	180 Å²	180	151.2 Å²	151.2	84%	0.841	83%	0.826	S	S	*	*			trans	-125	148.1	-168.6	61.7	-177.9	75.7	0	0	112.2
482	A	32.1	Very low	33.8	Very low	103 Å²	103	149.3 Å²	149.3	85%	0.851	83%	0.827	S	S	*	*			trans	-146	135.8	171	0	0	0	0	0	110.7
483	R	32.3	Very low	33.9	Very low	238 Å²	238	147.4 Å²	147.4	90%	0.898	82%	0.818	S	S	*	*			trans	-79	151.7	173	-55.1	168.2	-168.8	157.4	4.3	108.6
484	G	30.7	Very low	34.8	Very low	70 Å²	70	142.8 Å²	142.8	72%	0.722	82%	0.816	S	S	*	*			cis	118.8	116.4	7.2	0	0	0	0	0	111
485	M	31	Very low	34.7	Very low	190 Å²	190	149.4 Å²	149.4	94%	0.936	82%	0.82	S	S	*	*			trans	-168.2	158.7	170.6	-111.6	169.4	-176	0	0	111.8
486	D	33.7	Very low	34.6	Very low	146 Å²	146	144.1 Å²	144.1	78%	0.781	81%	0.812	S	S	*	*			trans	-112	159.1	-163.7	-20.8	-109.9	0	0	0	113.5
487	T	31.9	Very low	35.6	Very low	122 Å²	122	143.1 Å²	143.1	75%	0.748	82%	0.818	S	S	*	*				174.2	133.8	127	27.6	0	0	0	0	116.1
488	R	30.5	Very low	35.8	Very low	244 Å²	244	143.6 Å²	143.6	92%	0.921	81%	0.814	S	S	*	*			trans	60.6	143.8	142.9	-64.6	175	179.4	166.8	1	122.1
489	G	28.8	Very low	36.7	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	81%	0.81	S	S	*	*			trans	-91.6	-147.9	167	0	0	0	0	0	113
490	P	47	Very low	36.9	Very low	132 Å²	132	141.3 Å²	141.3	86%	0.857	82%	0.818	S	S	*	*			cis	-138.2	-168.9	32.4	43.2	-24.8	0	0	0	116.3
491	V	42.1	Very low	36.9	Very low	134 Å²	134	135 Å²	135	81%	0.812	81%	0.805	S	S	*	*			trans	-83.9	165.7	174.9	-61.8	0	0	0	0	113.4
492	P	47.1	Very low	37.1	Very low	122 Å²	122	134.1 Å²	134.1	79%	0.792	80%	0.803	S	S	*	*				-148.7	169.4	98	39.7	-23.5	0	0	0	116.8
493	G	35.1	Very low	37.1	Very low	66 Å²	66	138 Å²	138	68%	0.68	80%	0.804	S	S	*	*			trans	-88.5	-149.6	163.3	0	0	0	0	0	112.5
494	P	50.8	Low	37	Very low	120 Å²	120	130 Å²	130	78%	0.779	80%	0.795	S	S	*	*			cis	-151.1	-166.1	20.6	39.1	-14.6	0	0	0	117.9
495	R	32.1	Very low	38	Very low	240 Å²	240	132.9 Å²	132.9	91%	0.906	80%	0.801	S	S	*	*			trans	91.3	135.1	156.1	-64.1	163.6	75.5	153.7	3.7	121.1
496	G	31.6	Very low	38.2	Very low	70 Å²	70	129.2 Å²	129.2	72%	0.722	79%	0.794	S	S	*	*			trans	-101.8	-154.4	162.8	0	0	0	0	0	112.4
497	P	49.8	Very low	39.1	Very low	129 Å²	129	127.8 Å²	127.8	84%	0.838	79%	0.793	S	S	*	*			cis	-140.9	-151.1	37.9	43.5	-22.7	0	0	0	115.8
498	I	39.8	Very low	39.2	Very low	157 Å²	157	129.2 Å²	129.2	81%	0.805	79%	0.794	S	S	*	*			trans	-144.3	-178.1	-172.2	47.8	166	0	0	0	108.8
499	P	51.3	Low	39.4	Very low	108 Å²	108	124.6 Å²	124.6	70%	0.701	79%	0.788	S	S	*	*			cis	-150.8	-167.1	19.2	44.7	-21.8	0	0	0	119.3
500	S	34.7	Very low	39.5	Very low	120 Å²	120	129.6 Å²	129.6	84%	0.839	79%	0.794	S	S	*	*			trans	87.8	147.4	144.8	-66.3	0	0	0	0	124.3
501	G	31.6	Very low	38.7	Very low	72 Å²	72	127 Å²	127	74%	0.742	79%	0.791	S	S	*	*			trans	114.8	120.7	164.5	0	0	0	0	0	114
502	M	35.6	Very low	38.5	Very low	163 Å²	163	125.2 Å²	125.2	80%	0.803	79%	0.791	S	S	*	*			cis	97.3	114.8	32.5	-77.8	-175.7	61.3	0	0	115.9
503	Q	32.1	Very low	37.8	Very low	184 Å²	184	126.2 Å²	126.2	86%	0.86	79%	0.794	S	S	*	*			trans	66.2	159.7	161.3	-57.3	172.2	2.6	0	0	115.7
504	G	30.6	Very low	37.9	Very low	69 Å²	69	128.7 Å²	128.7	71%	0.711	80%	0.796	S	S	*	*			cis	-157.2	-159.4	5.5	0	0	0	0	0	113.2
505	P	50.8	Low	38.2	Very low	132 Å²	132	127.5 Å²	127.5	86%	0.857	79%	0.788	S	S	*	*			trans	-98.7	-174.5	-160.3	39.2	-38.6	0	0	0	117.9
506	S	36.2	Very low	38.3	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	79%	0.788	S	S	*	*			trans	-54.1	168.3	-173.7	-35.2	0	0	0	0	118.2
507	P	50.8	Low	38.3	Very low	116 Å²	116	125.1 Å²	125.1	75%	0.753	79%	0.787	S	S	*	*				-145.6	151.6	106.1	38.8	-24.8	0	0	0	117.8
508	I	34.6	Very low	37.6	Very low	152 Å²	152	124.1 Å²	124.1	78%	0.779	78%	0.783	S	S	*	*			trans	15.8	127.6	133.1	-65.1	164.7	0	0	0	116.2
509	N	34.6	Very low	37.4	Very low	148 Å²	148	126.9 Å²	126.9	79%	0.791	78%	0.783	S	S	*	*				-158.4	157.7	86.6	-152.5	15	0	0	0	118.7
510	M	32.2	Very low	36.4	Very low	175 Å²	175	129.4 Å²	129.4	86%	0.862	79%	0.786	S	S	*	*			trans	-59.9	150.2	171.1	-177.2	-172.5	-59.2	0	0	114.8
511	G	30.3	Very low	36.4	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	79%	0.785	S	S	*	*			trans	171.9	145.6	169.9	0	0	0	0	0	112
