G4LUD6_SCHMA Loading...

Pre-mRNA-splicing factor SLU7

Involved in pre-mRNA splicing.

AlphaFold DB , UniProt , Accession G4LUD6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 705 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	57.8	Low	74.2	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.03	28%	0.275	C	S	.	.				0	99.9	0	-69.5	177.4	-174.3	0	0	107	E38 R41 M49 P59 I61 M66	M1-E38 WeakPolarHBondContact CA-OE2 3.15Å; M1-E38 WeakPolarHBondContact CE-OE1 3.37Å; M1-E38 HydrophobicContact CG-CG 3.95Å; M1-E38 WeakPolarHBondContact CG-OE2 3.33Å; M1-E38 PolarHBondContact N-OE2 2.88Å; M1-R41 PolarHBondContact O-NH1 2.84Å; M1-M49 WeakPolarHBondContact O-CE 3.41Å; M1-P59 WeakPolarHBondContact CE-O 3.43Å; M1-P59 VanDerWaalsContact SD-O 3.37Å; M1-I61 WeakPolarHBondContact CE-O 3.31Å; M1-M66 HydrophobicContact CB-CE 4.01Å; M1-M66 HydrophobicContact CB-SD 3.68Å; M1-M66 HydrophobicContact CG-CE 4.5Å; M1-M66 HydrophobicContact CG-SD 4.16Å; M1-M66 HydrophobicContact SD-SD 3.99Å
2	S	63.4	Low	74.1	Confident	25 Å²	25	48.4 Å²	48.4	18%	0.175	28%	0.279	C	S	.	.			trans	-87.3	132.9	158.7	53.1	0	0	0	0	108	M34	S2-M34 WeakPolarHBondContact OG-CB 3.48Å; S2-M34 WeakPolarHBondContact OG-CG 3.49Å; S2-M34 PolarHBondContact OG-SD 3.24Å
3	F	72.7	Confident	74.2	Confident	22 Å²	22	55.6 Å²	55.6	10%	0.096	31%	0.309	C	S	.	.			trans	-62.7	151	159.7	-177.1	-107	0	0	0	109.9	P5 M49 A74 L75 H76 P77	F3-P5 HydrophobicContact CD1-CG 4.25Å; F3-P5 HydrophobicContact CE1-CB 4.26Å; F3-P5 HydrophobicContact CE1-CG 3.88Å; F3-M49 HydrophobicContact CB-SD 3.86Å; F3-A74 HydrophobicContact CZ-CB 4.34Å; F3-A74 WeakPolarHBondContact CZ-O 3.04Å; F3-L75 WeakPolarHBondContact CE1-O 3.23Å; F3-H76 WeakPolarHBondContact CE2-O 3.45Å; F3-H76 VanDerWaalsContact CZ-O 3.23Å; F3-H76 WeakPolarHBondContact CZ-O 3.4Å; F3-P77 HydrophobicContact CB-CB 4Å; F3-P77 HydrophobicContact CB-CG 3.7Å; F3-P77 HydrophobicContact CD2-CB 4.32Å; F3-P77 HydrophobicContact CG-CB 4.2Å; F3-P77 HydrophobicContact CG-CG 4.1Å
4	V	76.7	Confident	74.1	Confident	27 Å²	27	64.5 Å²	64.5	16%	0.164	34%	0.335	C	S	.	.			trans	-138.1	113.5	177	-170.6	0	0	0	0	105.8	N6	V4-N6 PolarHBondContact O-N 3.21Å; V4-N6 VanDerWaalsContact O-N 3.08Å
5	P	75.5	Confident	73.8	Confident	46 Å²	46	63.1 Å²	63.1	30%	0.299	33%	0.327	S	S	.	.			trans	-59.1	113.8	173.6	-23	33.1	0	0	0	109.6	F3 F7	F3-P5 HydrophobicContact CD1-CG 4.25Å; F3-P5 HydrophobicContact CE1-CB 4.26Å; F3-P5 HydrophobicContact CE1-CG 3.88Å; P5-F7 HydrophobicContact CB-CD2 4.41Å; P5-F7 HydrophobicContact CB-CE1 4.31Å; P5-F7 HydrophobicContact CB-CE2 3.81Å; P5-F7 HydrophobicContact CB-CZ 3.75Å; P5-F7 PolarHBondContact O-N 3.46Å
6	N	77.9	Confident	73.4	Confident	61 Å²	61	68.9 Å²	68.9	33%	0.326	35%	0.35	S	S	.	.			trans	-86	93.7	175.3	-75.9	-41	0	0	0	107.9	V4 A68 W70	V4-N6 PolarHBondContact O-N 3.21Å; V4-N6 VanDerWaalsContact O-N 3.08Å; N6-A68 PolarHBondContact ND2-O 2.75Å; N6-W70 HydrophobicContact CB-CB 4.05Å; N6-W70 WeakPolarHBondContact O-CA 3.5Å; N6-W70 WeakPolarHBondContact O-CB 3.38Å
7	F	77.4	Confident	72.8	Confident	81 Å²	81	70.1 Å²	70.1	36%	0.355	37%	0.365	S	S	.	.			trans	-74.5	149.7	176.8	-65.4	-66.1	0	0	0	112	P5 L11 L12 L75	P5-F7 HydrophobicContact CB-CD2 4.41Å; P5-F7 HydrophobicContact CB-CE1 4.31Å; P5-F7 HydrophobicContact CB-CE2 3.81Å; P5-F7 HydrophobicContact CB-CZ 3.75Å; P5-F7 PolarHBondContact O-N 3.46Å; F7-L11 HydrophobicContact CD1-CD2 4.48Å; F7-L12 HydrophobicContact CB-CD1 4.37Å; F7-L12 HydrophobicContact CB-CD2 4.2Å; F7-L12 HydrophobicContact CB-CG 3.94Å; F7-L12 WeakPolarHBondContact O-CD1 3.41Å; F7-L75 HydrophobicContact CE1-CD2 4.06Å
8	P	78.6	Confident	72.2	Confident	35 Å²	35	72.6 Å²	72.6	23%	0.227	38%	0.379	C	S	.	.			trans	-62.3	145.6	175.4	22.2	-30.4	0	0	0	111.3	S10 L11 L12 W70	P8-S10 PolarHBondContact O-N 3.19Å; P8-S10 VanDerWaalsContact O-N 3.08Å; P8-L11 HydrophobicContact CG-CB 3.8Å; P8-L11 HydrophobicContact CG-CD1 4.31Å; P8-L11 PolarHBondContact O-N 3.21Å; P8-L12 PolarHBondContact O-N 3.1Å; P8-L12 VanDerWaalsContact O-N 3.1Å; P8-W70 HydrophobicContact CB-CD2 4.39Å; P8-W70 HydrophobicContact CB-CE3 3.63Å; P8-W70 HydrophobicContact CB-CZ3 4.04Å
9	P	77.3	Confident	71	Confident	74 Å²	74	74.6 Å²	74.6	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-54.7	-31.5	-177.6	-29.2	35.9	0	0	0	115	Q13	P9-Q13 WeakPolarHBondContact O-CG 3.36Å; P9-Q13 PolarHBondContact O-N 3.1Å
10	S	81.9	Confident	69.7	Low	72 Å²	72	78.7 Å²	78.7	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-70.2	-30.6	177	50.7	0	0	0	0	113.8	P8 Q13 R14	P8-S10 PolarHBondContact O-N 3.19Å; P8-S10 VanDerWaalsContact O-N 3.08Å; S10-Q13 PolarHBondContact O-N 3.49Å; S10-R14 PolarHBondContact O-N 2.89Å
11	L	77.4	Confident	68.4	Low	71 Å²	71	77 Å²	77	37%	0.372	42%	0.42	S	S	.	.	H	α-helix	trans	-79.9	-39.9	176	-162.3	164.1	0	0	0	109.6	F7 P8 Q13 R14 I15	F7-L11 HydrophobicContact CD1-CD2 4.48Å; P8-L11 HydrophobicContact CG-CB 3.8Å; P8-L11 HydrophobicContact CG-CD1 4.31Å; P8-L11 PolarHBondContact O-N 3.21Å; L11-Q13 PolarHBondContact O-N 2.7Å; L11-R14 PolarHBondContact O-N 3.14Å; L11-R14 VanDerWaalsContact O-N 3.07Å; L11-I15 HydrophobicContact CD2-CD1 3.52Å; L11-I15 HydrophobicContact CD2-CG1 4.03Å; L11-I15 PolarHBondContact O-N 2.96Å
12	L	72.6	Confident	67.6	Low	61 Å²	61	82.6 Å²	82.6	32%	0.319	45%	0.45	S	S	.	.	H	α-helix	trans	-62	-20.8	168.2	-70.1	166.8	0	0	0	113.7	F7 P8 K16	F7-L12 HydrophobicContact CB-CD1 4.37Å; F7-L12 HydrophobicContact CB-CD2 4.2Å; F7-L12 HydrophobicContact CB-CG 3.94Å; F7-L12 WeakPolarHBondContact O-CD1 3.41Å; P8-L12 PolarHBondContact O-N 3.1Å; P8-L12 VanDerWaalsContact O-N 3.1Å; L12-K16 WeakPolarHBondContact O-CD 3.47Å; L12-K16 VanDerWaalsContact O-CG 3.27Å; L12-K16 WeakPolarHBondContact O-CG 3.29Å
13	Q	74.9	Confident	66.8	Low	142 Å²	142	86.5 Å²	86.5	66%	0.664	47%	0.466	S	S	*	.	H	α-helix	trans	-81.7	-33.8	170.7	-83.1	178.2	-43	0	0	112.8	P9 S10 L11 S17	P9-Q13 WeakPolarHBondContact O-CG 3.36Å; P9-Q13 PolarHBondContact O-N 3.1Å; S10-Q13 PolarHBondContact O-N 3.49Å; L11-Q13 PolarHBondContact O-N 2.7Å; Q13-S17 PolarHBondContact O-N 3.3Å
14	R	74.1	Confident	65.6	Low	180 Å²	180	92.5 Å²	92.5	68%	0.679	49%	0.492	S	S	*	.	H	α-helix	trans	-72.1	-45.9	176.5	-71.9	178.6	-177.3	175.3	-0.4	112.7	S10 L11 K16 S17 D18	S10-R14 PolarHBondContact O-N 2.89Å; L11-R14 PolarHBondContact O-N 3.14Å; L11-R14 VanDerWaalsContact O-N 3.07Å; R14-K16 PolarHBondContact O-N 3.01Å; R14-K16 VanDerWaalsContact O-N 3.15Å; R14-S17 PolarHBondContact O-N 3.02Å; R14-S17 PolarHBondContact O-OG 3.39Å; R14-D18 WeakPolarHBondContact O-CB 3.1Å; R14-D18 PolarHBondContact O-N 2.71Å; R14-D18 VanDerWaalsContact O-N 3.12Å
15	I	68.7	Low	64.6	Low	43 Å²	43	101 Å²	101	22%	0.221	53%	0.526	C	S	.	.	H	α-helix	trans	-55.3	-38.2	174.4	-61.9	168.6	0	0	0	110.1	L11 S17 D18 D19 E23	L11-I15 HydrophobicContact CD2-CD1 3.52Å; L11-I15 HydrophobicContact CD2-CG1 4.03Å; L11-I15 PolarHBondContact O-N 2.96Å; I15-S17 PolarHBondContact O-N 3.07Å; I15-D18 PolarHBondContact O-N 3.02Å; I15-D19 PolarHBondContact O-N 3.14Å; I15-D19 VanDerWaalsContact O-N 3.08Å; I15-E23 HydrophobicContact CG2-CG 3.86Å
16	K	66.8	Low	63.8	Low	157 Å²	157	104.9 Å²	104.9	68%	0.683	54%	0.535	S	S	*	.	H	α-helix	trans	-72.9	-14.9	175.9	-76.4	179.6	-177	169.5	0	116.6	L12 R14	L12-K16 WeakPolarHBondContact O-CD 3.47Å; L12-K16 VanDerWaalsContact O-CG 3.27Å; L12-K16 WeakPolarHBondContact O-CG 3.29Å; R14-K16 PolarHBondContact O-N 3.01Å; R14-K16 VanDerWaalsContact O-N 3.15Å
17	S	63.7	Low	63.5	Low	88 Å²	88	104.3 Å²	104.3	62%	0.615	54%	0.536	S	S	*	.	H	α-helix	trans	-89.6	-25.6	169.8	52.5	0	0	0	0	112.4	Q13 R14 I15	Q13-S17 PolarHBondContact O-N 3.3Å; R14-S17 PolarHBondContact O-N 3.02Å; R14-S17 PolarHBondContact O-OG 3.39Å; I15-S17 PolarHBondContact O-N 3.07Å
18	D	62.8	Low	63.7	Low	116 Å²	116	107.7 Å²	107.7	62%	0.62	55%	0.55	S	S	*	*	H	α-helix	trans	-104.5	-36.2	-161.9	-57.5	-2.2	0	0	0	112.3	R14 I15 T20	R14-D18 WeakPolarHBondContact O-CB 3.1Å; R14-D18 PolarHBondContact O-N 2.71Å; R14-D18 VanDerWaalsContact O-N 3.12Å; I15-D18 PolarHBondContact O-N 3.02Å; D18-T20 PolarHBondContact O-N 2.8Å
19	D	49.4	Very low	64	Low	110 Å²	110	109.5 Å²	109.5	59%	0.588	56%	0.558	S	S	*	*			trans	-93.7	100.5	-174.6	-88.6	-53.6	0	0	0	114.4	I15 G21	I15-D19 PolarHBondContact O-N 3.14Å; I15-D19 VanDerWaalsContact O-N 3.08Å; D19-G21 PolarHBondContact O-N 2.82Å
20	T	45.2	Very low	64.3	Low	156 Å²	156	109 Å²	109	96%	0.957	55%	0.552	S	S	*	*			trans	-75.6	53.9	160.2	56.3	0	0	0	0	111.5	D18	D18-T20 PolarHBondContact O-N 2.8Å
21	G	41.5	Very low	64.2	Low	43 Å²	43	112.8 Å²	112.8	44%	0.443	56%	0.556	S	S	.	*	S	Bend	trans	-177.6	125.6	-178.8	0	0	0	0	0	115.2	D19 E23	D19-G21 PolarHBondContact O-N 2.82Å; G21-E23 VanDerWaalsContact C-N 3.32Å; G21-E23 PolarHBondContact O-N 2.74Å
22	D	40.4	Very low	64.7	Low	125 Å²	125	115.1 Å²	115.1	67%	0.668	56%	0.56	S	S	*	*			trans	52.9	20	152.6	-86.2	-4.4	0	0	0	121.9	K24	D22-K24 PolarHBondContact O-N 2.83Å; D22-K24 WeakPolarHBondContact OD1-CE 3.49Å; D22-K24 IonicContact OD1-NZ 3.01Å; D22-K24 PolarHBondContact OD1-NZ 3.32Å; D22-K24 IonicContact OD2-NZ 3.15Å; D22-K24 PolarHBondContact OD2-NZ 3.36Å
23	E	47	Very low	65.4	Low	107 Å²	107	117.8 Å²	117.8	50%	0.5	57%	0.569	S	S	.	*			trans	-65.4	57.8	147.7	-86.4	-126.3	128.4	0	0	111.1	I15 G21 K25	I15-E23 HydrophobicContact CG2-CG 3.86Å; G21-E23 VanDerWaalsContact C-N 3.32Å; G21-E23 PolarHBondContact O-N 2.74Å; E23-K25 PolarHBondContact O-N 3.33Å
24	K	48.5	Very low	65.8	Low	147 Å²	147	112.3 Å²	112.3	64%	0.639	54%	0.544	S	S	*	.			trans	-60.8	112	170.6	-76.1	168	173	129.2	0	107.6	D22 R26	D22-K24 PolarHBondContact O-N 2.83Å; D22-K24 WeakPolarHBondContact OD1-CE 3.49Å; D22-K24 IonicContact OD1-NZ 3.01Å; D22-K24 PolarHBondContact OD1-NZ 3.32Å; D22-K24 IonicContact OD2-NZ 3.15Å; D22-K24 PolarHBondContact OD2-NZ 3.36Å; K24-R26 PolarHBondContact O-N 3.15Å
25	K	55.1	Low	66.3	Low	205 Å²	205	108.2 Å²	108.2	89%	0.891	53%	0.531	S	S	*	.			trans	-41.1	109.9	164.3	-67.4	174.3	-177.6	171.4	0	107.3	E23 S27	E23-K25 PolarHBondContact O-N 3.33Å; K25-S27 PolarHBondContact O-N 3.46Å
26	R	59.3	Low	67.3	Low	128 Å²	128	111.3 Å²	111.3	48%	0.483	54%	0.544	S	S	.	.			trans	-33.4	125.1	-165.7	-82.6	175.5	150.5	-163	-10.3	111.6	K24 M34	K24-R26 PolarHBondContact O-N 3.15Å; R26-M34 VanDerWaalsContact CZ-SD 3.54Å; R26-M34 PolarHBondContact NH1-SD 2.81Å