512	A	35.9	Very low	37.7	Very low	97 Å²	97	132.4 Å²	132.4	80%	0.802	79%	0.787	S	S	*	*			trans	-139.4	172.7	-173.1	0	0	0	0	0	113.1
513	V	34.2	Very low	37.4	Very low	143 Å²	143	131.5 Å²	131.5	87%	0.867	79%	0.79	S	S	*	*			trans	86	146.1	158	100	0	0	0	0	120.2
514	V	35.6	Very low	37.6	Very low	119 Å²	119	131 Å²	131	72%	0.721	79%	0.79	S	S	*	*			trans	-87.1	177.2	179	67.9	0	0	0	0	108.5
515	P	57.4	Low	37.7	Very low	94 Å²	94	137.4 Å²	137.4	61%	0.61	80%	0.801	S	S	*	*			cis	-152.3	179.7	25.1	43.4	-20.6	0	0	0	121.3
516	Q	34.4	Very low	37	Very low	192 Å²	192	134.3 Å²	134.3	90%	0.897	79%	0.793	S	S	*	*			trans	67.4	136.3	140.8	-89.6	180	-98.3	0	0	123.8
517	G	31	Very low	36.8	Very low	69 Å²	69	136 Å²	136	71%	0.711	80%	0.799	S	S	*	*			trans	120.4	145.3	138.9	0	0	0	0	0	116.8
518	S	36.1	Very low	35.9	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	80%	0.798	S	S	*	*			cis	-178.8	139.9	-43.1	43.8	0	0	0	0	111.3
519	R	35.4	Very low	36.2	Very low	215 Å²	215	134.9 Å²	134.9	81%	0.811	80%	0.802	S	S	*	*			trans	72.2	139.8	156.6	-66.8	179.1	95.6	-175.8	6.2	121.3
520	Q	29.7	Very low	36.1	Very low	161 Å²	161	136.5 Å²	136.5	75%	0.752	80%	0.804	S	S	*	*			trans	96.4	157	146.5	-75.7	163.6	131.6	0	0	121.1
521	V	34.4	Very low	36	Very low	135 Å²	135	132 Å²	132	82%	0.818	80%	0.804	S	S	*	*			trans	-160.1	-177.4	-155.1	-63.9	0	0	0	0	107.5
522	P	60.1	Low	36.4	Very low	120 Å²	120	133.4 Å²	133.4	78%	0.779	81%	0.808	S	S	*	*			cis	-125.2	-174.4	-25.7	34.4	-16.3	0	0	0	112
523	V	29.4	Very low	36.1	Very low	144 Å²	144	134.6 Å²	134.6	87%	0.873	81%	0.81	S	S	*	*			trans	-151.6	151.5	147.7	73.9	0	0	0	0	111.2
524	M	36.9	Very low	36.3	Very low	173 Å²	173	135.6 Å²	135.6	85%	0.852	81%	0.808	S	S	*	*			trans	-107.7	147.3	176.9	-60.1	165.7	64.5	0	0	110.8
525	Q	31.3	Very low	36.2	Very low	203 Å²	203	139.2 Å²	139.2	95%	0.949	82%	0.817	S	S	*	*			trans	-158.3	153.4	137.3	-154	161.1	-23.7	0	0	110.5
526	G	35.6	Very low	34.9	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	83%	0.825	S	S	*	*			trans	-162.6	141.9	177.8	0	0	0	0	0	114.2
527	T	33.2	Very low	34.7	Very low	148 Å²	148	132.6 Å²	132.6	91%	0.908	82%	0.818	S	S	*	*			trans	-172.1	152.6	171.9	31.5	0	0	0	0	106
528	G	31.6	Very low	35.1	Very low	71 Å²	71	135.1 Å²	135.1	73%	0.732	83%	0.825	S	S	*	*			cis	169.8	131.8	-8.3	0	0	0	0	0	111.4
529	M	40.1	Very low	35.1	Very low	172 Å²	172	138.9 Å²	138.9	85%	0.847	83%	0.83	S	S	*	*			trans	48.7	142.3	153.1	-111.9	-173.2	176.3	0	0	124.1
530	Q	32.9	Very low	35.6	Very low	182 Å²	182	134.6 Å²	134.6	85%	0.85	83%	0.831	S	S	*	*			trans	81.7	144.9	150.7	-64.7	169.7	52.2	0	0	120.5
531	G	30.9	Very low	36.1	Very low	82 Å²	82	130.6 Å²	130.6	85%	0.845	83%	0.833	S	S	*	*			trans	142	110.7	175.4	0	0	0	0	0	111.9
532	A	37.5	Very low	36.1	Very low	106 Å²	106	127.8 Å²	127.8	88%	0.876	83%	0.831	S	S	*	*			trans	-135	142	-179.6	0	0	0	0	0	111.9
533	S	31.4	Very low	35	Very low	121 Å²	121	132.1 Å²	132.1	85%	0.846	84%	0.838	S	S	*	*			trans	-152.9	160.5	171.1	51.7	0	0	0	0	111.3
534	I	37.9	Very low	35.3	Very low	164 Å²	164	130.8 Å²	130.8	84%	0.841	84%	0.835	S	S	*	*			trans	-110.6	169.7	-171	-67	-73.5	0	0	0	109.4
535	Q	32.2	Very low	36	Very low	195 Å²	195	128.7 Å²	128.7	91%	0.911	83%	0.834	S	S	*	*			trans	88.2	138.1	167.8	-156.1	177.6	104.8	0	0	114.1
536	G	31.8	Very low	36.9	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	83%	0.829	S	S	*	*			cis	149.7	129.5	-8.8	0	0	0	0	0	111.8
537	G	29.8	Very low	37.3	Very low	73 Å²	73	128.3 Å²	128.3	75%	0.753	84%	0.836	S	S	*	*			trans	130.8	120.3	171.7	0	0	0	0	0	116
538	S	39.8	Very low	38.1	Very low	122 Å²	122	128.3 Å²	128.3	85%	0.853	83%	0.831	S	S	*	*			trans	-21.8	138	160.2	50.5	0	0	0	0	119.1
539	Q	34.8	Very low	38.8	Very low	187 Å²	187	133.3 Å²	133.3	87%	0.874	84%	0.835	S	S	*	*			trans	-116.2	144.2	154.1	-72.8	-174	-6.5	0	0	110.8
540	P	47.2	Very low	39.5	Very low	126 Å²	126	128.8 Å²	128.8	82%	0.818	82%	0.817	S	S	*	*			trans	-80.4	154	169.5	34.4	-34.2	0	0	0	111.5
541	G	40.5	Very low	41.1	Very low	77 Å²	77	123.5 Å²	123.5	79%	0.794	80%	0.797	S	S	*	*			trans	-78	138.1	-178.3	0	0	0	0	0	114.1
542	G	33.8	Very low	42.7	Very low	76 Å²	76	124.9 Å²	124.9	78%	0.784	79%	0.791	S	S	*	*			trans	-104.6	124.7	163.6	0	0	0	0	0	110.5