27	S	71.7	Confident	68.2	Low	49 Å²	49	107.1 Å²	107.1	34%	0.343	53%	0.529	S	S	.	.			trans	-55.6	148.6	-171	-176.9	0	0	0	0	110	K25 D29 D30 Y31	K25-S27 PolarHBondContact O-N 3.46Å; S27-D29 PolarHBondContact O-N 2.81Å; S27-D29 PolarHBondContact OG-N 3.01Å; S27-D29 PolarHBondContact OG-OD2 2.84Å; S27-D30 WeakPolarHBondContact CB-OD2 3.49Å; S27-D30 PolarHBondContact N-OD2 3.32Å; S27-D30 WeakPolarHBondContact O-CA 3.42Å; S27-D30 PolarHBondContact O-N 3.3Å; S27-Y31 PolarHBondContact O-N 2.97Å
28	K	81.4	Confident	69.1	Low	152 Å²	152	104.3 Å²	104.3	66%	0.661	51%	0.506	S	S	*	.	H	α-helix	trans	-50.6	-31.5	169.5	-171	174.4	-177.5	175.8	0	110.8	R32	K28-R32 WeakPolarHBondContact O-CD 3.33Å; K28-R32 VanDerWaalsContact O-CG 3.25Å; K28-R32 WeakPolarHBondContact O-CG 3.29Å; K28-R32 PolarHBondContact O-N 2.83Å
29	D	84.9	Confident	70.3	Confident	73 Å²	73	102.8 Å²	102.8	39%	0.39	50%	0.495	S	S	.	.	H	α-helix	trans	-80.6	-27	179.1	-50.2	-51.7	0	0	0	113.2	S27 R32 K33	S27-D29 PolarHBondContact O-N 2.81Å; S27-D29 PolarHBondContact OG-N 3.01Å; S27-D29 PolarHBondContact OG-OD2 2.84Å; D29-R32 IonicContact OD1-CZ 2.79Å; D29-R32 IonicContact OD1-NH1 3.78Å; D29-R32 PolarHBondContact OD1-NH1 3.35Å; D29-K33 WeakPolarHBondContact O-CB 3.37Å; D29-K33 WeakPolarHBondContact O-CD 3.19Å; D29-K33 WeakPolarHBondContact O-CG 3.41Å; D29-K33 PolarHBondContact O-N 3.47Å
30	D	82.8	Confident	72.2	Confident	64 Å²	64	98.6 Å²	98.6	34%	0.342	48%	0.476	S	S	.	.	H	α-helix	trans	-72.4	-40.5	169.1	-55	-40.6	0	0	0	110.2	S27 R32 K33 M34	S27-D30 WeakPolarHBondContact CB-OD2 3.49Å; S27-D30 PolarHBondContact N-OD2 3.32Å; S27-D30 WeakPolarHBondContact O-CA 3.42Å; S27-D30 PolarHBondContact O-N 3.3Å; D30-R32 VanDerWaalsContact C-N 3.33Å; D30-R32 PolarHBondContact O-N 2.88Å; D30-K33 PolarHBondContact O-N 3.01Å; D30-K33 IonicContact OD1-NZ 3.2Å; D30-M34 WeakPolarHBondContact O-CB 3.32Å; D30-M34 WeakPolarHBondContact O-CE 3.23Å; D30-M34 WeakPolarHBondContact O-CG 3.46Å; D30-M34 PolarHBondContact O-N 2.81Å
31	Y	80.5	Confident	74.3	Confident	151 Å²	151	93.2 Å²	93.2	59%	0.592	44%	0.438	S	S	*	.	H	α-helix	trans	-62	-40.8	173.6	-172.8	-95.7	0	0	0	112.2	S27 M34 K35	S27-Y31 PolarHBondContact O-N 2.97Å; Y31-M34 HydrophobicContact CD2-CE 4.33Å; Y31-M34 PolarHBondContact O-N 3.07Å; Y31-K35 WeakPolarHBondContact O-CB 3.29Å; Y31-K35 PolarHBondContact O-N 3.27Å; Y31-K35 VanDerWaalsContact O-N 3.09Å
32	R	87.5	Confident	76.6	Confident	121 Å²	121	94.8 Å²	94.8	46%	0.457	43%	0.433	S	S	.	.	H	α-helix	trans	-56.7	-59.5	169.4	-79.1	161.2	161.9	173.1	-13.3	111.5	K28 D29 D30 M34 K35 E36	K28-R32 WeakPolarHBondContact O-CD 3.33Å; K28-R32 VanDerWaalsContact O-CG 3.25Å; K28-R32 WeakPolarHBondContact O-CG 3.29Å; K28-R32 PolarHBondContact O-N 2.83Å; D29-R32 IonicContact OD1-CZ 2.79Å; D29-R32 IonicContact OD1-NH1 3.78Å; D29-R32 PolarHBondContact OD1-NH1 3.35Å; D30-R32 VanDerWaalsContact C-N 3.33Å; D30-R32 PolarHBondContact O-N 2.88Å; R32-M34 VanDerWaalsContact C-N 3.27Å; R32-M34 PolarHBondContact O-N 3.02Å; R32-K35 CarbonylContact O-C 3.55Å; R32-K35 WeakPolarHBondContact O-CA 3.5Å; R32-K35 PolarHBondContact O-N 3.06Å; R32-E36 WeakPolarHBondContact CB-OE1 3.37Å; R32-E36 WeakPolarHBondContact O-CB 3.11Å; R32-E36 WeakPolarHBondContact O-CG 3.3Å; R32-E36 PolarHBondContact O-N 3.49Å
33	K	87.9	Confident	79	Confident	116 Å²	116	95 Å²	95	50%	0.504	43%	0.433	S	S	.	.	H	α-helix	trans	-52.5	-41.9	177.7	-70.7	163.8	-168.7	169.1	0	112.7	D29 D30 K35 E36 L37	D29-K33 WeakPolarHBondContact O-CB 3.37Å; D29-K33 WeakPolarHBondContact O-CD 3.19Å; D29-K33 WeakPolarHBondContact O-CG 3.41Å; D29-K33 PolarHBondContact O-N 3.47Å; D30-K33 PolarHBondContact O-N 3.01Å; D30-K33 IonicContact OD1-NZ 3.2Å; K33-K35 PolarHBondContact O-N 2.57Å; K33-E36 PolarHBondContact O-N 3.35Å; K33-L37 WeakPolarHBondContact O-CB 3.08Å; K33-L37 WeakPolarHBondContact O-CG 3.18Å; K33-L37 PolarHBondContact O-N 2.94Å
34	M	82.1	Confident	81	Confident	28 Å²	28	94.2 Å²	94.2	14%	0.138	45%	0.445	C	S	.	.	H	α-helix	trans	-67.4	-32.5	179.1	-72.2	-175.6	-56.8	0	0	113.5	S2 R26 D30 Y31 R32 E38	S2-M34 WeakPolarHBondContact OG-CB 3.48Å; S2-M34 WeakPolarHBondContact OG-CG 3.49Å; S2-M34 PolarHBondContact OG-SD 3.24Å; R26-M34 VanDerWaalsContact CZ-SD 3.54Å; R26-M34 PolarHBondContact NH1-SD 2.81Å; D30-M34 WeakPolarHBondContact O-CB 3.32Å; D30-M34 WeakPolarHBondContact O-CE 3.23Å; D30-M34 WeakPolarHBondContact O-CG 3.46Å; D30-M34 PolarHBondContact O-N 2.81Å; Y31-M34 HydrophobicContact CD2-CE 4.33Å; Y31-M34 PolarHBondContact O-N 3.07Å; R32-M34 VanDerWaalsContact C-N 3.27Å; R32-M34 PolarHBondContact O-N 3.02Å; M34-E38 PolarHBondContact O-N 3.25Å
35	K	85.6	Confident	83	Confident	94 Å²	94	92.5 Å²	92.5	41%	0.409	45%	0.446	S	S	.	.	H	α-helix	trans	-81	-36.9	174.7	-176.6	179.3	173.8	-63.6	0	112.1	Y31 R32 K33 E38 E39	Y31-K35 WeakPolarHBondContact O-CB 3.29Å; Y31-K35 PolarHBondContact O-N 3.27Å; Y31-K35 VanDerWaalsContact O-N 3.09Å; R32-K35 CarbonylContact O-C 3.55Å; R32-K35 WeakPolarHBondContact O-CA 3.5Å; R32-K35 PolarHBondContact O-N 3.06Å; K33-K35 PolarHBondContact O-N 2.57Å; K35-E38 CarbonylContact O-C 3.07Å; K35-E38 WeakPolarHBondContact O-CA 3.47Å; K35-E38 WeakPolarHBondContact O-CB 3.48Å; K35-E38 PolarHBondContact O-N 2.79Å; K35-E39 VanDerWaalsContact CE-OE1 3.26Å; K35-E39 WeakPolarHBondContact CE-OE1 3.49Å; K35-E39 IonicContact NZ-OE1 3.35Å; K35-E39 PolarHBondContact NZ-OE1 3.35Å; K35-E39 IonicContact NZ-OE2 3.13Å; K35-E39 PolarHBondContact NZ-OE2 3.13Å; K35-E39 PolarHBondContact O-N 3.29Å
36	E	89	Confident	84.5	Confident	108 Å²	108	86.3 Å²	86.3	51%	0.505	42%	0.422	S	S	.	.	H	α-helix	trans	-65	-43.6	172.5	-72	150.9	-162.7	0	0	110.5	R32 K33 E38 E39 A40	R32-E36 WeakPolarHBondContact CB-OE1 3.37Å; R32-E36 WeakPolarHBondContact O-CB 3.11Å; R32-E36 WeakPolarHBondContact O-CG 3.3Å; R32-E36 PolarHBondContact O-N 3.49Å; K33-E36 PolarHBondContact O-N 3.35Å; E36-E38 PolarHBondContact O-N 3.07Å; E36-E39 PolarHBondContact O-N 3.11Å; E36-A40 VanDerWaalsContact O-CB 3.24Å; E36-A40 WeakPolarHBondContact O-CB 3.23Å; E36-A40 PolarHBondContact O-N 2.99Å
37	L	85.4	Confident	85.8	Confident	68 Å²	68	84.6 Å²	84.6	36%	0.356	43%	0.427	S	S	.	.	H	α-helix	trans	-67.9	-9.7	167.6	-69	171.1	0	0	0	113.5	K33 R41 M46	K33-L37 WeakPolarHBondContact O-CB 3.08Å; K33-L37 WeakPolarHBondContact O-CG 3.18Å; K33-L37 PolarHBondContact O-N 2.94Å; L37-R41 WeakPolarHBondContact O-CB 2.96Å; L37-R41 WeakPolarHBondContact O-CD 3.41Å; L37-R41 WeakPolarHBondContact O-CG 3.48Å; L37-M46 HydrophobicContact CD2-CE 3.89Å; L37-M46 HydrophobicContact CD2-CG 4.22Å
38	E	82.9	Confident	86.6	Confident	30 Å²	30	83.6 Å²	83.6	14%	0.14	42%	0.421	C	S	.	.	H	α-helix	trans	-83.7	-49.2	167.3	-170.2	146.1	145.4	0	0	112	M1 M34 K35 E36 R41 K42	M1-E38 WeakPolarHBondContact CA-OE2 3.15Å; M1-E38 WeakPolarHBondContact CE-OE1 3.37Å; M1-E38 HydrophobicContact CG-CG 3.95Å; M1-E38 WeakPolarHBondContact CG-OE2 3.33Å; M1-E38 PolarHBondContact N-OE2 2.88Å; M34-E38 PolarHBondContact O-N 3.25Å; K35-E38 CarbonylContact O-C 3.07Å; K35-E38 WeakPolarHBondContact O-CA 3.47Å; K35-E38 WeakPolarHBondContact O-CB 3.48Å; K35-E38 PolarHBondContact O-N 2.79Å; E36-E38 PolarHBondContact O-N 3.07Å; E38-R41 PolarHBondContact O-N 3.4Å; E38-K42 HydrophobicContact CG-CD 4.02Å; E38-K42 VanDerWaalsContact CG-CE 3.45Å; E38-K42 WeakPolarHBondContact O-CB 3.4Å; E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.1Å; E38-K42 WeakPolarHBondContact OE1-CE 3.35Å; E38-K42 IonicContact OE1-NZ 2.69Å; E38-K42 PolarHBondContact OE1-NZ 3.46Å
39	E	87.6	Confident	86.8	Confident	83 Å²	83	77.8 Å²	77.8	39%	0.388	40%	0.397	S	S	.	.	H	α-helix	trans	-67.1	-43.6	-179.7	-79.4	147.5	-162.4	0	0	110.1	K35 E36 R41 K42 L43	K35-E39 VanDerWaalsContact CE-OE1 3.26Å; K35-E39 WeakPolarHBondContact CE-OE1 3.49Å; K35-E39 IonicContact NZ-OE1 3.35Å; K35-E39 PolarHBondContact NZ-OE1 3.35Å; K35-E39 IonicContact NZ-OE2 3.13Å; K35-E39 PolarHBondContact NZ-OE2 3.13Å; K35-E39 PolarHBondContact O-N 3.29Å; E36-E39 PolarHBondContact O-N 3.11Å; E39-R41 VanDerWaalsContact C-N 3.32Å; E39-R41 PolarHBondContact O-N 3.3Å; E39-K42 CarbonylContact O-C 3.51Å; E39-K42 PolarHBondContact O-N 3.2Å; E39-L43 VanDerWaalsContact O-CB 3.3Å; E39-L43 WeakPolarHBondContact O-CB 3.27Å; E39-L43 WeakPolarHBondContact O-CG 3.38Å; E39-L43 PolarHBondContact O-N 2.85Å
40	A	90.3	Very high	87	Confident	23 Å²	23	80.5 Å²	80.5	19%	0.19	41%	0.406	C	S	.	.	H	α-helix	trans	-61.3	-34	172.2	0	0	0	0	0	113.7	E36 A44 V45 M46	E36-A40 VanDerWaalsContact O-CB 3.24Å; E36-A40 WeakPolarHBondContact O-CB 3.23Å; E36-A40 PolarHBondContact O-N 2.99Å; A40-A44 PolarHBondContact O-N 3.32Å; A40-V45 HydrophobicContact CB-CB 4.39Å; A40-V45 PolarHBondContact O-N 3.12Å; A40-M46 HydrophobicContact CB-CB 4.18Å; A40-M46 HydrophobicContact CB-CG 3.71Å; A40-M46 PolarHBondContact O-N 2.92Å; A40-M46 VanDerWaalsContact O-N 3.1Å
41	R	88.8	Confident	87.2	Confident	42 Å²	42	78.6 Å²	78.6	16%	0.158	40%	0.395	C	S	.	.	H	α-helix	trans	-73.3	-39.5	173.4	-80.8	-178.1	171.3	121.2	16.1	112.5	M1 L37 E38 E39 L43 A44 M46 P47 P59	M1-R41 PolarHBondContact O-NH1 2.84Å; L37-R41 WeakPolarHBondContact O-CB 2.96Å; L37-R41 WeakPolarHBondContact O-CD 3.41Å; L37-R41 WeakPolarHBondContact O-CG 3.48Å; E38-R41 PolarHBondContact O-N 3.4Å; E39-R41 VanDerWaalsContact C-N 3.32Å; E39-R41 PolarHBondContact O-N 3.3Å; R41-L43 VanDerWaalsContact C-N 3.26Å; R41-L43 PolarHBondContact O-N 3.14Å; R41-A44 PolarHBondContact O-N 3.49Å; R41-A44 VanDerWaalsContact O-N 3.11Å; R41-M46 HydrophobicContact CG-CB 3.8Å; R41-P47 WeakPolarHBondContact CG-O 3.11Å; R41-P47 PolarHBondContact NE-O 3.23Å; R41-P59 HydrophobicContact CB-CB 3.79Å; R41-P59 HydrophobicContact CB-CG 3.8Å
42	K	90.2	Very high	87.5	Confident	77 Å²	77	75.8 Å²	75.8	34%	0.335	39%	0.387	S	S	.	.	H	α-helix	trans	-70	-23.1	174.8	-72.6	172.7	-175.1	170.9	0	113	E38 E39 A44 P59 H60	E38-K42 HydrophobicContact CG-CD 4.02Å; E38-K42 VanDerWaalsContact CG-CE 3.45Å; E38-K42 WeakPolarHBondContact O-CB 3.4Å; E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.1Å; E38-K42 WeakPolarHBondContact OE1-CE 3.35Å; E38-K42 IonicContact OE1-NZ 2.69Å; E38-K42 PolarHBondContact OE1-NZ 3.46Å; E39-K42 CarbonylContact O-C 3.51Å; E39-K42 PolarHBondContact O-N 3.2Å; K42-A44 VanDerWaalsContact C-N 3.33Å; K42-P59 WeakPolarHBondContact CE-O 3.17Å; K42-P59 HydrophobicContact CG-CB 4.12Å; K42-P59 VanDerWaalsContact CG-O 3.29Å; K42-P59 WeakPolarHBondContact CG-O 3.47Å; K42-H60 PolarHBondContact O-CE1 2.97Å