543	F	36.9	Very low	43.7	Very low	210 Å²	210	126.1 Å²	126.1	92%	0.921	78%	0.779	S	S	*	*			trans	-82.1	134.9	175.9	-82.8	-104.9	0	0	0	111.2
544	S	36.2	Very low	45.3	Very low	116 Å²	116	124.3 Å²	124.3	81%	0.811	76%	0.759	S	S	*	*			trans	-121.7	138.9	166.6	-71.6	0	0	0	0	109.6
545	P	51.2	Low	46.8	Very low	130 Å²	130	123 Å²	123	84%	0.844	75%	0.75	S	S	*	*			trans	-84.1	131.5	-167.2	31.2	-35.1	0	0	0	114.5	Q547	P545-Q547 PolarHBondContact O-N 3.15Å
546	G	49	Very low	48.7	Very low	81 Å²	81	120.1 Å²	120.1	84%	0.835	74%	0.736	S	S	*	*			trans	63.1	43.5	132.5	0	0	0	0	0	119.3	N548	G546-N548 PolarHBondContact O-N 3.08Å
547	Q	44	Very low	50.5	Low	182 Å²	182	122.6 Å²	122.6	85%	0.85	73%	0.726	S	S	*	*			trans	-78.3	106.8	162.2	-171.1	167.3	84.7	0	0	109.6	P545 Q549	P545-Q547 PolarHBondContact O-N 3.15Å; Q547-Q549 PolarHBondContact O-N 3.4Å; Q547-Q549 VanDerWaalsContact O-N 3.15Å
548	N	50.9	Low	52.4	Low	148 Å²	148	121.3 Å²	121.3	79%	0.791	71%	0.708	S	S	*	*			trans	-67.4	110.2	178.8	-165.2	64.6	0	0	0	109.7	G546 V550	G546-N548 PolarHBondContact O-N 3.08Å; N548-V550 PolarHBondContact O-N 2.91Å
549	Q	45.1	Very low	54.1	Low	175 Å²	175	118.2 Å²	118.2	82%	0.818	69%	0.689	S	S	*	*			trans	-73.4	91.9	-174.6	-71.9	-176.7	89.5	0	0	111	Q547 T551	Q547-Q549 PolarHBondContact O-N 3.4Å; Q547-Q549 VanDerWaalsContact O-N 3.15Å; Q549-T551 PolarHBondContact O-N 2.99Å; Q549-T551 VanDerWaalsContact O-N 3.12Å
550	V	55.1	Low	56	Low	78 Å²	78	114 Å²	114	47%	0.473	67%	0.672	S	S	.	*			trans	-58.7	111.9	168.8	175.6	0	0	0	0	108.1	N548 D554 H555	N548-V550 PolarHBondContact O-N 2.91Å; V550-D554 HydrophobicContact CG1-CB 4.08Å; V550-H555 WeakPolarHBondContact CG1-ND1 3.4Å
551	T	66.8	Low	57.4	Low	71 Å²	71	111.5 Å²	111.5	44%	0.436	65%	0.651	S	S	.	*			trans	-71.4	155.5	179.1	60.6	0	0	0	0	110.2	Q549 Q553 D554 H555	Q549-T551 PolarHBondContact O-N 2.99Å; Q549-T551 VanDerWaalsContact O-N 3.12Å; T551-Q553 PolarHBondContact O-N 2.9Å; T551-D554 WeakPolarHBondContact O-CB 3.41Å; T551-D554 PolarHBondContact O-N 2.92Å; T551-D554 PolarHBondContact OG1-N 3.29Å; T551-H555 PolarHBondContact O-N 3.41Å; T551-H555 VanDerWaalsContact O-N 3.13Å
552	P	64.6	Low	59	Low	110 Å²	110	113.5 Å²	113.5	71%	0.714	64%	0.642	S	S	*	*	H	α-helix	trans	-57.4	-32.1	176	21.6	-33	0	0	0	112.4	D554 H555 E556	P552-D554 VanDerWaalsContact C-N 3.33Å; P552-D554 PolarHBondContact O-N 2.74Å; P552-H555 WeakPolarHBondContact O-CB 3.29Å; P552-H555 PolarHBondContact O-N 2.96Å; P552-E556 WeakPolarHBondContact O-CB 3.36Å; P552-E556 PolarHBondContact O-N 3.22Å
553	Q	58.2	Low	60.9	Low	133 Å²	133	116 Å²	116	62%	0.621	63%	0.633	S	S	*	*	H	α-helix	trans	-66.8	-30.3	174.1	-64.4	-178.8	-55.9	0	0	113.5	T551 K557	T551-Q553 PolarHBondContact O-N 2.9Å; Q553-K557 WeakPolarHBondContact O-CB 3.44Å; Q553-K557 WeakPolarHBondContact O-CD 3.1Å; Q553-K557 WeakPolarHBondContact O-CG 3.01Å; Q553-K557 PolarHBondContact O-N 3.27Å
554	D	66.6	Low	62.8	Low	82 Å²	82	107.1 Å²	107.1	44%	0.439	60%	0.596	S	S	.	*	H	α-helix	trans	-74.7	-38.7	174.8	-166.2	-114.3	0	0	0	111	V550 T551 P552 E556 K557 A558	V550-D554 HydrophobicContact CG1-CB 4.08Å; T551-D554 WeakPolarHBondContact O-CB 3.41Å; T551-D554 PolarHBondContact O-N 2.92Å; T551-D554 PolarHBondContact OG1-N 3.29Å; P552-D554 VanDerWaalsContact C-N 3.33Å; P552-D554 PolarHBondContact O-N 2.74Å; D554-E556 PolarHBondContact O-N 3.43Å; D554-K557 PolarHBondContact O-N 2.88Å; D554-A558 WeakPolarHBondContact O-CB 3.16Å; D554-A558 PolarHBondContact O-N 3.13Å
555	H	69.2	Low	64.6	Low	138 Å²	138	105.2 Å²	105.2	64%	0.639	58%	0.576	S	S	*	*	H	α-helix	trans	-60.4	-42.5	170.3	-120.2	71.4	0	0	0	112.5	V550 T551 P552 A558 A559	V550-H555 WeakPolarHBondContact CG1-ND1 3.4Å; T551-H555 PolarHBondContact O-N 3.41Å; T551-H555 VanDerWaalsContact O-N 3.13Å; P552-H555 WeakPolarHBondContact O-CB 3.29Å; P552-H555 PolarHBondContact O-N 2.96Å; H555-A558 PolarHBondContact O-N 2.81Å; H555-A559 PolarHBondContact O-N 3.21Å
556	E	71.1	Confident	65.8	Low	133 Å²	133	105.6 Å²	105.6	62%	0.621	57%	0.566	S	S	*	*	H	α-helix	trans	-68.8	-39.7	177.9	-167.9	165.2	78.2	0	0	112	P552 D554 A559 L560	P552-E556 WeakPolarHBondContact O-CB 3.36Å; P552-E556 PolarHBondContact O-N 3.22Å; D554-E556 PolarHBondContact O-N 3.43Å; E556-A559 PolarHBondContact O-N 2.74Å; E556-L560 WeakPolarHBondContact O-CG 3.46Å; E556-L560 PolarHBondContact O-N 2.7Å