43	L	91.4	Very high	87.5	Confident	130 Å²	130	75.2 Å²	75.2	68%	0.681	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	5.6	171	-66.1	169.1	0	0	0	112.8	E39 R41 V45	E39-L43 VanDerWaalsContact O-CB 3.3Å; E39-L43 WeakPolarHBondContact O-CB 3.27Å; E39-L43 WeakPolarHBondContact O-CG 3.38Å; E39-L43 PolarHBondContact O-N 2.85Å; R41-L43 VanDerWaalsContact C-N 3.26Å; R41-L43 PolarHBondContact O-N 3.14Å; L43-V45 HydrophobicContact CB-CG2 4.1Å; L43-V45 PolarHBondContact O-N 3.44Å; L43-V45 VanDerWaalsContact O-N 3.07Å
44	A	87.6	Confident	87.5	Confident	89 Å²	89	71.8 Å²	71.8	74%	0.736	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	14.8	-177.7	0	0	0	0	0	116.2	A40 R41 K42	A40-A44 PolarHBondContact O-N 3.32Å; R41-A44 PolarHBondContact O-N 3.49Å; R41-A44 VanDerWaalsContact O-N 3.11Å; K42-A44 VanDerWaalsContact C-N 3.33Å
45	V	91.9	Very high	87.9	Confident	111 Å²	111	77 Å²	77	67%	0.673	41%	0.406	S	S	*	.	S	Bend	trans	-74	-34.9	174.8	-179.3	0	0	0	0	111.2	A40 L43	A40-V45 HydrophobicContact CB-CB 4.39Å; A40-V45 PolarHBondContact O-N 3.12Å; L43-V45 HydrophobicContact CB-CG2 4.1Å; L43-V45 PolarHBondContact O-N 3.44Å; L43-V45 VanDerWaalsContact O-N 3.07Å
46	M	84.7	Confident	88.1	Confident	76 Å²	76	77.2 Å²	77.2	37%	0.374	41%	0.412	S	S	.	.	S	Bend	trans	-110	141.9	176.5	-72.8	-63.7	-71.7	0	0	110.9	L37 A40 R41	L37-M46 HydrophobicContact CD2-CE 3.89Å; L37-M46 HydrophobicContact CD2-CG 4.22Å; A40-M46 HydrophobicContact CB-CB 4.18Å; A40-M46 HydrophobicContact CB-CG 3.71Å; A40-M46 PolarHBondContact O-N 2.92Å; A40-M46 VanDerWaalsContact O-N 3.1Å; R41-M46 HydrophobicContact CG-CB 3.8Å
47	P	87.6	Confident	88.2	Confident	92 Å²	92	72.5 Å²	72.5	60%	0.597	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-61.6	150	-179.2	25	-34.5	0	0	0	112.1	R41	R41-P47 WeakPolarHBondContact CG-O 3.11Å; R41-P47 PolarHBondContact NE-O 3.23Å
48	A	89	Confident	88.3	Confident	27 Å²	27	73.2 Å²	73.2	22%	0.223	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-57	160.5	174.7	0	0	0	0	0	111.9	D56 P59	A48-D56 HydrophobicContact CB-CB 3.77Å; A48-P59 HydrophobicContact CB-CG 4.44Å
49	M	84.6	Confident	88.6	Confident	31 Å²	31	72.6 Å²	72.6	15%	0.153	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119	178.7	179	158	-82.7	0	0	108.6	M1 F3 I57 P77	M1-M49 WeakPolarHBondContact O-CE 3.41Å; F3-M49 HydrophobicContact CB-SD 3.86Å; M49-I57 HydrophobicContact CB-CB 4.46Å; M49-I57 HydrophobicContact CG-CD1 4.49Å; M49-I57 WeakPolarHBondContact O-CA 3.13Å; M49-I57 WeakPolarHBondContact O-CB 3.3Å; M49-I57 WeakPolarHBondContact O-CG1 3.48Å; M49-I57 PolarHBondContact O-N 3.08Å; M49-P77 HydrophobicContact CE-CG 4.42Å; M49-P77 HydrophobicContact CG-CB 3.56Å; M49-P77 HydrophobicContact CG-CG 3.51Å; M49-P77 HydrophobicContact SD-CB 3.66Å; M49-P77 HydrophobicContact SD-CG 3.52Å; M49-P77 VanDerWaalsContact SD-CG 3.52Å
50	K	89.3	Confident	88.8	Confident	130 Å²	130	74.5 Å²	74.5	57%	0.565	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	144.9	178.8	-68.1	-172.7	176.3	-168.4	0	111.8	R55 D56	K50-R55 CarbonylContact C-O 3.6Å; K50-R55 WeakPolarHBondContact CA-O 3.22Å; K50-D56 WeakPolarHBondContact CE-OD1 3.48Å; K50-D56 VanDerWaalsContact CG-OD1 3.31Å; K50-D56 WeakPolarHBondContact CG-OD1 3.19Å
51	D	88	Confident	88.8	Confident	23 Å²	23	75.2 Å²	75.2	12%	0.123	40%	0.401	C	S	.	.			trans	-88.7	178.1	171.2	73	12.5	0	0	0	113	E53 G54 R55 I57 P77	D51-E53 PolarHBondContact O-N 3.24Å; D51-E53 WeakPolarHBondContact OD1-CA 3.44Å; D51-E53 WeakPolarHBondContact OD1-CB 3.31Å; D51-E53 PolarHBondContact OD1-N 3.5Å; D51-G54 WeakPolarHBondContact O-CA 3.3Å; D51-G54 PolarHBondContact O-N 3.15Å; D51-G54 PolarHBondContact OD1-N 3.02Å; D51-G54 VanDerWaalsContact OD1-N 3.15Å; D51-R55 PolarHBondContact N-O 2.95Å; D51-R55 WeakPolarHBondContact OD1-CB 3.25Å; D51-R55 PolarHBondContact OD1-N 3.07Å; D51-I57 HydrophobicContact CB-CD1 4.08Å; D51-I57 HydrophobicContact CB-CG1 4.09Å; D51-P77 VanDerWaalsContact CA-O 3.26Å; D51-P77 WeakPolarHBondContact CA-O 3.26Å; D51-P77 WeakPolarHBondContact CB-O 3.45Å
52	E	86.6	Confident	88.8	Confident	92 Å²	92	75.8 Å²	75.8	43%	0.43	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.7	178.1	-61.9	165.4	155.1	0	0	113.4	H76 T78	E52-H76 HydrophobicContact CG-CB 3.8Å; E52-H76 IonicContact OE1-CD2 2.74Å; E52-T78 PolarHBondContact OE2-OG1 3.26Å
53	E	86.7	Confident	88.7	Confident	110 Å²	110	76.2 Å²	76.2	51%	0.514	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	6.2	174.4	-63.3	178.3	-153.4	0	0	112	D51 R55	D51-E53 PolarHBondContact O-N 3.24Å; D51-E53 WeakPolarHBondContact OD1-CA 3.44Å; D51-E53 WeakPolarHBondContact OD1-CB 3.31Å; D51-E53 PolarHBondContact OD1-N 3.5Å; E53-R55 VanDerWaalsContact C-N 3.27Å; E53-R55 HydrophobicContact CB-CG 4.07Å; E53-R55 PolarHBondContact O-N 2.95Å; E53-R55 IonicContact OE2-CZ 2.65Å; E53-R55 IonicContact OE2-NE 2.66Å; E53-R55 PolarHBondContact OE2-NE 3.1Å; E53-R55 IonicContact OE2-NH2 2.92Å; E53-R55 PolarHBondContact OE2-NH2 3.08Å
54	G	88.4	Confident	88.6	Confident	44 Å²	44	78.5 Å²	78.5	45%	0.454	41%	0.414	S	S	.	.	S	Bend	trans	75.8	7	-178.3	0	0	0	0	0	114.9	D51	D51-G54 WeakPolarHBondContact O-CA 3.3Å; D51-G54 PolarHBondContact O-N 3.15Å; D51-G54 PolarHBondContact OD1-N 3.02Å; D51-G54 VanDerWaalsContact OD1-N 3.15Å
55	R	90.6	Very high	88.8	Confident	136 Å²	136	76.9 Å²	76.9	51%	0.513	39%	0.393	S	S	.	.			trans	-81.5	144.5	-178.9	-48.8	175.8	-172.3	-93.3	1	110.6	K50 D51 E53 I57	K50-R55 CarbonylContact C-O 3.6Å; K50-R55 WeakPolarHBondContact CA-O 3.22Å; D51-R55 PolarHBondContact N-O 2.95Å; D51-R55 WeakPolarHBondContact OD1-CB 3.25Å; D51-R55 PolarHBondContact OD1-N 3.07Å; E53-R55 VanDerWaalsContact C-N 3.27Å; E53-R55 HydrophobicContact CB-CG 4.07Å; E53-R55 PolarHBondContact O-N 2.95Å; E53-R55 IonicContact OE2-CZ 2.65Å; E53-R55 IonicContact OE2-NE 2.66Å; E53-R55 PolarHBondContact OE2-NE 3.1Å; E53-R55 IonicContact OE2-NH2 2.92Å; E53-R55 PolarHBondContact OE2-NH2 3.08Å; R55-I57 PolarHBondContact O-N 3.09Å
56	D	90.6	Very high	88.6	Confident	100 Å²	100	71.6 Å²	71.6	54%	0.535	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	115.2	177.5	-66.4	-55.2	0	0	0	112.2	A48 K50 N58	A48-D56 HydrophobicContact CB-CB 3.77Å; K50-D56 WeakPolarHBondContact CE-OD1 3.48Å; K50-D56 VanDerWaalsContact CG-OD1 3.31Å; K50-D56 WeakPolarHBondContact CG-OD1 3.19Å; D56-N58 PolarHBondContact O-N 3.13Å
57	I	89.3	Confident	88.7	Confident	8 Å²	8	69.9 Å²	69.9	4%	0.041	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	112.5	168.6	-59.4	176.7	0	0	0	108.2	M49 D51 R55 P59 I61 M66 P77 L79	M49-I57 HydrophobicContact CB-CB 4.46Å; M49-I57 HydrophobicContact CG-CD1 4.49Å; M49-I57 WeakPolarHBondContact O-CA 3.13Å; M49-I57 WeakPolarHBondContact O-CB 3.3Å; M49-I57 WeakPolarHBondContact O-CG1 3.48Å; M49-I57 PolarHBondContact O-N 3.08Å; D51-I57 HydrophobicContact CB-CD1 4.08Å; D51-I57 HydrophobicContact CB-CG1 4.09Å; R55-I57 PolarHBondContact O-N 3.09Å; I57-P59 WeakPolarHBondContact O-CD 3.42Å; I57-I61 HydrophobicContact CG2-CD1 4.27Å; I57-M66 HydrophobicContact CG2-CG 3.89Å; I57-M66 HydrophobicContact CG2-SD 4.21Å; I57-P77 HydrophobicContact CD1-CB 3.6Å; I57-L79 HydrophobicContact CD1-CD1 4.49Å; I57-L79 HydrophobicContact CG1-CD1 4.44Å; I57-L79 HydrophobicContact CG2-CD1 4Å
58	N	89.3	Confident	88.8	Confident	83 Å²	83	65.6 Å²	65.6	44%	0.444	32%	0.324	S	S	.	.			trans	-58.3	120.4	-179.9	178.4	-26.9	0	0	0	111.3	D56 H60 I61	D56-N58 PolarHBondContact O-N 3.13Å; N58-H60 PolarHBondContact O-N 2.9Å; N58-H60 WeakPolarHBondContact OD1-CB 3.36Å; N58-H60 PolarHBondContact OD1-CD2 2.93Å; N58-H60 PolarHBondContact OD1-N 3.25Å; N58-I61 HydrophobicContact CB-CD1 3.87Å; N58-I61 HydrophobicContact CB-CG1 4.05Å; N58-I61 WeakPolarHBondContact O-CB 3.2Å; N58-I61 WeakPolarHBondContact O-CG1 3.34Å; N58-I61 PolarHBondContact O-N 3.44Å
59	P	89.3	Confident	88.8	Confident	18 Å²	18	66.1 Å²	66.1	12%	0.117	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-7.9	-178.9	-27.5	37.2	0	0	0	117.1	M1 R41 K42 A48 I57	M1-P59 WeakPolarHBondContact CE-O 3.43Å; M1-P59 VanDerWaalsContact SD-O 3.37Å; R41-P59 HydrophobicContact CB-CB 3.79Å; R41-P59 HydrophobicContact CB-CG 3.8Å; K42-P59 WeakPolarHBondContact CE-O 3.17Å; K42-P59 HydrophobicContact CG-CB 4.12Å; K42-P59 VanDerWaalsContact CG-O 3.29Å; K42-P59 WeakPolarHBondContact CG-O 3.47Å; A48-P59 HydrophobicContact CB-CG 4.44Å; I57-P59 WeakPolarHBondContact O-CD 3.42Å
60	H	90.2	Very high	88.9	Confident	123 Å²	123	70.8 Å²	70.8	57%	0.569	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.3	176	-55	-75.4	0	0	0	113.3	K42 N58 P62	K42-H60 PolarHBondContact O-CE1 2.97Å; N58-H60 PolarHBondContact O-N 2.9Å; N58-H60 WeakPolarHBondContact OD1-CB 3.36Å; N58-H60 PolarHBondContact OD1-CD2 2.93Å; N58-H60 PolarHBondContact OD1-N 3.25Å; H60-P62 VanDerWaalsContact O-CD 3.3Å; H60-P62 WeakPolarHBondContact O-CD 3.27Å
61	I	90.5	Very high	88.8	Confident	38 Å²	38	72.5 Å²	72.5	20%	0.195	35%	0.345	C	S	.	.	S	Bend	trans	-66.6	115.7	174.4	-65.7	167.7	0	0	0	108.9	M1 I57 N58 I65 M66 L79	M1-I61 WeakPolarHBondContact CE-O 3.31Å; I57-I61 HydrophobicContact CG2-CD1 4.27Å; N58-I61 HydrophobicContact CB-CD1 3.87Å; N58-I61 HydrophobicContact CB-CG1 4.05Å; N58-I61 WeakPolarHBondContact O-CB 3.2Å; N58-I61 WeakPolarHBondContact O-CG1 3.34Å; N58-I61 PolarHBondContact O-N 3.44Å; I61-I65 HydrophobicContact CG2-CB 3.78Å; I61-I65 HydrophobicContact CG2-CG2 3.83Å; I61-M66 HydrophobicContact CG2-CB 4.36Å; I61-L79 HydrophobicContact CD1-CD1 4.28Å; I61-L79 HydrophobicContact CD1-CD2 3.99Å
62	P	89.9	Confident	88.7	Confident	53 Å²	53	75.5 Å²	75.5	34%	0.344	36%	0.356	S	S	.	.			trans	-52.2	143.5	-176.1	-29	35.9	0	0	0	113.6	H60 Y64 I65 M66	H60-P62 VanDerWaalsContact O-CD 3.3Å; H60-P62 WeakPolarHBondContact O-CD 3.27Å; P62-Y64 HydrophobicContact CB-CD1 3.74Å; P62-Y64 HydrophobicContact CB-CE1 3.3Å; P62-Y64 HydrophobicContact CG-CE1 4.14Å; P62-Y64 PolarHBondContact O-N 3.4Å; P62-I65 HydrophobicContact CG-CD1 4.45Å; P62-I65 PolarHBondContact O-N 3.38Å; P62-M66 PolarHBondContact O-N 2.79Å; P62-M66 VanDerWaalsContact O-N 3.16Å