557	K	70.8	Confident	67.2	Low	127 Å²	127	103.7 Å²	103.7	55%	0.552	54%	0.537	S	S	*	.	H	α-helix	trans	-60.7	-44.1	169.6	-76.1	168.3	-177.3	177.5	0	112	Q553 D554 A559 L560 I561	Q553-K557 WeakPolarHBondContact O-CB 3.44Å; Q553-K557 WeakPolarHBondContact O-CD 3.1Å; Q553-K557 WeakPolarHBondContact O-CG 3.01Å; Q553-K557 PolarHBondContact O-N 3.27Å; D554-K557 PolarHBondContact O-N 2.88Å; K557-A559 VanDerWaalsContact C-N 3.34Å; K557-A559 PolarHBondContact O-N 3.29Å; K557-L560 PolarHBondContact O-N 3.47Å; K557-I561 WeakPolarHBondContact O-CB 3.4Å; K557-I561 WeakPolarHBondContact O-CD1 3.29Å; K557-I561 VanDerWaalsContact O-CG1 3.23Å; K557-I561 WeakPolarHBondContact O-CG1 3.4Å; K557-I561 PolarHBondContact O-N 2.92Å
558	A	67.8	Low	68.9	Low	45 Å²	45	98.6 Å²	98.6	37%	0.372	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-39.8	176.7	0	0	0	0	0	112	D554 H555 I561 M562	D554-A558 WeakPolarHBondContact O-CB 3.16Å; D554-A558 PolarHBondContact O-N 3.13Å; H555-A558 PolarHBondContact O-N 2.81Å; A558-I561 PolarHBondContact O-N 2.91Å; A558-M562 PolarHBondContact O-N 3.47Å
559	A	75.7	Confident	69.9	Low	57 Å²	57	95.5 Å²	95.5	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-44.9	174.4	0	0	0	0	0	112.2	H555 E556 K557 M562 Q563	H555-A559 PolarHBondContact O-N 3.21Å; E556-A559 PolarHBondContact O-N 2.74Å; K557-A559 VanDerWaalsContact C-N 3.34Å; K557-A559 PolarHBondContact O-N 3.29Å; A559-M562 PolarHBondContact O-N 3.32Å; A559-Q563 WeakPolarHBondContact O-CB 3.34Å; A559-Q563 PolarHBondContact O-N 3.4Å
560	L	76.1	Confident	71.4	Confident	98 Å²	98	92.8 Å²	92.8	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-42.2	174.5	-72.3	166	0	0	0	111.8	E556 K557 Q563 V564	E556-L560 WeakPolarHBondContact O-CG 3.46Å; E556-L560 PolarHBondContact O-N 2.7Å; K557-L560 PolarHBondContact O-N 3.47Å; L560-Q563 PolarHBondContact O-N 3.19Å; L560-V564 WeakPolarHBondContact O-CG2 3.48Å; L560-V564 PolarHBondContact O-N 3.17Å
561	I	75	Confident	72.3	Confident	74 Å²	74	93.7 Å²	93.7	38%	0.379	50%	0.504	S	S	.	.	H	α-helix	trans	-60	-46.7	174.6	-76.3	165.1	0	0	0	111.1	K557 A558 Q563 V564 L565 I590	K557-I561 WeakPolarHBondContact O-CB 3.4Å; K557-I561 WeakPolarHBondContact O-CD1 3.29Å; K557-I561 VanDerWaalsContact O-CG1 3.23Å; K557-I561 WeakPolarHBondContact O-CG1 3.4Å; K557-I561 PolarHBondContact O-N 2.92Å; A558-I561 PolarHBondContact O-N 2.91Å; I561-Q563 VanDerWaalsContact C-N 3.3Å; I561-Q563 PolarHBondContact O-N 2.89Å; I561-V564 PolarHBondContact O-N 3.42Å; I561-L565 HydrophobicContact CG2-CD1 4.25Å; I561-L565 WeakPolarHBondContact O-CB 3.33Å; I561-L565 PolarHBondContact O-N 3.42Å; I561-I590 HydrophobicContact CB-CD1 4.43Å; I561-I590 HydrophobicContact CG1-CD1 4.09Å; I561-I590 HydrophobicContact CG2-CD1 4.12Å; I561-I590 HydrophobicContact CG2-CG1 4.38Å; I561-I590 HydrophobicContact CG2-CG2 3.86Å
562	M	74.6	Confident	72.7	Confident	119 Å²	119	90.8 Å²	90.8	59%	0.586	49%	0.485	S	S	*	.	H	α-helix	trans	-63.3	-34	174.7	-81	-179.1	58	0	0	112.8	A558 A559 Q566	A558-M562 PolarHBondContact O-N 3.47Å; A559-M562 PolarHBondContact O-N 3.32Å; M562-Q566 WeakPolarHBondContact O-CG 3.36Å; M562-Q566 PolarHBondContact O-N 3.36Å; M562-Q566 VanDerWaalsContact O-N 3.16Å; M562-Q566 PolarHBondContact O-NE2 2.86Å
563	Q	74.4	Confident	73.2	Confident	130 Å²	130	87.7 Å²	87.7	61%	0.607	47%	0.469	S	S	*	.	H	α-helix	trans	-71.6	-44.5	177.6	-166.2	168.9	88	0	0	111.2	A559 L560 I561 L565 Q566 L567	A559-Q563 WeakPolarHBondContact O-CB 3.34Å; A559-Q563 PolarHBondContact O-N 3.4Å; L560-Q563 PolarHBondContact O-N 3.19Å; I561-Q563 VanDerWaalsContact C-N 3.3Å; I561-Q563 PolarHBondContact O-N 2.89Å; Q563-L565 VanDerWaalsContact C-N 3.33Å; Q563-L565 PolarHBondContact O-N 2.92Å; Q563-Q566 PolarHBondContact O-N 3.19Å; Q563-Q566 VanDerWaalsContact O-N 3.12Å; Q563-L567 PolarHBondContact O-N 2.93Å; Q563-L567 VanDerWaalsContact O-N 3.17Å