63	Q	86.5	Confident	88.5	Confident	86 Å²	86	73.6 Å²	73.6	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-52.2	-35.8	-172.5	-177	-179.8	-9.8	0	0	113.4	I65 M66 Q67	Q63-I65 VanDerWaalsContact C-N 3.29Å; Q63-I65 PolarHBondContact O-N 3.14Å; Q63-M66 PolarHBondContact O-N 3.48Å; Q63-Q67 HydrophobicContact CG-CG 3.97Å; Q63-Q67 VanDerWaalsContact NE2-NE2 3.16Å; Q63-Q67 WeakPolarHBondContact O-CB 3.46Å; Q63-Q67 WeakPolarHBondContact O-CG 3.25Å; Q63-Q67 PolarHBondContact O-N 2.76Å
64	Y	90.1	Very high	88.3	Confident	179 Å²	179	69.1 Å²	69.1	70%	0.702	34%	0.342	S	S	*	.	H	α-helix	trans	-72.5	-14.8	178.7	68	-95.8	0	0	0	114.7	P62	P62-Y64 HydrophobicContact CB-CD1 3.74Å; P62-Y64 HydrophobicContact CB-CE1 3.3Å; P62-Y64 HydrophobicContact CG-CE1 4.14Å; P62-Y64 PolarHBondContact O-N 3.4Å
65	I	92.1	Very high	88	Confident	54 Å²	54	72.1 Å²	72.1	28%	0.277	35%	0.347	S	S	.	.	H	α-helix	trans	-93.3	-32.8	171.4	-53.3	-173.5	0	0	0	110.2	I61 P62 Q63 H81 Q82	I61-I65 HydrophobicContact CG2-CB 3.78Å; I61-I65 HydrophobicContact CG2-CG2 3.83Å; P62-I65 HydrophobicContact CG-CD1 4.45Å; P62-I65 PolarHBondContact O-N 3.38Å; Q63-I65 VanDerWaalsContact C-N 3.29Å; Q63-I65 PolarHBondContact O-N 3.14Å; I65-H81 PolarHBondContact O-CE1 3.1Å; I65-H81 VanDerWaalsContact O-CE1 3.27Å; I65-H81 PolarHBondContact O-NE2 2.81Å; I65-Q82 HydrophobicContact CG2-CG 3.96Å; I65-Q82 WeakPolarHBondContact O-CG 3.45Å; I65-Q82 PolarHBondContact O-NE2 2.84Å; I65-Q82 VanDerWaalsContact O-NE2 3.12Å
66	M	87.6	Confident	87.7	Confident	1 Å²	1	71 Å²	71	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-76.8	-39.1	179	-171	-159.7	69	0	0	113	M1 I57 I61 P62 Q63 A68	M1-M66 HydrophobicContact CB-CE 4.01Å; M1-M66 HydrophobicContact CB-SD 3.68Å; M1-M66 HydrophobicContact CG-CE 4.5Å; M1-M66 HydrophobicContact CG-SD 4.16Å; M1-M66 HydrophobicContact SD-SD 3.99Å; I57-M66 HydrophobicContact CG2-CG 3.89Å; I57-M66 HydrophobicContact CG2-SD 4.21Å; I61-M66 HydrophobicContact CG2-CB 4.36Å; P62-M66 PolarHBondContact O-N 2.79Å; P62-M66 VanDerWaalsContact O-N 3.16Å; Q63-M66 PolarHBondContact O-N 3.48Å; M66-A68 PolarHBondContact O-N 3.42Å
67	Q	87.7	Confident	87.4	Confident	39 Å²	39	67.3 Å²	67.3	18%	0.182	33%	0.329	C	S	.	.	S	Bend	trans	-76.1	109.9	-177.9	-75.2	-173.6	-38.8	0	0	111.2	Q63 P69	Q63-Q67 HydrophobicContact CG-CG 3.97Å; Q63-Q67 VanDerWaalsContact NE2-NE2 3.16Å; Q63-Q67 WeakPolarHBondContact O-CB 3.46Å; Q63-Q67 WeakPolarHBondContact O-CG 3.25Å; Q63-Q67 PolarHBondContact O-N 2.76Å; Q67-P69 WeakPolarHBondContact O-CD 3.35Å
68	A	88.5	Confident	87.4	Confident	3 Å²	3	67 Å²	67	3%	0.025	33%	0.328	C	S	.	.			trans	-54.8	128.3	168.9	0	0	0	0	0	110.7	N6 M66 Y72 A74 H81	N6-A68 PolarHBondContact ND2-O 2.75Å; M66-A68 PolarHBondContact O-N 3.42Å; A68-Y72 HydrophobicContact CB-CD1 4.12Å; A68-A74 HydrophobicContact CB-CB 3.79Å; A68-H81 PolarHBondContact N-CE1 2.83Å
69	P	88.5	Confident	87.4	Confident	37 Å²	37	64.8 Å²	64.8	24%	0.24	32%	0.316	C	S	.	.			trans	-62.2	153.4	171.8	-25.3	36	0	0	0	112.1	Q67 Y71 Y72	Q67-P69 WeakPolarHBondContact O-CD 3.35Å; P69-Y71 HydrophobicContact CB-CD1 3.79Å; P69-Y71 HydrophobicContact CB-CD2 4.45Å; P69-Y71 HydrophobicContact CB-CE1 3.32Å; P69-Y71 HydrophobicContact CB-CE2 4.05Å; P69-Y71 HydrophobicContact CB-CG 4.33Å; P69-Y71 VanDerWaalsContact CB-CZ 3.47Å; P69-Y71 HydrophobicContact CG-CE1 4.09Å; P69-Y71 HydrophobicContact CG-CE2 4.41Å; P69-Y71 PolarHBondContact O-N 2.91Å; P69-Y71 VanDerWaalsContact O-N 3.13Å; P69-Y72 VanDerWaalsContact O-CB 3.3Å; P69-Y72 WeakPolarHBondContact O-CB 3.29Å; P69-Y72 PolarHBondContact O-N 2.93Å
70	W	87.9	Confident	87.4	Confident	130 Å²	130	70.4 Å²	70.4	49%	0.492	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-58.9	-31.3	-174	63.6	-98.6	0	0	0	114.4	N6 P8 Y72 G73	N6-W70 HydrophobicContact CB-CB 4.05Å; N6-W70 WeakPolarHBondContact O-CA 3.5Å; N6-W70 WeakPolarHBondContact O-CB 3.38Å; P8-W70 HydrophobicContact CB-CD2 4.39Å; P8-W70 HydrophobicContact CB-CE3 3.63Å; P8-W70 HydrophobicContact CB-CZ3 4.04Å; W70-Y72 PolarHBondContact O-N 3.3Å; W70-G73 PolarHBondContact O-N 3.47Å; W70-G73 VanDerWaalsContact O-N 3.15Å
71	Y	87.4	Confident	87.3	Confident	166 Å²	166	65.6 Å²	65.6	65%	0.651	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-71.2	-10.5	177.6	59.1	-104.6	0	0	0	113.4	P69	P69-Y71 HydrophobicContact CB-CD1 3.79Å; P69-Y71 HydrophobicContact CB-CD2 4.45Å; P69-Y71 HydrophobicContact CB-CE1 3.32Å; P69-Y71 HydrophobicContact CB-CE2 4.05Å; P69-Y71 HydrophobicContact CB-CG 4.33Å; P69-Y71 VanDerWaalsContact CB-CZ 3.47Å; P69-Y71 HydrophobicContact CG-CE1 4.09Å; P69-Y71 HydrophobicContact CG-CE2 4.41Å; P69-Y71 PolarHBondContact O-N 2.91Å; P69-Y71 VanDerWaalsContact O-N 3.13Å
72	Y	85.8	Confident	87.3	Confident	86 Å²	86	68.3 Å²	68.3	34%	0.337	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-87.1	-19.2	172.2	-166.4	-98.4	0	0	0	112.6	A68 P69 W70 A74 T78 R80 H81	A68-Y72 HydrophobicContact CB-CD1 4.12Å; P69-Y72 VanDerWaalsContact O-CB 3.3Å; P69-Y72 WeakPolarHBondContact O-CB 3.29Å; P69-Y72 PolarHBondContact O-N 2.93Å; W70-Y72 PolarHBondContact O-N 3.3Å; Y72-A74 VanDerWaalsContact C-N 3.31Å; Y72-A74 HydrophobicContact CD1-CB 3.96Å; Y72-A74 HydrophobicContact CE1-CB 4.38Å; Y72-A74 PolarHBondContact O-N 3.26Å; Y72-T78 HydrophobicContact CE1-CG2 4.12Å; Y72-R80 WeakPolarHBondContact OH-CB 3.47Å; Y72-R80 VanDerWaalsContact OH-CD 3.3Å; Y72-R80 WeakPolarHBondContact OH-CD 3.31Å; Y72-R80 WeakPolarHBondContact OH-CG 3.45Å; Y72-H81 HydrophobicContact CD1-CB 3.75Å; Y72-H81 HydrophobicContact CD2-CB 3.65Å; Y72-H81 HydrophobicContact CE1-CB 3.87Å; Y72-H81 HydrophobicContact CE2-CB 3.77Å; Y72-H81 HydrophobicContact CG-CB 3.65Å
73	G	81.6	Confident	87.3	Confident	52 Å²	52	72.3 Å²	72.3	54%	0.536	33%	0.332	S	S	.	.			trans	69.3	14.5	171.2	0	0	0	0	0	116.8	W70 L75	W70-G73 PolarHBondContact O-N 3.47Å; W70-G73 VanDerWaalsContact O-N 3.15Å; G73-L75 PolarHBondContact O-N 2.91Å
74	A	82.8	Confident	87.3	Confident	15 Å²	15	73.4 Å²	73.4	12%	0.124	34%	0.34	C	S	.	.			trans	-66.9	129.2	-179.3	0	0	0	0	0	112.7	F3 A68 Y72 T78	F3-A74 HydrophobicContact CZ-CB 4.34Å; F3-A74 WeakPolarHBondContact CZ-O 3.04Å; A68-A74 HydrophobicContact CB-CB 3.79Å; Y72-A74 VanDerWaalsContact C-N 3.31Å; Y72-A74 HydrophobicContact CD1-CB 3.96Å; Y72-A74 HydrophobicContact CE1-CB 4.38Å; Y72-A74 PolarHBondContact O-N 3.26Å; A74-T78 HydrophobicContact CB-CG2 3.46Å; A74-T78 VanDerWaalsContact CB-CG2 3.46Å
75	L	82.1	Confident	86.8	Confident	108 Å²	108	69.7 Å²	69.7	57%	0.565	33%	0.329	S	S	*	.	S	Bend	trans	-91.8	-18	172.9	-59.7	178.2	0	0	0	112.4	F3 F7 G73	F3-L75 WeakPolarHBondContact CE1-O 3.23Å; F7-L75 HydrophobicContact CE1-CD2 4.06Å; G73-L75 PolarHBondContact O-N 2.91Å
76	H	83.1	Confident	85.9	Confident	111 Å²	111	71 Å²	71	51%	0.514	34%	0.337	S	S	.	.	S	Bend	trans	-118.2	162	-177.2	-57	-62.5	0	0	0	111.5	F3 E52 T78	F3-H76 WeakPolarHBondContact CE2-O 3.45Å; F3-H76 VanDerWaalsContact CZ-O 3.23Å; F3-H76 WeakPolarHBondContact CZ-O 3.4Å; E52-H76 HydrophobicContact CG-CB 3.8Å; E52-H76 IonicContact OE1-CD2 2.74Å; H76-T78 PolarHBondContact O-N 3.13Å
77	P	86	Confident	84.9	Confident	23 Å²	23	78.1 Å²	78.1	15%	0.149	37%	0.37	C	S	.	.			trans	-58.4	123.9	170.2	-11.9	24.4	0	0	0	109.8	F3 M49 D51 I57	F3-P77 HydrophobicContact CB-CB 4Å; F3-P77 HydrophobicContact CB-CG 3.7Å; F3-P77 HydrophobicContact CD2-CB 4.32Å; F3-P77 HydrophobicContact CG-CB 4.2Å; F3-P77 HydrophobicContact CG-CG 4.1Å; M49-P77 HydrophobicContact CE-CG 4.42Å; M49-P77 HydrophobicContact CG-CB 3.56Å; M49-P77 HydrophobicContact CG-CG 3.51Å; M49-P77 HydrophobicContact SD-CB 3.66Å; M49-P77 HydrophobicContact SD-CG 3.52Å; M49-P77 VanDerWaalsContact SD-CG 3.52Å; D51-P77 VanDerWaalsContact CA-O 3.26Å; D51-P77 WeakPolarHBondContact CA-O 3.26Å; D51-P77 WeakPolarHBondContact CB-O 3.45Å; I57-P77 HydrophobicContact CD1-CB 3.6Å
78	T	88.7	Confident	83.7	Confident	3 Å²	3	81.9 Å²	81.9	2%	0.018	39%	0.386	C	S	.	.			trans	-154.8	127.7	-178.4	-172.5	0	0	0	0	112.8	E52 Y72 A74 H76 R80 H81	E52-T78 PolarHBondContact OE2-OG1 3.26Å; Y72-T78 HydrophobicContact CE1-CG2 4.12Å; A74-T78 HydrophobicContact CB-CG2 3.46Å; A74-T78 VanDerWaalsContact CB-CG2 3.46Å; H76-T78 PolarHBondContact O-N 3.13Å; T78-R80 VanDerWaalsContact C-N 3.28Å; T78-R80 VanDerWaalsContact OG1-CB 3.26Å; T78-R80 WeakPolarHBondContact OG1-CB 3.26Å; T78-R80 PolarHBondContact OG1-N 3.15Å; T78-H81 PolarHBondContact O-CE1 2.82Å; T78-H81 PolarHBondContact O-ND1 3.03Å
79	L	89.9	Confident	82.2	Confident	36 Å²	36	85.6 Å²	85.6	19%	0.188	40%	0.401	C	S	.	.			trans	-86.4	3.9	169.6	-114.8	80.5	0	0	0	112.8	I57 I61 H81 Q82	I57-L79 HydrophobicContact CD1-CD1 4.49Å; I57-L79 HydrophobicContact CG1-CD1 4.44Å; I57-L79 HydrophobicContact CG2-CD1 4Å; I61-L79 HydrophobicContact CD1-CD1 4.28Å; I61-L79 HydrophobicContact CD1-CD2 3.99Å; L79-H81 PolarHBondContact O-N 3.14Å; L79-Q82 HydrophobicContact CG-CB 4.47Å; L79-Q82 HydrophobicContact CG-CG 4.35Å; L79-Q82 WeakPolarHBondContact O-CB 3.41Å; L79-Q82 PolarHBondContact O-N 2.98Å
80	R	88.9	Confident	80.3	Confident	135 Å²	135	91.4 Å²	91.4	51%	0.509	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-58.8	-30.6	-178.5	-167.9	-178.6	164.5	-174.9	-3.8	112.6	Y72 T78 Q82 R83	Y72-R80 WeakPolarHBondContact OH-CB 3.47Å; Y72-R80 VanDerWaalsContact OH-CD 3.3Å; Y72-R80 WeakPolarHBondContact OH-CD 3.31Å; Y72-R80 WeakPolarHBondContact OH-CG 3.45Å; T78-R80 VanDerWaalsContact C-N 3.28Å; T78-R80 VanDerWaalsContact OG1-CB 3.26Å; T78-R80 WeakPolarHBondContact OG1-CB 3.26Å; T78-R80 PolarHBondContact OG1-N 3.15Å; R80-Q82 PolarHBondContact O-N 3.43Å; R80-R83 WeakPolarHBondContact O-CB 3.47Å; R80-R83 PolarHBondContact O-N 3.26Å
81	H	87.6	Confident	78.8	Confident	22 Å²	22	90.9 Å²	90.9	10%	0.102	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-67.3	-17.1	174	77.6	-85	0	0	0	114.7	I65 A68 Y72 T78 L79	I65-H81 PolarHBondContact O-CE1 3.1Å; I65-H81 VanDerWaalsContact O-CE1 3.27Å; I65-H81 PolarHBondContact O-NE2 2.81Å; A68-H81 PolarHBondContact N-CE1 2.83Å; Y72-H81 HydrophobicContact CD1-CB 3.75Å; Y72-H81 HydrophobicContact CD2-CB 3.65Å; Y72-H81 HydrophobicContact CE1-CB 3.87Å; Y72-H81 HydrophobicContact CE2-CB 3.77Å; Y72-H81 HydrophobicContact CG-CB 3.65Å; T78-H81 PolarHBondContact O-CE1 2.82Å; T78-H81 PolarHBondContact O-ND1 3.03Å; L79-H81 PolarHBondContact O-N 3.14Å