564	V	77.2	Confident	74.3	Confident	22 Å²	22	88.9 Å²	88.9	13%	0.133	48%	0.476	C	S	.	.	H	α-helix	trans	-60.7	-39.3	174.1	168.5	0	0	0	0	111.8	L560 I561 I583 L586 K587 I590	L560-V564 WeakPolarHBondContact O-CG2 3.48Å; L560-V564 PolarHBondContact O-N 3.17Å; I561-V564 PolarHBondContact O-N 3.42Å; V564-I583 HydrophobicContact CG1-CD1 4.33Å; V564-I583 HydrophobicContact CG1-CG2 4.48Å; V564-I583 HydrophobicContact CG2-CD1 3.98Å; V564-L586 HydrophobicContact CG1-CB 4.45Å; V564-K587 HydrophobicContact CG1-CG 3.68Å; V564-K587 WeakPolarHBondContact O-CD 3.44Å; V564-K587 PolarHBondContact O-NZ 3.12Å; V564-I590 HydrophobicContact CG1-CD1 4.3Å
565	L	74.2	Confident	74.9	Confident	76 Å²	76	88 Å²	88	40%	0.398	47%	0.471	S	S	.	.	H	α-helix	trans	-63.2	-39	173.1	-84.4	165.2	0	0	0	112.8	I561 Q563 K587 I590	I561-L565 HydrophobicContact CG2-CD1 4.25Å; I561-L565 WeakPolarHBondContact O-CB 3.33Å; I561-L565 PolarHBondContact O-N 3.42Å; Q563-L565 VanDerWaalsContact C-N 3.33Å; Q563-L565 PolarHBondContact O-N 2.92Å; L565-K587 PolarHBondContact O-NZ 2.68Å; L565-I590 HydrophobicContact CD1-CG2 3.79Å; L565-I590 HydrophobicContact CD2-CG2 4.28Å; L565-I590 HydrophobicContact CG-CG2 4.08Å
566	Q	76.5	Confident	75.6	Confident	138 Å²	138	85 Å²	85	65%	0.645	46%	0.464	S	S	*	.	H	α-helix	trans	-77.4	-16	-178.9	-75.9	171.9	97.4	0	0	115.1	M562 Q563 T568	M562-Q566 WeakPolarHBondContact O-CG 3.36Å; M562-Q566 PolarHBondContact O-N 3.36Å; M562-Q566 VanDerWaalsContact O-N 3.16Å; M562-Q566 PolarHBondContact O-NE2 2.86Å; Q563-Q566 PolarHBondContact O-N 3.19Å; Q563-Q566 VanDerWaalsContact O-N 3.12Å; Q566-T568 PolarHBondContact O-N 3.48Å
567	L	77.6	Confident	75.9	Confident	42 Å²	42	83.3 Å²	83.3	22%	0.22	47%	0.465	C	S	.	.			trans	-56.5	121.5	174.6	-72.3	173	0	0	0	111.5	Q563 Q571 I572 I583 K587	Q563-L567 PolarHBondContact O-N 2.93Å; Q563-L567 VanDerWaalsContact O-N 3.17Å; L567-Q571 HydrophobicContact CD2-CB 4.35Å; L567-I572 HydrophobicContact CB-CD1 4Å; L567-I572 HydrophobicContact CB-CG1 3.9Å; L567-I572 WeakPolarHBondContact O-CD1 3.21Å; L567-I583 HydrophobicContact CD1-CD1 4.45Å; L567-I583 HydrophobicContact CD1-CG2 4.09Å; L567-K587 PolarHBondContact O-NZ 3Å
568	T	78.9	Confident	76.1	Confident	74 Å²	74	84.3 Å²	84.3	45%	0.454	47%	0.471	S	S	.	.			trans	-72.9	156.6	177.2	61.4	0	0	0	0	111.3	Q566 D570 Q571 I572	Q566-T568 PolarHBondContact O-N 3.48Å; T568-D570 PolarHBondContact O-N 3.33Å; T568-D570 VanDerWaalsContact O-N 3.13Å; T568-Q571 PolarHBondContact O-N 3.01Å; T568-Q571 PolarHBondContact OG1-NE2 3.38Å; T568-I572 WeakPolarHBondContact O-CG1 3.47Å; T568-I572 PolarHBondContact O-N 2.96Å
569	A	72.9	Confident	76.6	Confident	84 Å²	84	87.4 Å²	87.4	69%	0.694	48%	0.478	S	S	*	.	H	α-helix	trans	-57.2	-29.2	179.9	0	0	0	0	0	113.4	A573	A569-A573 PolarHBondContact O-N 2.94Å; A569-A573 VanDerWaalsContact O-N 3.08Å
570	D	75.9	Confident	76.8	Confident	118 Å²	118	90 Å²	90	63%	0.631	48%	0.476	S	S	*	.	H	α-helix	trans	-72.3	-49	177.5	-162	-109.9	0	0	0	112	T568 I572 A573 M574	T568-D570 PolarHBondContact O-N 3.33Å; T568-D570 VanDerWaalsContact O-N 3.13Å; D570-I572 PolarHBondContact O-N 3.48Å; D570-A573 WeakPolarHBondContact O-CA 3.46Å; D570-A573 WeakPolarHBondContact O-CB 3.23Å; D570-A573 PolarHBondContact O-N 3.17Å; D570-M574 PolarHBondContact O-N 3.34Å; D570-M574 VanDerWaalsContact O-N 3.15Å
571	Q	73.6	Confident	77	Confident	96 Å²	96	91.8 Å²	91.8	45%	0.449	48%	0.481	S	S	.	.	H	α-helix	trans	-58.3	-38.5	171.8	-72.2	172.6	88.5	0	0	111.8	L567 T568 A573 M574	L567-Q571 HydrophobicContact CD2-CB 4.35Å; T568-Q571 PolarHBondContact O-N 3.01Å; T568-Q571 PolarHBondContact OG1-NE2 3.38Å; Q571-A573 VanDerWaalsContact C-N 3.25Å; Q571-A573 PolarHBondContact O-N 2.68Å; Q571-M574 PolarHBondContact O-N 2.85Å
572	I	75.7	Confident	77.1	Confident	10 Å²	10	91 Å²	91	5%	0.051	48%	0.483	C	S	.	.	H	α-helix	trans	-66.7	-27.1	175.1	-67.2	168.4	0	0	0	111.6	L567 T568 D570 R580 I583 L584 K587	L567-I572 HydrophobicContact CB-CD1 4Å; L567-I572 HydrophobicContact CB-CG1 3.9Å; L567-I572 WeakPolarHBondContact O-CD1 3.21Å; T568-I572 WeakPolarHBondContact O-CG1 3.47Å; T568-I572 PolarHBondContact O-N 2.96Å; D570-I572 PolarHBondContact O-N 3.48Å; I572-R580 HydrophobicContact CG2-CG 3.92Å; I572-R580 VanDerWaalsContact O-CD 3.25Å; I572-R580 WeakPolarHBondContact O-CD 3.48Å; I572-R580 VanDerWaalsContact O-CG 3.3Å; I572-R580 WeakPolarHBondContact O-CG 3.46Å; I572-I583 HydrophobicContact CD1-CG2 4.22Å; I572-I583 HydrophobicContact CG1-CG2 4.1Å; I572-L584 HydrophobicContact CG2-CD1 3.98Å; I572-K587 HydrophobicContact CD1-CD 3.75Å
573	A	76	Confident	77.5	Confident	45 Å²	45	86.6 Å²	86.6	37%	0.372	46%	0.461	S	S	.	.	H	α-helix	trans	-78.9	-23.7	175.9	0	0	0	0	0	113.8	A569 D570 Q571 L575	A569-A573 PolarHBondContact O-N 2.94Å; A569-A573 VanDerWaalsContact O-N 3.08Å; D570-A573 WeakPolarHBondContact O-CA 3.46Å; D570-A573 WeakPolarHBondContact O-CB 3.23Å; D570-A573 PolarHBondContact O-N 3.17Å; Q571-A573 VanDerWaalsContact C-N 3.25Å; Q571-A573 PolarHBondContact O-N 2.68Å; A573-L575 VanDerWaalsContact C-N 3.34Å
574	M	79.8	Confident	77.8	Confident	158 Å²	158	85.3 Å²	85.3	78%	0.778	46%	0.458	S	S	*	.	S	Bend	trans	-79.2	-12.2	174.3	-63.2	-174.3	73.5	0	0	114	D570 Q571	D570-M574 PolarHBondContact O-N 3.34Å; D570-M574 VanDerWaalsContact O-N 3.15Å; Q571-M574 PolarHBondContact O-N 2.85Å
575	L	80.1	Confident	78.1	Confident	63 Å²	63	88.7 Å²	88.7	33%	0.33	47%	0.474	S	S	.	.	S	Bend	trans	-76.8	150.1	178	-70.3	173.9	0	0	0	112.3	A573 Q579 R580 I583	A573-L575 VanDerWaalsContact C-N 3.34Å; L575-Q579 HydrophobicContact CB-CB 4.39Å; L575-R580 HydrophobicContact CB-CB 4.37Å; L575-I583 HydrophobicContact CD1-CG1 4.16Å
576	P	84.4	Confident	78.4	Confident	76 Å²	76	88.9 Å²	88.9	49%	0.494	48%	0.475	S	S	.	.			trans	-51.7	147.1	170.5	-26.2	34.6	0	0	0	112	E578 Q579 R580	P576-E578 VanDerWaalsContact C-N 3.31Å; P576-E578 PolarHBondContact O-N 3.39Å; P576-Q579 HydrophobicContact CB-CB 4.44Å; P576-Q579 HydrophobicContact CB-CG 4.33Å; P576-Q579 HydrophobicContact CG-CG 4.44Å; P576-Q579 WeakPolarHBondContact O-CB 3.42Å; P576-Q579 PolarHBondContact O-N 2.75Å; P576-R580 WeakPolarHBondContact O-CB 3.36Å; P576-R580 PolarHBondContact O-N 3.27Å
577	P	77.1	Confident	78.5	Confident	97 Å²	97	84.2 Å²	84.2	63%	0.63	45%	0.453	S	S	*	.	H	α-helix	trans	-57.7	-39.1	-169.1	20.9	-32.9	0	0	0	113.8	R580 Q581	P577-R580 PolarHBondContact O-N 2.89Å; P577-Q581 WeakPolarHBondContact O-CG 3.35Å; P577-Q581 PolarHBondContact O-N 3.42Å
578	E	74.6	Confident	78.7	Confident	148 Å²	148	87.4 Å²	87.4	69%	0.692	47%	0.467	S	S	*	.	H	α-helix	trans	-65.7	-46.8	177.1	-60.5	177.6	100.3	0	0	111.6	P576 R580 Q581 S582	P576-E578 VanDerWaalsContact C-N 3.31Å; P576-E578 PolarHBondContact O-N 3.39Å; E578-R580 VanDerWaalsContact C-N 3.32Å; E578-R580 PolarHBondContact O-N 3.4Å; E578-Q581 PolarHBondContact O-N 2.93Å; E578-S582 PolarHBondContact O-N 2.96Å; E578-S582 PolarHBondContact O-OG 3.3Å; E578-S582 VanDerWaalsContact O-OG 3.09Å
579	Q	77.4	Confident	78.5	Confident	110 Å²	110	89.3 Å²	89.3	51%	0.514	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-40.5	175.5	-66.1	-64.5	-53.1	0	0	111.4	L575 P576 Q581 S582 I583	L575-Q579 HydrophobicContact CB-CB 4.39Å; P576-Q579 HydrophobicContact CB-CB 4.44Å; P576-Q579 HydrophobicContact CB-CG 4.33Å; P576-Q579 HydrophobicContact CG-CG 4.44Å; P576-Q579 WeakPolarHBondContact O-CB 3.42Å; P576-Q579 PolarHBondContact O-N 2.75Å; Q579-Q581 PolarHBondContact O-N 2.97Å; Q579-S582 PolarHBondContact O-N 2.92Å; Q579-I583 WeakPolarHBondContact O-CB 3.37Å; Q579-I583 VanDerWaalsContact O-CG1 3.29Å; Q579-I583 WeakPolarHBondContact O-CG1 3.43Å; Q579-I583 PolarHBondContact O-N 3.13Å
580	R	81.8	Confident	78.7	Confident	113 Å²	113	86.3 Å²	86.3	43%	0.426	44%	0.443	S	S	.	.	H	α-helix	trans	-60.8	-42.9	175.5	178.2	173.4	-176.4	173.6	2	111.9	I572 L575 P576 P577 E578 L584	I572-R580 HydrophobicContact CG2-CG 3.92Å; I572-R580 VanDerWaalsContact O-CD 3.25Å; I572-R580 WeakPolarHBondContact O-CD 3.48Å; I572-R580 VanDerWaalsContact O-CG 3.3Å; I572-R580 WeakPolarHBondContact O-CG 3.46Å; L575-R580 HydrophobicContact CB-CB 4.37Å; P576-R580 WeakPolarHBondContact O-CB 3.36Å; P576-R580 PolarHBondContact O-N 3.27Å; P577-R580 PolarHBondContact O-N 2.89Å; E578-R580 VanDerWaalsContact C-N 3.32Å; E578-R580 PolarHBondContact O-N 3.4Å; R580-L584 PolarHBondContact O-N 2.82Å