82	Q	90.9	Very high	77	Confident	95 Å²	95	85.6 Å²	85.6	44%	0.444	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-97.7	-1.8	175.1	-59.1	-67.1	-13.7	0	0	112.9	I65 L79 R80	I65-Q82 HydrophobicContact CG2-CG 3.96Å; I65-Q82 WeakPolarHBondContact O-CG 3.45Å; I65-Q82 PolarHBondContact O-NE2 2.84Å; I65-Q82 VanDerWaalsContact O-NE2 3.12Å; L79-Q82 HydrophobicContact CG-CB 4.47Å; L79-Q82 HydrophobicContact CG-CG 4.35Å; L79-Q82 WeakPolarHBondContact O-CB 3.41Å; L79-Q82 PolarHBondContact O-N 2.98Å; R80-Q82 PolarHBondContact O-N 3.43Å
83	R	89.7	Confident	75.1	Confident	137 Å²	137	87 Å²	87	52%	0.517	42%	0.422	S	S	.	.	S	Bend	trans	-73.9	163.8	169.9	-60.3	-61.2	-172.6	-172.7	-0.7	109.6	R80 Q85	R80-R83 WeakPolarHBondContact O-CB 3.47Å; R80-R83 PolarHBondContact O-N 3.26Å; R83-Q85 PolarHBondContact O-N 2.64Å
84	I	86	Confident	73.4	Confident	109 Å²	109	88.1 Å²	88.1	56%	0.559	42%	0.422	S	S	*	.	S	Bend	trans	-51.5	118.4	173	-55.9	175.5	0	0	0	107.7	K88 K89	I84-K88 HydrophobicContact CG2-CB 3.96Å; I84-K89 HydrophobicContact CB-CG 4.15Å; I84-K89 HydrophobicContact CG2-CG 3.83Å; I84-K89 VanDerWaalsContact O-CE 3.31Å; I84-K89 WeakPolarHBondContact O-CE 3.26Å; I84-K89 PolarHBondContact O-NZ 3.49Å
85	Q	79.9	Confident	71.5	Confident	101 Å²	101	90 Å²	90	47%	0.472	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-62.8	147.6	-171.7	-69.5	168.6	-48.3	0	0	110.8	R83 E87 K88 K89	R83-Q85 PolarHBondContact O-N 2.64Å; Q85-E87 PolarHBondContact O-N 2.59Å; Q85-E87 VanDerWaalsContact O-N 3.1Å; Q85-K88 PolarHBondContact O-N 2.81Å; Q85-K89 PolarHBondContact O-N 2.74Å
86	D	72.5	Confident	69.8	Low	83 Å²	83	91.7 Å²	91.7	44%	0.444	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-6.9	-177	-66.8	-25.8	0	0	0	113.7	K89 R90	D86-K89 IonicContact OD1-NZ 3.83Å; D86-K89 PolarHBondContact OD1-NZ 3.39Å; D86-R90 WeakPolarHBondContact O-CB 3.45Å; D86-R90 PolarHBondContact O-N 2.82Å; D86-R90 VanDerWaalsContact O-N 3.09Å
87	E	66.8	Low	67.9	Low	149 Å²	149	88.8 Å²	88.8	70%	0.696	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-50.3	163.8	-68.7	-173.3	148.4	0	0	111.5	Q85 R90 E91	Q85-E87 PolarHBondContact O-N 2.59Å; Q85-E87 VanDerWaalsContact O-N 3.1Å; E87-R90 CarbonylContact O-C 3.27Å; E87-R90 WeakPolarHBondContact O-CA 3.41Å; E87-R90 PolarHBondContact O-N 2.78Å; E87-E91 PolarHBondContact O-N 3.4Å
88	K	62.7	Low	66.1	Low	118 Å²	118	94.8 Å²	94.8	51%	0.513	46%	0.456	S	S	.	.	H	α-helix	trans	-61.9	-47.8	174.2	-65.4	-177.1	-177.6	177.8	0	110.7	I84 Q85 R90 E91 D92	I84-K88 HydrophobicContact CG2-CB 3.96Å; Q85-K88 PolarHBondContact O-N 2.81Å; K88-R90 PolarHBondContact O-N 2.98Å; K88-R90 VanDerWaalsContact O-N 3.13Å; K88-E91 WeakPolarHBondContact O-CB 3.45Å; K88-E91 PolarHBondContact O-N 2.99Å; K88-E91 VanDerWaalsContact O-N 3.14Å; K88-D92 WeakPolarHBondContact O-CB 3.46Å; K88-D92 PolarHBondContact O-N 3.41Å; K88-D92 VanDerWaalsContact O-OD2 3.05Å
89	K	56.6	Low	64	Low	82 Å²	82	96.4 Å²	96.4	36%	0.357	47%	0.473	S	S	.	.	H	α-helix	trans	-58.3	-28.5	171.6	-60.2	-157.5	-159.9	78.3	0	112.6	I84 Q85 D86 D92 T93	I84-K89 HydrophobicContact CB-CG 4.15Å; I84-K89 HydrophobicContact CG2-CG 3.83Å; I84-K89 VanDerWaalsContact O-CE 3.31Å; I84-K89 WeakPolarHBondContact O-CE 3.26Å; I84-K89 PolarHBondContact O-NZ 3.49Å; Q85-K89 PolarHBondContact O-N 2.74Å; D86-K89 IonicContact OD1-NZ 3.83Å; D86-K89 PolarHBondContact OD1-NZ 3.39Å; K89-D92 CarbonylContact O-C 3.57Å; K89-D92 PolarHBondContact O-N 3.12Å; K89-T93 WeakPolarHBondContact O-CB 3.38Å; K89-T93 VanDerWaalsContact O-CG2 3.25Å; K89-T93 WeakPolarHBondContact O-CG2 3.41Å; K89-T93 PolarHBondContact O-N 2.72Å; K89-T93 PolarHBondContact O-OG1 3.04Å
90	R	50	Low	62.2	Low	159 Å²	159	97.7 Å²	97.7	60%	0.6	49%	0.485	S	S	*	.	H	α-helix	trans	-81.9	-33.5	178.5	-174.9	-178.1	-54.5	176	3.4	111.6	D86 E87 K88 D92 T93 S94	D86-R90 WeakPolarHBondContact O-CB 3.45Å; D86-R90 PolarHBondContact O-N 2.82Å; D86-R90 VanDerWaalsContact O-N 3.09Å; E87-R90 CarbonylContact O-C 3.27Å; E87-R90 WeakPolarHBondContact O-CA 3.41Å; E87-R90 PolarHBondContact O-N 2.78Å; K88-R90 PolarHBondContact O-N 2.98Å; K88-R90 VanDerWaalsContact O-N 3.13Å; R90-D92 PolarHBondContact O-N 3.41Å; R90-T93 PolarHBondContact O-N 2.81Å; R90-S94 WeakPolarHBondContact O-CA 3.15Å; R90-S94 WeakPolarHBondContact O-CB 3.45Å; R90-S94 PolarHBondContact O-N 3.08Å; R90-S94 PolarHBondContact O-OG 3.31Å
91	E	54.8	Low	60.5	Low	119 Å²	119	93.3 Å²	93.3	56%	0.556	47%	0.472	S	S	*	.	H	α-helix	trans	-57.5	-44.4	161.5	-64.5	-177.7	142.9	0	0	109.5	E87 K88 T93 K96 M97	E87-E91 PolarHBondContact O-N 3.4Å; K88-E91 WeakPolarHBondContact O-CB 3.45Å; K88-E91 PolarHBondContact O-N 2.99Å; K88-E91 VanDerWaalsContact O-N 3.14Å; E91-T93 PolarHBondContact O-N 2.92Å; E91-K96 CarbonylContact O-C 3.56Å; E91-K96 WeakPolarHBondContact O-CA 3.48Å; E91-K96 PolarHBondContact O-N 3.23Å; E91-M97 WeakPolarHBondContact O-CA 3.42Å; E91-M97 PolarHBondContact O-N 2.67Å
92	D	50	Low	59.3	Low	54 Å²	54	95.2 Å²	95.2	29%	0.289	49%	0.492	S	S	.	.	H	α-helix	trans	-71.5	-20.8	179.6	-58.3	-32.9	0	0	0	115.3	K88 K89 R90 M97 S100	K88-D92 WeakPolarHBondContact O-CB 3.46Å; K88-D92 PolarHBondContact O-N 3.41Å; K88-D92 VanDerWaalsContact O-OD2 3.05Å; K89-D92 CarbonylContact O-C 3.57Å; K89-D92 PolarHBondContact O-N 3.12Å; R90-D92 PolarHBondContact O-N 3.41Å; D92-M97 HydrophobicContact CB-CE 4.32Å; D92-M97 HydrophobicContact CB-CG 4.02Å; D92-M97 HydrophobicContact CB-SD 3.68Å; D92-M97 WeakPolarHBondContact O-CB 3.42Å; D92-S100 PolarHBondContact O-OG 3.25Å
93	T	45.7	Very low	58.3	Low	116 Å²	116	98.2 Å²	98.2	71%	0.712	51%	0.51	S	S	*	.	H	α-helix	trans	-122.1	-16.9	-175.2	57.9	0	0	0	0	114.9	K89 R90 E91 G95	K89-T93 WeakPolarHBondContact O-CB 3.38Å; K89-T93 VanDerWaalsContact O-CG2 3.25Å; K89-T93 WeakPolarHBondContact O-CG2 3.41Å; K89-T93 PolarHBondContact O-N 2.72Å; K89-T93 PolarHBondContact O-OG1 3.04Å; R90-T93 PolarHBondContact O-N 2.81Å; E91-T93 PolarHBondContact O-N 2.92Å; T93-G95 PolarHBondContact O-N 3.27Å
94	S	46.6	Very low	57.7	Low	76 Å²	76	98.8 Å²	98.8	53%	0.531	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	25.9	173.1	89.8	0	0	0	0	112.7	R90 K96	R90-S94 WeakPolarHBondContact O-CA 3.15Å; R90-S94 WeakPolarHBondContact O-CB 3.45Å; R90-S94 PolarHBondContact O-N 3.08Å; R90-S94 PolarHBondContact O-OG 3.31Å; S94-K96 VanDerWaalsContact C-N 3.29Å; S94-K96 PolarHBondContact O-N 3.09Å
95	G	43.5	Very low	57.5	Low	53 Å²	53	96.6 Å²	96.6	55%	0.546	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	7.8	175.5	0	0	0	0	0	116	T93 M97	T93-G95 PolarHBondContact O-N 3.27Å; G95-M97 VanDerWaalsContact C-N 3.3Å
96	K	45.9	Very low	57.9	Low	144 Å²	144	94.6 Å²	94.6	63%	0.626	50%	0.503	S	S	*	.			trans	-93.7	15.1	170	-78	-169.8	172.7	-176.5	0	112.9	E91 S94 K98	E91-K96 CarbonylContact O-C 3.56Å; E91-K96 WeakPolarHBondContact O-CA 3.48Å; E91-K96 PolarHBondContact O-N 3.23Å; S94-K96 VanDerWaalsContact C-N 3.29Å; S94-K96 PolarHBondContact O-N 3.09Å; K96-K98 PolarHBondContact O-N 2.74Å; K96-K98 VanDerWaalsContact O-N 3.12Å
97	M	43.8	Very low	58.6	Low	51 Å²	51	94.9 Å²	94.9	25%	0.251	50%	0.499	S	S	.	.			trans	-72.6	110.5	-176.1	-164.7	168.2	174.6	0	0	110.7	E91 D92 G95 G99 S100 D166	E91-M97 WeakPolarHBondContact O-CA 3.42Å; E91-M97 PolarHBondContact O-N 2.67Å; D92-M97 HydrophobicContact CB-CE 4.32Å; D92-M97 HydrophobicContact CB-CG 4.02Å; D92-M97 HydrophobicContact CB-SD 3.68Å; D92-M97 WeakPolarHBondContact O-CB 3.42Å; G95-M97 VanDerWaalsContact C-N 3.3Å; M97-G99 PolarHBondContact O-N 2.53Å; M97-S100 WeakPolarHBondContact CB-OG 3.27Å; M97-S100 PolarHBondContact O-N 3.49Å; M97-S100 WeakPolarHBondContact SD-CB 3.37Å; M97-S100 PolarHBondContact SD-OG 2.8Å; M97-D166 VanDerWaalsContact O-O 3.13Å
98	K	47.1	Very low	59.6	Low	148 Å²	148	94.2 Å²	94.2	64%	0.643	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	88.7	149.6	-62.2	165.8	-172.4	161.8	0	106.6	K96 D166	K96-K98 PolarHBondContact O-N 2.74Å; K96-K98 VanDerWaalsContact O-N 3.12Å; K98-D166 WeakPolarHBondContact CA-O 3.48Å
99	G	45.9	Very low	60.7	Low	37 Å²	37	97.7 Å²	97.7	38%	0.381	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	141	-18.3	-179.1	0	0	0	0	0	118.4	M97 D168	M97-G99 PolarHBondContact O-N 2.53Å; G99-D168 WeakPolarHBondContact CA-OD2 3.18Å
100	S	50.3	Low	62	Low	63 Å²	63	96.6 Å²	96.6	44%	0.441	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140	22.2	-173.1	77.5	0	0	0	0	118.2	D92 M97 A102	D92-S100 PolarHBondContact O-OG 3.25Å; M97-S100 WeakPolarHBondContact CB-OG 3.27Å; M97-S100 PolarHBondContact O-N 3.49Å; M97-S100 WeakPolarHBondContact SD-CB 3.37Å; M97-S100 PolarHBondContact SD-OG 2.8Å; S100-A102 PolarHBondContact O-N 2.7Å
101	N	53.1	Low	63.1	Low	43 Å²	43	94.2 Å²	94.2	23%	0.23	51%	0.514	C	S	.	.	S	Bend	trans	-56.5	112.4	146.4	-75.6	-56.4	0	0	0	106.5	L167	N101-L167 HydrophobicContact CB-CD2 3.78Å; N101-L167 HydrophobicContact CB-CG 4.42Å
102	A	62.7	Low	63.9	Low	63 Å²	63	90.6 Å²	90.6	52%	0.521	50%	0.501	S	S	.	.			trans	-55.2	148.3	-169.5	0	0	0	0	0	111.1	S100 N104 V105	S100-A102 PolarHBondContact O-N 2.7Å; A102-N104 PolarHBondContact O-N 2.74Å; A102-V105 HydrophobicContact CB-CG2 4.25Å; A102-V105 WeakPolarHBondContact O-CB 3.32Å; A102-V105 WeakPolarHBondContact O-CG2 3.36Å; A102-V105 PolarHBondContact O-N 3.06Å
103	L	71.1	Confident	64.6	Low	158 Å²	158	97.4 Å²	97.4	83%	0.827	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-29.6	-169.9	-160.7	85.4	0	0	0	114.9
104	N	76	Confident	65.6	Low	148 Å²	148	96.5 Å²	96.5	79%	0.791	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-1.7	-177.3	-53.9	-18.2	0	0	0	114	A102	A102-N104 PolarHBondContact O-N 2.74Å
105	V	82.2	Confident	66.4	Low	64 Å²	64	102.9 Å²	102.9	39%	0.388	54%	0.539	S	S	.	.			trans	-96.2	102.5	-174.4	-177.4	0	0	0	0	110.5	A102 L165	A102-V105 HydrophobicContact CB-CG2 4.25Å; A102-V105 WeakPolarHBondContact O-CB 3.32Å; A102-V105 WeakPolarHBondContact O-CG2 3.36Å; A102-V105 PolarHBondContact O-N 3.06Å; V105-L165 HydrophobicContact CG1-CD2 3.82Å