581	Q	78.4	Confident	78.5	Confident	134 Å²	134	87.4 Å²	87.4	63%	0.626	44%	0.444	S	S	*	.	H	α-helix	trans	-66.4	-45.9	174.7	-73.8	-173.5	-60.6	0	0	111.7	P577 E578 Q579 I583 L584 I585	P577-Q581 WeakPolarHBondContact O-CG 3.35Å; P577-Q581 PolarHBondContact O-N 3.42Å; E578-Q581 PolarHBondContact O-N 2.93Å; Q579-Q581 PolarHBondContact O-N 2.97Å; Q581-I583 PolarHBondContact O-N 2.91Å; Q581-L584 PolarHBondContact O-N 3.33Å; Q581-I585 VanDerWaalsContact O-CG1 3.29Å; Q581-I585 WeakPolarHBondContact O-CG1 3.32Å; Q581-I585 PolarHBondContact O-N 3.16Å
582	S	78.1	Confident	78.5	Confident	58 Å²	58	89.8 Å²	89.8	41%	0.406	45%	0.453	S	S	.	.	H	α-helix	trans	-57.2	-47.2	175.9	-57.5	0	0	0	0	112.1	E578 Q579 L584 I585 L586	E578-S582 PolarHBondContact O-N 2.96Å; E578-S582 PolarHBondContact O-OG 3.3Å; E578-S582 VanDerWaalsContact O-OG 3.09Å; Q579-S582 PolarHBondContact O-N 2.92Å; S582-L584 PolarHBondContact O-N 2.93Å; S582-I585 PolarHBondContact O-N 3.35Å; S582-L586 WeakPolarHBondContact O-CD1 3.49Å; S582-L586 PolarHBondContact O-N 2.85Å
583	I	82.3	Confident	78	Confident	26 Å²	26	94.1 Å²	94.1	13%	0.133	48%	0.484	C	S	.	.	H	α-helix	trans	-64.9	-37.1	178	-69.3	-68.2	0	0	0	111.9	V564 L567 I572 L575 Q579 Q581 K587	V564-I583 HydrophobicContact CG1-CD1 4.33Å; V564-I583 HydrophobicContact CG1-CG2 4.48Å; V564-I583 HydrophobicContact CG2-CD1 3.98Å; L567-I583 HydrophobicContact CD1-CD1 4.45Å; L567-I583 HydrophobicContact CD1-CG2 4.09Å; I572-I583 HydrophobicContact CD1-CG2 4.22Å; I572-I583 HydrophobicContact CG1-CG2 4.1Å; L575-I583 HydrophobicContact CD1-CG1 4.16Å; Q579-I583 WeakPolarHBondContact O-CB 3.37Å; Q579-I583 VanDerWaalsContact O-CG1 3.29Å; Q579-I583 WeakPolarHBondContact O-CG1 3.43Å; Q579-I583 PolarHBondContact O-N 3.13Å; Q581-I583 PolarHBondContact O-N 2.91Å; I583-K587 HydrophobicContact CG2-CD 4.26Å; I583-K587 WeakPolarHBondContact O-CB 3.47Å; I583-K587 WeakPolarHBondContact O-CG 3.19Å; I583-K587 PolarHBondContact O-N 3.35Å
584	L	80.9	Confident	77.5	Confident	104 Å²	104	97.5 Å²	97.5	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-46	174	-128.5	84.8	0	0	0	111.7	I572 R580 Q581 S582 K587 E588	I572-L584 HydrophobicContact CG2-CD1 3.98Å; R580-L584 PolarHBondContact O-N 2.82Å; Q581-L584 PolarHBondContact O-N 3.33Å; S582-L584 PolarHBondContact O-N 2.93Å; L584-K587 PolarHBondContact O-N 3.12Å; L584-E588 PolarHBondContact O-N 3.01Å
585	I	83.7	Confident	76.6	Confident	92 Å²	92	92.6 Å²	92.6	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-65.5	-41.4	-179.8	-66.8	163.7	0	0	0	110.6	Q581 S582 E588 Q589	Q581-I585 VanDerWaalsContact O-CG1 3.29Å; Q581-I585 WeakPolarHBondContact O-CG1 3.32Å; Q581-I585 PolarHBondContact O-N 3.16Å; S582-I585 PolarHBondContact O-N 3.35Å; I585-E588 PolarHBondContact O-N 3.49Å; I585-Q589 HydrophobicContact CG2-CG 4.45Å; I585-Q589 WeakPolarHBondContact O-CB 3.38Å; I585-Q589 WeakPolarHBondContact O-CG 3.09Å; I585-Q589 PolarHBondContact O-N 2.97Å
586	L	79.8	Confident	74.4	Confident	81 Å²	81	93.5 Å²	93.5	42%	0.424	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-45.6	173	-92.6	84.8	0	0	0	111.5	V564 S582 E588 Q589 I590	V564-L586 HydrophobicContact CG1-CB 4.45Å; S582-L586 WeakPolarHBondContact O-CD1 3.49Å; S582-L586 PolarHBondContact O-N 2.85Å; L586-E588 VanDerWaalsContact C-N 3.31Å; L586-E588 PolarHBondContact O-N 3.24Å; L586-Q589 PolarHBondContact O-N 3.22Å; L586-I590 HydrophobicContact CB-CD1 4.33Å; L586-I590 VanDerWaalsContact O-CB 3.31Å; L586-I590 WeakPolarHBondContact O-CB 3.31Å; L586-I590 WeakPolarHBondContact O-CD1 3.45Å; L586-I590 WeakPolarHBondContact O-CG1 3.16Å; L586-I590 PolarHBondContact O-N 3.27Å
587	K	80.1	Confident	72.5	Confident	39 Å²	39	99.7 Å²	99.7	17%	0.17	55%	0.547	C	S	.	.	H	α-helix	trans	-59.1	-41.5	176.4	-74.2	-179.5	85.1	115.2	0	111.5	V564 L565 L567 I572 I583 L584 Q591	V564-K587 HydrophobicContact CG1-CG 3.68Å; V564-K587 WeakPolarHBondContact O-CD 3.44Å; V564-K587 PolarHBondContact O-NZ 3.12Å; L565-K587 PolarHBondContact O-NZ 2.68Å; L567-K587 PolarHBondContact O-NZ 3Å; I572-K587 HydrophobicContact CD1-CD 3.75Å; I583-K587 HydrophobicContact CG2-CD 4.26Å; I583-K587 WeakPolarHBondContact O-CB 3.47Å; I583-K587 WeakPolarHBondContact O-CG 3.19Å; I583-K587 PolarHBondContact O-N 3.35Å; L584-K587 PolarHBondContact O-N 3.12Å; K587-Q591 WeakPolarHBondContact O-CB 3.35Å; K587-Q591 PolarHBondContact O-N 2.94Å