106	W	87.7	Confident	67.8	Low	59 Å²	59	108.3 Å²	108.3	22%	0.223	55%	0.55	C	S	.	*			trans	-130.1	167.9	176.1	-171.5	-106.8	0	0	0	112.3	K108 R109 L167 N177	W106-K108 PolarHBondContact O-N 2.88Å; W106-R109 VanDerWaalsContact NE1-NH2 3.12Å; W106-L167 HydrophobicContact CE3-CD1 3.89Å; W106-L167 HydrophobicContact CZ3-CD1 3.6Å; W106-N177 HydrophobicContact CD2-CB 3.73Å; W106-N177 HydrophobicContact CE3-CB 3.59Å; W106-N177 VanDerWaalsContact CE3-CG 3.42Å; W106-N177 HydrophobicContact CG-CB 4.47Å; W106-N177 HydrophobicContact CH2-CB 3.82Å; W106-N177 HydrophobicContact CZ2-CB 3.97Å; W106-N177 HydrophobicContact CZ3-CB 3.63Å; W106-N177 VanDerWaalsContact CZ3-OD1 3.27Å; W106-N177 WeakPolarHBondContact CZ3-OD1 3.5Å
107	Y	88.5	Confident	69.1	Low	89 Å²	89	110.7 Å²	110.7	35%	0.349	56%	0.56	S	S	.	*			trans	-53.6	134	173	-65.4	-74.2	0	0	0	111.8	R109 Q162 V163 L165	Y107-R109 PolarHBondContact O-N 3.08Å; Y107-R109 VanDerWaalsContact O-N 3.14Å; Y107-Q162 HydrophobicContact CD1-CB 4.09Å; Y107-Q162 HydrophobicContact CD1-CG 4.46Å; Y107-V163 VanDerWaalsContact CE1-O 3.23Å; Y107-V163 WeakPolarHBondContact CE1-O 3.42Å; Y107-L165 HydrophobicContact CD1-CD1 4.3Å; Y107-L165 HydrophobicContact CD2-CD1 4.08Å; Y107-L165 HydrophobicContact CE1-CB 4.5Å; Y107-L165 HydrophobicContact CE1-CD1 4.26Å; Y107-L165 HydrophobicContact CE1-CG 4.22Å; Y107-L165 HydrophobicContact CE2-CB 4.41Å; Y107-L165 HydrophobicContact CE2-CD1 4.03Å; Y107-L165 HydrophobicContact CG-CD1 4.21Å
108	K	87	Confident	70.9	Confident	135 Å²	135	109.6 Å²	109.6	59%	0.587	56%	0.556	S	S	*	*			trans	-73.8	106.1	-178.5	-69.4	-178.3	179.1	177.8	0	109.4	W106 C160 Q162	W106-K108 PolarHBondContact O-N 2.88Å; K108-C160 HydrophobicContact CB-CB 3.81Å; K108-C160 HydrophobicContact CD-CB 4.45Å; K108-Q162 PolarHBondContact O-NE2 2.63Å
109	R	86.7	Confident	72.6	Confident	190 Å²	190	108.1 Å²	108.1	72%	0.717	56%	0.56	S	S	*	*			trans	-87.1	146.2	178.3	-59	-173	-174.1	-83.7	7.1	111	W106 Y107	W106-R109 VanDerWaalsContact NE1-NH2 3.12Å; Y107-R109 PolarHBondContact O-N 3.08Å; Y107-R109 VanDerWaalsContact O-N 3.14Å
110	G	83.4	Confident	74.5	Confident	59 Å²	59	112.7 Å²	112.7	61%	0.608	57%	0.57	S	S	*	*	S	Bend	trans	84.6	172	-178.6	0	0	0	0	0	114
111	L	73	Confident	76.4	Confident	109 Å²	109	112.1 Å²	112.1	57%	0.571	56%	0.558	S	S	*	*			trans	-72.1	141.4	173.6	-69.6	175.5	0	0	0	110.3	G157 E159	L111-G157 WeakPolarHBondContact CD2-O 3.3Å; L111-E159 HydrophobicContact CD2-CG 4.17Å
112	P	71.6	Confident	78.2	Confident	44 Å²	44	113.8 Å²	113.8	29%	0.286	56%	0.561	S	S	.	*			trans	-61.8	142.4	171.6	26.6	-32	0	0	0	110.3	I114 D158	P112-I114 HydrophobicContact CB-CD1 4.43Å; P112-I114 HydrophobicContact CB-CG1 3.99Å; P112-I114 HydrophobicContact CG-CD1 3.82Å; P112-I114 HydrophobicContact CG-CG1 3.88Å; P112-I114 PolarHBondContact O-N 2.89Å; P112-D158 WeakPolarHBondContact CD-O 3.3Å; P112-D158 WeakPolarHBondContact CG-O 3.29Å
113	Q	65.6	Low	79.5	Confident	196 Å²	196	118.1 Å²	118.1	92%	0.916	58%	0.576	S	S	*	*			trans	-75.7	59.9	175.7	-65	-173.5	1.5	0	0	111.6	K115	Q113-K115 PolarHBondContact O-N 3.24Å
114	I	66.4	Low	80.4	Confident	97 Å²	97	114 Å²	114	50%	0.497	57%	0.571	S	S	.	*			trans	-68.6	117.8	173.8	-55	176.7	0	0	0	107.6	P112 Q116	P112-I114 HydrophobicContact CB-CD1 4.43Å; P112-I114 HydrophobicContact CB-CG1 3.99Å; P112-I114 HydrophobicContact CG-CD1 3.82Å; P112-I114 HydrophobicContact CG-CG1 3.88Å; P112-I114 PolarHBondContact O-N 2.89Å; I114-Q116 WeakPolarHBondContact CG2-O 3.39Å; I114-Q116 PolarHBondContact O-N 3.24Å; I114-Q116 VanDerWaalsContact O-N 3.07Å
115	K	63.4	Low	81.2	Confident	210 Å²	210	107.3 Å²	107.3	91%	0.913	54%	0.537	S	S	*	.	S	Bend	trans	-61.5	-18.6	-173.9	-64.5	-177.1	179.3	180	0	114.2	Q113	Q113-K115 PolarHBondContact O-N 3.24Å
116	Q	71.4	Confident	81.7	Confident	168 Å²	168	104.3 Å²	104.3	79%	0.785	52%	0.518	S	S	*	.	S	Bend	trans	-121.8	118	177.9	-69.2	175.7	-19.6	0	0	109.3	I114	I114-Q116 WeakPolarHBondContact CG2-O 3.39Å; I114-Q116 PolarHBondContact O-N 3.24Å; I114-Q116 VanDerWaalsContact O-N 3.07Å
117	K	73.7	Confident	81.9	Confident	193 Å²	193	104 Å²	104	84%	0.839	52%	0.52	S	S	*	.			trans	-76.7	143.4	172.5	-67.2	-175.6	178.7	-177.4	0	109.9
118	V	81.3	Confident	82.1	Confident	28 Å²	28	100.1 Å²	100.1	17%	0.17	51%	0.505	C	S	.	.			trans	-76.4	128.2	176.2	-161.4	0	0	0	0	108.9	F120 R122 I155	V118-F120 HydrophobicContact CG1-CD1 4.43Å; V118-F120 HydrophobicContact CG1-CE1 4.38Å; V118-F120 WeakPolarHBondContact CG1-O 3.41Å; V118-R122 HydrophobicContact CG1-CG 4.49Å; V118-R122 VanDerWaalsContact CG2-NH2 3.26Å; V118-I155 HydrophobicContact CB-CG2 4.22Å
119	T	83.1	Confident	82.2	Confident	118 Å²	118	93.8 Å²	93.8	72%	0.724	48%	0.477	S	S	*	.			trans	-110.4	-5.3	-177.5	52.6	0	0	0	0	114
120	F	86.3	Confident	82.4	Confident	133 Å²	133	84.8 Å²	84.8	58%	0.583	44%	0.444	S	S	*	.	S	Bend	trans	-125.9	146.4	179	63	-86.6	0	0	0	110.7	V118 R122 I155	V118-F120 HydrophobicContact CG1-CD1 4.43Å; V118-F120 HydrophobicContact CG1-CE1 4.38Å; V118-F120 WeakPolarHBondContact CG1-O 3.41Å; F120-R122 HydrophobicContact CD2-CG 4.47Å; F120-R122 HydrophobicContact CE2-CG 4.08Å; F120-I155 WeakPolarHBondContact O-CD1 3.36Å
121	Y	90.6	Very high	82.7	Confident	51 Å²	51	82 Å²	82	20%	0.2	42%	0.415	C	S	.	.			trans	-68.4	138.8	176.7	178.3	-92	0	0	0	110.2	A125 A148 K149	Y121-A125 HydrophobicContact CD2-CB 4.32Å; Y121-A125 HydrophobicContact CE2-CB 3.86Å; Y121-A125 PolarHBondContact OH-O 3.24Å; Y121-A125 VanDerWaalsContact OH-O 3.1Å; Y121-A148 HydrophobicContact CD2-CB 4.01Å; Y121-K149 HydrophobicContact CD2-CB 4.29Å; Y121-K149 HydrophobicContact CE1-CB 4.29Å; Y121-K149 HydrophobicContact CE1-CG 3.94Å; Y121-K149 HydrophobicContact CE2-CB 3.79Å; Y121-K149 HydrophobicContact CE2-CG 4.31Å
122	R	90.1	Very high	83.5	Confident	78 Å²	78	80.9 Å²	80.9	29%	0.294	41%	0.408	S	S	.	.			trans	-107.1	146	178.4	-60.1	-175.4	-172.7	132.9	-17.1	111.2	V118 F120 G124 A125 M132 D158	V118-R122 HydrophobicContact CG1-CG 4.49Å; V118-R122 VanDerWaalsContact CG2-NH2 3.26Å; F120-R122 HydrophobicContact CD2-CG 4.47Å; F120-R122 HydrophobicContact CE2-CG 4.08Å; R122-G124 PolarHBondContact O-N 3.47Å; R122-A125 HydrophobicContact CB-CB 4.38Å; R122-A125 WeakPolarHBondContact O-CB 3.46Å; R122-A125 PolarHBondContact O-N 2.89Å; R122-A125 VanDerWaalsContact O-N 3.1Å; R122-M132 HydrophobicContact CB-SD 3.75Å; R122-D158 IonicContact CZ-OD2 3.52Å; R122-D158 VanDerWaalsContact NH1-CG 3.31Å; R122-D158 IonicContact NH1-OD1 4Å; R122-D158 PolarHBondContact NH1-OD1 3.35Å; R122-D158 VanDerWaalsContact NH1-OD1 3.15Å; R122-D158 IonicContact NH1-OD2 2.74Å; R122-D158 PolarHBondContact NH1-OD2 2.97Å; R122-D158 IonicContact NH2-OD2 3.26Å
123	D	90.5	Very high	84.3	Confident	153 Å²	153	81.4 Å²	81.4	82%	0.818	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	136	172.3	-69.2	-46.4	0	0	0	111.6	A125 M132	D123-A125 VanDerWaalsContact C-N 3.31Å; D123-M132 WeakPolarHBondContact O-CE 3.46Å
124	G	90.1	Very high	85.5	Confident	71 Å²	71	73.4 Å²	73.4	73%	0.732	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	-10	-170.9	0	0	0	0	0	115.3	R122	R122-G124 PolarHBondContact O-N 3.47Å
125	A	92.2	Very high	86.8	Confident	8 Å²	8	76.3 Å²	76.3	7%	0.066	38%	0.384	C	S	.	.	S	Bend	trans	-68.1	163.1	177.9	0	0	0	0	0	113.5	Y121 R122 D123 E127 G130 S131 M132	Y121-A125 HydrophobicContact CD2-CB 4.32Å; Y121-A125 HydrophobicContact CE2-CB 3.86Å; Y121-A125 PolarHBondContact OH-O 3.24Å; Y121-A125 VanDerWaalsContact OH-O 3.1Å; R122-A125 HydrophobicContact CB-CB 4.38Å; R122-A125 WeakPolarHBondContact O-CB 3.46Å; R122-A125 PolarHBondContact O-N 2.89Å; R122-A125 VanDerWaalsContact O-N 3.1Å; D123-A125 VanDerWaalsContact C-N 3.31Å; A125-E127 PolarHBondContact O-N 3.17Å; A125-G130 WeakPolarHBondContact CB-O 3.33Å; A125-S131 CarbonylContact C-O 3.58Å; A125-S131 WeakPolarHBondContact CA-O 3.49Å; A125-S131 WeakPolarHBondContact CB-O 3.13Å; A125-M132 HydrophobicContact CB-SD 3.7Å
126	C	92.2	Very high	88.2	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.007	37%	0.367	C	S	.	.			trans	-59.8	116.9	171.9	178.8	0	0	0	0	110.9	N128 C129 G130 S131 H134	C126-N128 PolarHBondContact O-N 3.31Å; C126-C129 VanDerWaalsContact CB-SG 3.52Å; C126-C129 PolarHBondContact O-N 2.96Å; C126-C129 PolarHBondContact SG-SG 2.91Å; C126-G130 WeakPolarHBondContact O-CA 3.45Å; C126-G130 PolarHBondContact O-N 3.15Å; C126-S131 PolarHBondContact N-O 3.18Å; C126-H134 WeakPolarHBondContact CB-O 3.45Å
127	E	92.3	Very high	89.2	Confident	53 Å²	53	74.9 Å²	74.9	25%	0.248	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-23	-177.3	-41.5	-172.5	115.5	0	0	113.7	A125 R136 G147 A148 K149	A125-E127 PolarHBondContact O-N 3.17Å; E127-R136 WeakPolarHBondContact OE2-CD 3.32Å; E127-R136 IonicContact OE2-CZ 3.58Å; E127-R136 IonicContact OE2-NE 2.71Å; E127-R136 IonicContact OE2-NH1 3.51Å; E127-R136 PolarHBondContact OE2-NH1 2.87Å; E127-G147 CarbonylContact O-C 3.55Å; E127-G147 VanDerWaalsContact O-C 3.27Å; E127-G147 VanDerWaalsContact O-CA 3.29Å; E127-G147 WeakPolarHBondContact O-CA 3.44Å; E127-A148 PolarHBondContact O-N 3.16Å; E127-K149 HydrophobicContact CB-CB 4.1Å; E127-K149 HydrophobicContact CB-CD 4.08Å; E127-K149 HydrophobicContact CG-CD 3.96Å; E127-K149 PolarHBondContact O-N 3.45Å; E127-K149 VanDerWaalsContact OE1-CD 3.29Å; E127-K149 WeakPolarHBondContact OE1-CD 3.42Å; E127-K149 IonicContact OE1-NZ 2.7Å; E127-K149 PolarHBondContact OE1-NZ 3.03Å
128	N	93.1	Very high	90.1	Very high	7 Å²	7	70.5 Å²	70.5	4%	0.037	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-52.6	179.9	-170.6	48.5	0	0	0	112.6	C126 R136 C139 E141 R142 R144 A148	C126-N128 PolarHBondContact O-N 3.31Å; N128-R136 HydrophobicContact CB-CG 4.49Å; N128-C139 PolarHBondContact ND2-SG 2.8Å; N128-C139 VanDerWaalsContact ND2-SG 3.35Å; N128-E141 PolarHBondContact ND2-O 2.88Å; N128-R142 PolarHBondContact ND2-O 3.48Å; N128-R144 PolarHBondContact O-NE 3.02Å; N128-R144 PolarHBondContact O-NH2 2.9Å; N128-R144 WeakPolarHBondContact OD1-CB 3.33Å; N128-R144 PolarHBondContact OD1-N 3.21Å; N128-A148 PolarHBondContact O-N 3.15Å