588	E	81.6	Confident	72.3	Confident	110 Å²	110	99.9 Å²	99.9	51%	0.514	54%	0.543	S	S	.	.	H	α-helix	trans	-63.4	-52.4	173.9	-165.5	-167.4	120	0	0	111.4	L584 I585 L586 I590 Q591 K592	L584-E588 PolarHBondContact O-N 3.01Å; I585-E588 PolarHBondContact O-N 3.49Å; L586-E588 VanDerWaalsContact C-N 3.31Å; L586-E588 PolarHBondContact O-N 3.24Å; E588-I590 VanDerWaalsContact C-N 3.32Å; E588-I590 PolarHBondContact O-N 2.85Å; E588-Q591 PolarHBondContact O-N 3.15Å; E588-K592 WeakPolarHBondContact O-CB 3.33Å; E588-K592 PolarHBondContact O-N 3.46Å; E588-K592 IonicContact OE1-NZ 3.89Å; E588-K592 PolarHBondContact OE1-NZ 2.83Å
589	Q	75.4	Confident	72.2	Confident	114 Å²	114	97.3 Å²	97.3	53%	0.533	54%	0.535	S	S	.	.	H	α-helix	trans	-59.8	-40.6	-178.4	-73.3	-179.1	13	0	0	112.6	I585 L586 K592 S593	I585-Q589 HydrophobicContact CG2-CG 4.45Å; I585-Q589 WeakPolarHBondContact O-CB 3.38Å; I585-Q589 WeakPolarHBondContact O-CG 3.09Å; I585-Q589 PolarHBondContact O-N 2.97Å; L586-Q589 PolarHBondContact O-N 3.22Å; Q589-K592 PolarHBondContact O-N 2.85Å; Q589-S593 WeakPolarHBondContact O-CB 3.43Å; Q589-S593 PolarHBondContact O-N 3.33Å; Q589-S593 PolarHBondContact O-OG 2.79Å
590	I	76.1	Confident	71.9	Confident	21 Å²	21	96.6 Å²	96.6	11%	0.108	54%	0.536	C	S	.	.	H	α-helix	trans	-63.7	-52.5	174.8	-67.8	160.8	0	0	0	109.8	I561 V564 L565 L586 E588 K592 S593 T594	I561-I590 HydrophobicContact CB-CD1 4.43Å; I561-I590 HydrophobicContact CG1-CD1 4.09Å; I561-I590 HydrophobicContact CG2-CD1 4.12Å; I561-I590 HydrophobicContact CG2-CG1 4.38Å; I561-I590 HydrophobicContact CG2-CG2 3.86Å; V564-I590 HydrophobicContact CG1-CD1 4.3Å; L565-I590 HydrophobicContact CD1-CG2 3.79Å; L565-I590 HydrophobicContact CD2-CG2 4.28Å; L565-I590 HydrophobicContact CG-CG2 4.08Å; L586-I590 HydrophobicContact CB-CD1 4.33Å; L586-I590 VanDerWaalsContact O-CB 3.31Å; L586-I590 WeakPolarHBondContact O-CB 3.31Å; L586-I590 WeakPolarHBondContact O-CD1 3.45Å; L586-I590 WeakPolarHBondContact O-CG1 3.16Å; L586-I590 PolarHBondContact O-N 3.27Å; E588-I590 VanDerWaalsContact C-N 3.32Å; E588-I590 PolarHBondContact O-N 2.85Å; I590-K592 PolarHBondContact O-N 2.7Å; I590-S593 PolarHBondContact O-N 3.34Å; I590-T594 PolarHBondContact O-N 3.02Å; I590-T594 PolarHBondContact O-OG1 3.16Å
591	Q	71.3	Confident	71.3	Confident	141 Å²	141	95.6 Å²	95.6	66%	0.659	54%	0.543	S	S	*	.	H	α-helix	trans	-60.9	-33.2	-179.9	-174.3	172.7	-9.7	0	0	112.5	K587 E588 G595	K587-Q591 WeakPolarHBondContact O-CB 3.35Å; K587-Q591 PolarHBondContact O-N 2.94Å; E588-Q591 PolarHBondContact O-N 3.15Å; Q591-G595 PolarHBondContact O-N 3.31Å
592	K	74.4	Confident	70.8	Confident	145 Å²	145	93.3 Å²	93.3	63%	0.63	54%	0.537	S	S	*	.	H	α-helix	trans	-80.1	-14.4	177.3	-159.3	177.8	-147.8	164.4	0	113.6	E588 Q589 I590	E588-K592 WeakPolarHBondContact O-CB 3.33Å; E588-K592 PolarHBondContact O-N 3.46Å; E588-K592 IonicContact OE1-NZ 3.89Å; E588-K592 PolarHBondContact OE1-NZ 2.83Å; Q589-K592 PolarHBondContact O-N 2.85Å; I590-K592 PolarHBondContact O-N 2.7Å
593	S	64.8	Low	70.4	Confident	101 Å²	101	95.6 Å²	95.6	71%	0.706	55%	0.546	S	S	*	.	H	α-helix	trans	-98.8	-31.8	174.3	-55.9	0	0	0	0	112.5	Q589 I590	Q589-S593 WeakPolarHBondContact O-CB 3.43Å; Q589-S593 PolarHBondContact O-N 3.33Å; Q589-S593 PolarHBondContact O-OG 2.79Å; I590-S593 PolarHBondContact O-N 3.34Å
594	T	64.8	Low	69.5	Low	116 Å²	116	100.6 Å²	100.6	71%	0.712	58%	0.576	S	S	*	*	H	α-helix	trans	-77.9	-24	169.9	-57.5	0	0	0	0	111.9	I590 A596	I590-T594 PolarHBondContact O-N 3.02Å; I590-T594 PolarHBondContact O-OG1 3.16Å; T594-A596 PolarHBondContact O-N 3.14Å
595	G	61.5	Low	68.6	Low	55 Å²	55	100.3 Å²	100.3	57%	0.567	58%	0.578	S	S	*	*			trans	-88.9	80.4	177.2	0	0	0	0	0	114.1	Q591	Q591-G595 PolarHBondContact O-N 3.31Å
596	A	33.2	Very low	67.4	Low	82 Å²	82	101 Å²	101	68%	0.678	59%	0.587	S	S	*	*			trans	-103.1	153.3	157.2	0	0	0	0	0	109.2	T594	T594-A596 PolarHBondContact O-N 3.14Å
597	P	45.8	Very low	66.3	Low	207 Å²	207	102.8 Å²	102.8	100%	1.344	60%	0.602	S	S	*	*			trans	-74.4	0	-164.1	31	-37.3	0	0	0	115.4

Retrieved 597 of 597 residues in 75.7 ms (Link to these results)

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