129	C	90.2	Very high	90.6	Very high	2 Å²	2	70.3 Å²	70.3	1%	0.014	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-13.9	-168.7	66.3	0	0	0	0	115	C126 S131 H134 E141 I155 A156	C126-C129 VanDerWaalsContact CB-SG 3.52Å; C126-C129 PolarHBondContact O-N 2.96Å; C126-C129 PolarHBondContact SG-SG 2.91Å; C129-S131 PolarHBondContact SG-OG 3.41Å; C129-S131 VanDerWaalsContact SG-OG 3.33Å; C129-H134 PolarHBondContact SG-NE2 2.86Å; C129-E141 HydrophobicContact CB-CB 3.85Å; C129-E141 HydrophobicContact CB-CG 3.82Å; C129-I155 CarbonylContact O-C 3.6Å; C129-I155 WeakPolarHBondContact O-CA 3.48Å; C129-A156 HydrophobicContact CB-CB 3.93Å; C129-A156 PolarHBondContact O-N 2.94Å
130	G	90.5	Very high	90.9	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.01	36%	0.358	C	S	.	.			trans	82.3	5	176.2	0	0	0	0	0	116.9	A125 C126	A125-G130 WeakPolarHBondContact CB-O 3.33Å; C126-G130 WeakPolarHBondContact O-CA 3.45Å; C126-G130 PolarHBondContact O-N 3.15Å
131	S	89.8	Confident	91.1	Very high	1 Å²	1	70.5 Å²	70.5	1%	0.007	36%	0.355	C	S	.	.			trans	-75.4	151.2	170.2	63	0	0	0	0	112	A125 C126 C129 H134	A125-S131 CarbonylContact C-O 3.58Å; A125-S131 WeakPolarHBondContact CA-O 3.49Å; A125-S131 WeakPolarHBondContact CB-O 3.13Å; C126-S131 PolarHBondContact N-O 3.18Å; C129-S131 PolarHBondContact SG-OG 3.41Å; C129-S131 VanDerWaalsContact SG-OG 3.33Å; S131-H134 PolarHBondContact OG-CE1 2.73Å; S131-H134 PolarHBondContact OG-NE2 2.68Å
132	M	89.7	Confident	91.2	Very high	86 Å²	86	78.2 Å²	78.2	42%	0.424	38%	0.384	S	S	.	.	S	Bend	trans	-86.7	-10.1	176.5	-66.5	-63.9	-59.3	0	0	114.3	R122 D123 A125 D158	R122-M132 HydrophobicContact CB-SD 3.75Å; D123-M132 WeakPolarHBondContact O-CE 3.46Å; A125-M132 HydrophobicContact CB-SD 3.7Å; M132-D158 WeakPolarHBondContact CB-OD1 3.26Å; M132-D158 PolarHBondContact N-OD1 3.35Å
133	S	88.9	Confident	91.4	Very high	55 Å²	55	80 Å²	80	39%	0.385	41%	0.406	S	S	.	.	S	Bend	trans	-82.3	-25.6	-167.4	48.2	0	0	0	0	114.9	E159	S133-E159 VanDerWaalsContact CB-OE2 3.23Å; S133-E159 WeakPolarHBondContact CB-OE2 3.49Å; S133-E159 WeakPolarHBondContact OG-CB 3.13Å; S133-E159 VanDerWaalsContact OG-CD 3.29Å; S133-E159 WeakPolarHBondContact OG-CG 3.36Å; S133-E159 PolarHBondContact OG-N 3.43Å; S133-E159 PolarHBondContact OG-OE2 3.46Å
134	H	90	Very high	91.3	Very high	27 Å²	27	75.9 Å²	75.9	13%	0.125	38%	0.379	C	S	.	.	S	Bend	trans	-140.1	161.4	-176.2	57.7	-119.1	0	0	0	112.8	C126 C129 S131 D138 E159	C126-H134 WeakPolarHBondContact CB-O 3.45Å; C129-H134 PolarHBondContact SG-NE2 2.86Å; S131-H134 PolarHBondContact OG-CE1 2.73Å; S131-H134 PolarHBondContact OG-NE2 2.68Å; H134-D138 HydrophobicContact CB-CB 4.45Å; H134-E159 IonicContact CE1-OE1 2.7Å; H134-E159 PolarHBondContact CE1-OE1 2.89Å; H134-E159 IonicContact CE1-OE2 2.82Å; H134-E159 IonicContact CG-OE2 3.57Å; H134-E159 VanDerWaalsContact ND1-CD 3.26Å; H134-E159 IonicContact ND1-OE1 3.66Å; H134-E159 PolarHBondContact ND1-OE1 3.43Å; H134-E159 VanDerWaalsContact ND1-OE1 3.13Å; H134-E159 IonicContact ND1-OE2 2.63Å; H134-E159 PolarHBondContact ND1-OE2 3.01Å
135	K	92.9	Very high	91.4	Very high	158 Å²	158	82.9 Å²	82.9	69%	0.687	39%	0.389	S	S	*	.			trans	-87.9	164	176.4	-61.6	171.9	-177.8	170.8	0	110.3	K137 D138 C139	K135-K137 PolarHBondContact O-N 3.17Å; K135-D138 WeakPolarHBondContact CB-OD2 3.31Å; K135-D138 CarbonylContact O-C 3.5Å; K135-D138 PolarHBondContact O-N 2.84Å; K135-C139 PolarHBondContact O-N 3.49Å
136	R	92.5	Very high	91.3	Very high	148 Å²	148	86.1 Å²	86.1	56%	0.558	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-29.1	177.8	-178.2	178.6	179.4	176.3	-3.2	114.9	E127 N128	E127-R136 WeakPolarHBondContact OE2-CD 3.32Å; E127-R136 IonicContact OE2-CZ 3.58Å; E127-R136 IonicContact OE2-NE 2.71Å; E127-R136 IonicContact OE2-NH1 3.51Å; E127-R136 PolarHBondContact OE2-NH1 2.87Å; N128-R136 HydrophobicContact CB-CG 4.49Å
137	K	92.5	Very high	91.3	Very high	201 Å²	201	86.6 Å²	86.6	87%	0.874	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-31	178.1	-67.6	-171.2	176.7	-173.8	0	113.2	K135	K135-K137 PolarHBondContact O-N 3.17Å
138	D	93.3	Very high	91.3	Very high	100 Å²	100	84 Å²	84	54%	0.535	40%	0.401	S	S	.	.	S	Bend	trans	-105	18.1	-171	-38.5	-62.8	0	0	0	110.6	H134 K135	H134-D138 HydrophobicContact CB-CB 4.45Å; K135-D138 WeakPolarHBondContact CB-OD2 3.31Å; K135-D138 CarbonylContact O-C 3.5Å; K135-D138 PolarHBondContact O-N 2.84Å
139	C	92.4	Very high	91.2	Very high	24 Å²	24	87.9 Å²	87.9	16%	0.162	42%	0.417	C	S	.	.			trans	-80.4	122.1	-171.5	176.9	0	0	0	0	111.5	N128 K135 E141	N128-C139 PolarHBondContact ND2-SG 2.8Å; N128-C139 VanDerWaalsContact ND2-SG 3.35Å; K135-C139 PolarHBondContact O-N 3.49Å; C139-E141 VanDerWaalsContact C-N 3.31Å; C139-E141 PolarHBondContact O-N 2.87Å
140	L	89.9	Confident	91.2	Very high	145 Å²	145	95.7 Å²	95.7	76%	0.759	45%	0.447	S	S	*	.			trans	-72	-24.6	178.2	-57	-178	0	0	0	113	E159	L140-E159 WeakPolarHBondContact CD1-OE1 3.18Å
141	E	90.5	Very high	91.1	Very high	111 Å²	111	98.2 Å²	98.2	52%	0.519	46%	0.463	S	S	.	.	S	Bend	trans	-75.2	144.5	176.5	-75.3	-61.9	163.3	0	0	112.8	N128 C129 C139	N128-E141 PolarHBondContact ND2-O 2.88Å; C129-E141 HydrophobicContact CB-CB 3.85Å; C129-E141 HydrophobicContact CB-CG 3.82Å; C139-E141 VanDerWaalsContact C-N 3.31Å; C139-E141 PolarHBondContact O-N 2.87Å
142	R	92.2	Very high	90.9	Very high	213 Å²	213	99.7 Å²	99.7	80%	0.804	48%	0.478	S	S	*	.			trans	-50.6	130.3	179.3	176.8	178.4	170.5	-174.8	-1.9	111	N128 R144	N128-R142 PolarHBondContact ND2-O 3.48Å; R142-R144 PolarHBondContact O-N 2.83Å; R142-R144 VanDerWaalsContact O-N 3.11Å
143	P	92.8	Very high	90.7	Very high	116 Å²	116	100.8 Å²	100.8	75%	0.753	49%	0.485	S	S	*	.			trans	-58.2	115.9	175.7	-27.9	36.2	0	0	0	112.4
144	R	90.2	Very high	90.6	Very high	65 Å²	65	104.4 Å²	104.4	25%	0.245	50%	0.5	C	S	.	.			trans	-86.6	145.5	178.5	-61.4	-162.9	-87.4	-172.8	-7.5	111	N128 R142 V146 L153 D154	N128-R144 PolarHBondContact O-NE 3.02Å; N128-R144 PolarHBondContact O-NH2 2.9Å; N128-R144 WeakPolarHBondContact OD1-CB 3.33Å; N128-R144 PolarHBondContact OD1-N 3.21Å; R142-R144 PolarHBondContact O-N 2.83Å; R142-R144 VanDerWaalsContact O-N 3.11Å; R144-V146 VanDerWaalsContact C-N 3.27Å; R144-V146 VanDerWaalsContact CB-O 3.29Å; R144-V146 WeakPolarHBondContact CB-O 3.46Å; R144-V146 PolarHBondContact O-N 2.99Å; R144-L153 PolarHBondContact NH1-O 3.47Å; R144-L153 PolarHBondContact NH2-O 3.16Å; R144-D154 IonicContact NH1-OD2 3.67Å; R144-D154 PolarHBondContact NH1-OD2 2.91Å; R144-D154 PolarHBondContact NH2-O 2.87Å
145	K	91.3	Very high	90.6	Very high	218 Å²	218	104.7 Å²	104.7	95%	0.948	50%	0.502	S	S	*	.	S	Bend	trans	-63.3	-36.4	172.8	-177.1	178.8	177.9	-177.3	0	111.5
146	V	91.2	Very high	90.3	Very high	77 Å²	77	98.3 Å²	98.3	47%	0.467	48%	0.479	S	S	.	.	S	Bend	trans	-127.2	116	170.1	-168.5	0	0	0	0	106.2	R144 Y150 T151	R144-V146 VanDerWaalsContact C-N 3.27Å; R144-V146 VanDerWaalsContact CB-O 3.29Å; R144-V146 WeakPolarHBondContact CB-O 3.46Å; R144-V146 PolarHBondContact O-N 2.99Å; V146-Y150 HydrophobicContact CG1-CD2 4.48Å; V146-T151 HydrophobicContact CB-CG2 4.07Å; V146-T151 HydrophobicContact CG1-CG2 3.69Å
147	G	91	Very high	90	Very high	10 Å²	10	92.7 Å²	92.7	10%	0.103	47%	0.467	C	S	.	.			trans	-87.6	172.2	-175.4	0	0	0	0	0	113.8	E127 K149 Y150 T151	E127-G147 CarbonylContact O-C 3.55Å; E127-G147 VanDerWaalsContact O-C 3.27Å; E127-G147 VanDerWaalsContact O-CA 3.29Å; E127-G147 WeakPolarHBondContact O-CA 3.44Å; G147-K149 PolarHBondContact O-N 3.42Å; G147-Y150 PolarHBondContact O-N 2.92Å; G147-T151 PolarHBondContact O-N 3.48Å; G147-T151 PolarHBondContact O-OG1 3.43Å
148	A	91.8	Very high	89.8	Confident	0 Å²	0	84.4 Å²	84.4	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-44.9	-37.6	179.4	0	0	0	0	0	113.8	Y121 E127 N128 Y150 T151 G152	Y121-A148 HydrophobicContact CD2-CB 4.01Å; E127-A148 PolarHBondContact O-N 3.16Å; N128-A148 PolarHBondContact O-N 3.15Å; A148-Y150 PolarHBondContact O-N 3.15Å; A148-Y150 VanDerWaalsContact O-N 3.14Å; A148-T151 PolarHBondContact O-N 3.27Å; A148-G152 WeakPolarHBondContact O-CA 3.43Å; A148-G152 PolarHBondContact O-N 3.27Å
149	K	91.3	Very high	89.3	Confident	87 Å²	87	82.6 Å²	82.6	38%	0.378	42%	0.421	S	S	.	.	H	α-helix	trans	-54.9	-29	178.9	-172	179.7	-171.9	-172.7	0	114.5	Y121 E127 G147	Y121-K149 HydrophobicContact CD2-CB 4.29Å; Y121-K149 HydrophobicContact CE1-CB 4.29Å; Y121-K149 HydrophobicContact CE1-CG 3.94Å; Y121-K149 HydrophobicContact CE2-CB 3.79Å; Y121-K149 HydrophobicContact CE2-CG 4.31Å; E127-K149 HydrophobicContact CB-CB 4.1Å; E127-K149 HydrophobicContact CB-CD 4.08Å; E127-K149 HydrophobicContact CG-CD 3.96Å; E127-K149 PolarHBondContact O-N 3.45Å; E127-K149 VanDerWaalsContact OE1-CD 3.29Å; E127-K149 WeakPolarHBondContact OE1-CD 3.42Å; E127-K149 IonicContact OE1-NZ 2.7Å; E127-K149 PolarHBondContact OE1-NZ 3.03Å; G147-K149 PolarHBondContact O-N 3.42Å
150	Y	90.7	Very high	88.7	Confident	166 Å²	166	82.7 Å²	82.7	65%	0.651	42%	0.422	S	S	*	.	H	α-helix	trans	-114.7	-21.1	-177	-55.9	-71.7	0	0	0	113.4	V146 G147 A148	V146-Y150 HydrophobicContact CG1-CD2 4.48Å; G147-Y150 PolarHBondContact O-N 2.92Å; A148-Y150 PolarHBondContact O-N 3.15Å; A148-Y150 VanDerWaalsContact O-N 3.14Å
151	T	88.7	Confident	88.4	Confident	55 Å²	55	84.8 Å²	84.8	34%	0.337	43%	0.427	S	S	.	.	H	α-helix	trans	-94.6	-33.5	177.5	58.6	0	0	0	0	113.6	V146 G147 A148 L153	V146-T151 HydrophobicContact CB-CG2 4.07Å; V146-T151 HydrophobicContact CG1-CG2 3.69Å; G147-T151 PolarHBondContact O-N 3.48Å; G147-T151 PolarHBondContact O-OG1 3.43Å; A148-T151 PolarHBondContact O-N 3.27Å; T151-L153 PolarHBondContact O-N 3.31Å; T151-L153 PolarHBondContact OG1-N 2.91Å; T151-L153 VanDerWaalsContact OG1-N 3.14Å
152	G	86.3	Confident	88.1	Confident	31 Å²	31	83.9 Å²	83.9	32%	0.32	42%	0.423	S	S	.	.			trans	65.5	1.9	-163.2	0	0	0	0	0	114.6	A148	A148-G152 WeakPolarHBondContact O-CA 3.43Å; A148-G152 PolarHBondContact O-N 3.27Å
153	L	85.3	Confident	87.7	Confident	110 Å²	110	78 Å²	78	58%	0.576	41%	0.411	S	S	*	.			trans	-96.7	150.8	-174.5	-60.2	179.1	0	0	0	111.9	R144 T151	R144-L153 PolarHBondContact NH1-O 3.47Å; R144-L153 PolarHBondContact NH2-O 3.16Å; T151-L153 PolarHBondContact O-N 3.31Å; T151-L153 PolarHBondContact OG1-N 2.91Å; T151-L153 VanDerWaalsContact OG1-N 3.14Å
154	D	85.8	Confident	87.2	Confident	130 Å²	130	78.1 Å²	78.1	70%	0.695	41%	0.409	S	S	*	.	S	Bend	trans	44.7	77.1	-178.5	-31.1	-58.9	0	0	0	112.2	R144	R144-D154 IonicContact NH1-OD2 3.67Å; R144-D154 PolarHBondContact NH1-OD2 2.91Å; R144-D154 PolarHBondContact NH2-O 2.87Å
155	I	89.3	Confident	86.7	Confident	33 Å²	33	75.3 Å²	75.3	17%	0.169	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-93	121.6	178.3	-63.9	-177.1	0	0	0	109.5	V118 F120 C129	V118-I155 HydrophobicContact CB-CG2 4.22Å; F120-I155 WeakPolarHBondContact O-CD1 3.36Å; C129-I155 CarbonylContact O-C 3.6Å; C129-I155 WeakPolarHBondContact O-CA 3.48Å
156	A	87.9	Confident	86.1	Confident	24 Å²	24	68.4 Å²	68.4	20%	0.198	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-69.9	145.1	175.6	0	0	0	0	0	110.8	C129	C129-A156 HydrophobicContact CB-CB 3.93Å; C129-A156 PolarHBondContact O-N 2.94Å
157	G	86.3	Confident	85.5	Confident	31 Å²	31	65.5 Å²	65.5	32%	0.32	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-66.5	150	170.6	0	0	0	0	0	111.4	L111	L111-G157 WeakPolarHBondContact CD2-O 3.3Å
158	D	87.3	Confident	84.9	Confident	27 Å²	27	68.4 Å²	68.4	14%	0.144	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-65.2	133.9	173.2	-54.7	-59.6	0	0	0	110.2	P112 R122 M132	P112-D158 WeakPolarHBondContact CD-O 3.3Å; P112-D158 WeakPolarHBondContact CG-O 3.29Å; R122-D158 IonicContact CZ-OD2 3.52Å; R122-D158 VanDerWaalsContact NH1-CG 3.31Å; R122-D158 IonicContact NH1-OD1 4Å; R122-D158 PolarHBondContact NH1-OD1 3.35Å; R122-D158 VanDerWaalsContact NH1-OD1 3.15Å; R122-D158 IonicContact NH1-OD2 2.74Å; R122-D158 PolarHBondContact NH1-OD2 2.97Å; R122-D158 IonicContact NH2-OD2 3.26Å; M132-D158 WeakPolarHBondContact CB-OD1 3.26Å; M132-D158 PolarHBondContact N-OD1 3.35Å
159	E	83.2	Confident	84.6	Confident	62 Å²	62	75.7 Å²	75.7	29%	0.29	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-73.2	155.2	179.6	-65.1	152.8	154	0	0	111.6	L111 S133 H134 L140 Q161	L111-E159 HydrophobicContact CD2-CG 4.17Å; S133-E159 VanDerWaalsContact CB-OE2 3.23Å; S133-E159 WeakPolarHBondContact CB-OE2 3.49Å; S133-E159 WeakPolarHBondContact OG-CB 3.13Å; S133-E159 VanDerWaalsContact OG-CD 3.29Å; S133-E159 WeakPolarHBondContact OG-CG 3.36Å; S133-E159 PolarHBondContact OG-N 3.43Å; S133-E159 PolarHBondContact OG-OE2 3.46Å; H134-E159 IonicContact CE1-OE1 2.7Å; H134-E159 PolarHBondContact CE1-OE1 2.89Å; H134-E159 IonicContact CE1-OE2 2.82Å; H134-E159 IonicContact CG-OE2 3.57Å; H134-E159 VanDerWaalsContact ND1-CD 3.26Å; H134-E159 IonicContact ND1-OE1 3.66Å; H134-E159 PolarHBondContact ND1-OE1 3.43Å; H134-E159 VanDerWaalsContact ND1-OE1 3.13Å; H134-E159 IonicContact ND1-OE2 2.63Å; H134-E159 PolarHBondContact ND1-OE2 3.01Å; L140-E159 WeakPolarHBondContact CD1-OE1 3.18Å; E159-Q161 PolarHBondContact O-N 3.27Å
160	C	80.6	Confident	84.3	Confident	26 Å²	26	79 Å²	79	18%	0.176	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-59.9	125.2	174.7	-69.3	0	0	0	0	110.6	K108 Q162	K108-C160 HydrophobicContact CB-CB 3.81Å; K108-C160 HydrophobicContact CD-CB 4.45Å; C160-Q162 PolarHBondContact O-N 2.8Å; C160-Q162 PolarHBondContact O-NE2 3.47Å
161	Q	82.3	Confident	84	Confident	188 Å²	188	72.1 Å²	72.1	88%	0.879	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-58	125	164.5	-70.1	-176.6	-5	0	0	109.1	E159	E159-Q161 PolarHBondContact O-N 3.27Å
162	Q	84.2	Confident	83.9	Confident	92 Å²	92	74.7 Å²	74.7	43%	0.43	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-88.3	135	-175.2	-61.4	-57.8	-30.2	0	0	110.7	Y107 K108 C160	Y107-Q162 HydrophobicContact CD1-CB 4.09Å; Y107-Q162 HydrophobicContact CD1-CG 4.46Å; K108-Q162 PolarHBondContact O-NE2 2.63Å; C160-Q162 PolarHBondContact O-N 2.8Å; C160-Q162 PolarHBondContact O-NE2 3.47Å
163	V	83.8	Confident	84	Confident	91 Å²	91	80.4 Å²	80.4	55%	0.552	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-74.5	139	172.9	-176.3	0	0	0	0	108.7	Y107 L165	Y107-V163 VanDerWaalsContact CE1-O 3.23Å; Y107-V163 WeakPolarHBondContact CE1-O 3.42Å; V163-L165 HydrophobicContact CB-CD2 4.15Å; V163-L165 HydrophobicContact CG1-CD2 3.91Å; V163-L165 PolarHBondContact O-N 2.99Å
164	T	82.6	Confident	84.2	Confident	117 Å²	117	78.5 Å²	78.5	72%	0.718	40%	0.401	S	S	*	.			trans	-72.7	106.7	171.5	-54.1	0	0	0	0	109.4
165	L	79.8	Confident	84.5	Confident	7 Å²	7	81.6 Å²	81.6	4%	0.037	40%	0.403	C	S	.	.			trans	-98.2	97.9	-176.7	-61.1	-179.4	0	0	0	111.5	V105 Y107 V163 L167	V105-L165 HydrophobicContact CG1-CD2 3.82Å; Y107-L165 HydrophobicContact CD1-CD1 4.3Å; Y107-L165 HydrophobicContact CD2-CD1 4.08Å; Y107-L165 HydrophobicContact CE1-CB 4.5Å; Y107-L165 HydrophobicContact CE1-CD1 4.26Å; Y107-L165 HydrophobicContact CE1-CG 4.22Å; Y107-L165 HydrophobicContact CE2-CB 4.41Å; Y107-L165 HydrophobicContact CE2-CD1 4.03Å; Y107-L165 HydrophobicContact CG-CD1 4.21Å; V163-L165 HydrophobicContact CB-CD2 4.15Å; V163-L165 HydrophobicContact CG1-CD2 3.91Å; V163-L165 PolarHBondContact O-N 2.99Å; L165-L167 HydrophobicContact CB-CD1 4.06Å; L165-L167 HydrophobicContact CB-CG 4.19Å; L165-L167 HydrophobicContact CD1-CD1 4.4Å; L165-L167 PolarHBondContact O-N 3.31Å
166	D	79.2	Confident	84.6	Confident	73 Å²	73	86.7 Å²	86.7	39%	0.39	42%	0.42	S	S	.	.			trans	-74.8	57.9	174.2	-83.5	-42.5	0	0	0	112.8	M97 K98	M97-D166 VanDerWaalsContact O-O 3.13Å; K98-D166 WeakPolarHBondContact CA-O 3.48Å
167	L	77.7	Confident	84.7	Confident	15 Å²	15	86.9 Å²	86.9	8%	0.079	42%	0.418	C	S	.	.			trans	-69.3	161.4	179.1	-76.7	163.7	0	0	0	113.5	N101 W106 L165 K172	N101-L167 HydrophobicContact CB-CD2 3.78Å; N101-L167 HydrophobicContact CB-CG 4.42Å; W106-L167 HydrophobicContact CE3-CD1 3.89Å; W106-L167 HydrophobicContact CZ3-CD1 3.6Å; L165-L167 HydrophobicContact CB-CD1 4.06Å; L165-L167 HydrophobicContact CB-CG 4.19Å; L165-L167 HydrophobicContact CD1-CD1 4.4Å; L165-L167 PolarHBondContact O-N 3.31Å; L167-K172 HydrophobicContact CB-CD 4.47Å; L167-K172 HydrophobicContact CB-CG 3.61Å; L167-K172 WeakPolarHBondContact O-CD 3.17Å; L167-K172 WeakPolarHBondContact O-CE 3.45Å; L167-K172 PolarHBondContact O-NZ 3.37Å
168	D	78.7	Confident	84.7	Confident	71 Å²	71	87.7 Å²	87.7	38%	0.38	43%	0.427	S	S	.	.			trans	-76.5	179.4	-176.7	-144.4	-18	0	0	0	114	G99 E170 K172	G99-D168 WeakPolarHBondContact CA-OD2 3.18Å; D168-E170 VanDerWaalsContact C-N 3.32Å; D168-E170 PolarHBondContact O-N 3.22Å; D168-K172 VanDerWaalsContact O-CB 3.26Å; D168-K172 WeakPolarHBondContact O-CB 3.47Å; D168-K172 VanDerWaalsContact O-CG 3.31Å; D168-K172 WeakPolarHBondContact O-CG 3.36Å; D168-K172 PolarHBondContact O-N 3.19Å
169	Y	84.6	Confident	84.8	Confident	153 Å²	153	90.2 Å²	90.2	60%	0.6	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-45.4	173.6	-179.3	-80.1	0	0	0	111.9	R173	Y169-R173 VanDerWaalsContact CE2-NH2 3.3Å; Y169-R173 VanDerWaalsContact CG-NH1 3.33Å; Y169-R173 PolarHBondContact O-NH1 3.2Å
170	E	86.6	Confident	85.1	Confident	157 Å²	157	91.2 Å²	91.2	73%	0.734	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-45.9	177.8	-60.8	-171.3	163.1	0	0	110.6	D168 K172 R173 D174	D168-E170 VanDerWaalsContact C-N 3.32Å; D168-E170 PolarHBondContact O-N 3.22Å; E170-K172 PolarHBondContact O-N 3.27Å; E170-R173 CarbonylContact O-C 3.6Å; E170-R173 WeakPolarHBondContact O-CA 3.43Å; E170-R173 PolarHBondContact O-N 3.16Å; E170-D174 PolarHBondContact O-N 2.88Å
171	G	84.3	Confident	85.5	Confident	21 Å²	21	94.4 Å²	94.4	22%	0.216	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-32.1	176.8	0	0	0	0	0	114.1	R173 N177	G171-R173 VanDerWaalsContact C-N 3.3Å; G171-R173 PolarHBondContact O-N 3.12Å; G171-N177 PolarHBondContact O-ND2 2.98Å; G171-N177 PolarHBondContact O-OD1 3.07Å
172	K	87.2	Confident	86	Confident	109 Å²	109	88.1 Å²	88.1	47%	0.474	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.6	173.3	-75.2	174.5	166.6	134	0	114.4	L167 D168 E170	L167-K172 HydrophobicContact CB-CD 4.47Å; L167-K172 HydrophobicContact CB-CG 3.61Å; L167-K172 WeakPolarHBondContact O-CD 3.17Å; L167-K172 WeakPolarHBondContact O-CE 3.45Å; L167-K172 PolarHBondContact O-NZ 3.37Å; D168-K172 VanDerWaalsContact O-CB 3.26Å; D168-K172 WeakPolarHBondContact O-CB 3.47Å; D168-K172 VanDerWaalsContact O-CG 3.31Å; D168-K172 WeakPolarHBondContact O-CG 3.36Å; D168-K172 PolarHBondContact O-N 3.19Å; E170-K172 PolarHBondContact O-N 3.27Å
173	R	87.5	Confident	86.3	Confident	151 Å²	151	87.4 Å²	87.4	57%	0.57	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	-7.9	-174.7	-71.6	-176.5	-176.2	77.7	-5.6	114.9	Y169 E170 G171 R175	Y169-R173 VanDerWaalsContact CE2-NH2 3.3Å; Y169-R173 VanDerWaalsContact CG-NH1 3.33Å; Y169-R173 PolarHBondContact O-NH1 3.2Å; E170-R173 CarbonylContact O-C 3.6Å; E170-R173 WeakPolarHBondContact O-CA 3.43Å; E170-R173 PolarHBondContact O-N 3.16Å; G171-R173 VanDerWaalsContact C-N 3.3Å; G171-R173 PolarHBondContact O-N 3.12Å; R173-R175 PolarHBondContact O-N 2.79Å
174	D	89.7	Confident	86.7	Confident	70 Å²	70	88.4 Å²	88.4	37%	0.374	43%	0.434	S	S	.	.			trans	-56.2	129.7	175.3	-178.6	17.2	0	0	0	110.3	E170 W176 N177	E170-D174 PolarHBondContact O-N 2.88Å; D174-W176 PolarHBondContact O-N 3.35Å; D174-W176 PolarHBondContact OD1-N 3.26Å; D174-N177 PolarHBondContact N-ND2 2.87Å; D174-N177 WeakPolarHBondContact O-CB 2.92Å; D174-N177 PolarHBondContact O-ND2 3.44Å
175	R	92.4	Very high	87.3	Confident	195 Å²	195	89.3 Å²	89.3	74%	0.736	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-21	179.8	-158.4	-174.2	77.5	168.5	8.5	111.8	R173	R173-R175 PolarHBondContact O-N 2.79Å
176	W	90.5	Very high	88	Confident	140 Å²	140	95.6 Å²	95.6	53%	0.53	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	11.5	-177.8	-56.1	108.5	0	0	0	113.6	D174 G178 Y179	D174-W176 PolarHBondContact O-N 3.35Å; D174-W176 PolarHBondContact OD1-N 3.26Å; W176-G178 PolarHBondContact O-N 2.86Å; W176-G178 VanDerWaalsContact O-N 3.08Å; W176-Y179 HydrophobicContact CE3-CD2 4.02Å; W176-Y179 HydrophobicContact CE3-CE2 4.44Å; W176-Y179 HydrophobicContact CE3-CG 4.15Å; W176-Y179 HydrophobicContact CZ3-CD2 4.25Å; W176-Y179 HydrophobicContact CZ3-CE2 4.27Å; W176-Y179 WeakPolarHBondContact O-CB 3.49Å; W176-Y179 PolarHBondContact O-N 3.33Å
177	N	89.3	Confident	88.7	Confident	29 Å²	29	95.5 Å²	95.5	16%	0.155	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	111.7	173.4	-95.6	-50.9	0	0	0	112.9	W106 G171 D174	W106-N177 HydrophobicContact CD2-CB 3.73Å; W106-N177 HydrophobicContact CE3-CB 3.59Å; W106-N177 VanDerWaalsContact CE3-CG 3.42Å; W106-N177 HydrophobicContact CG-CB 4.47Å; W106-N177 HydrophobicContact CH2-CB 3.82Å; W106-N177 HydrophobicContact CZ2-CB 3.97Å; W106-N177 HydrophobicContact CZ3-CB 3.63Å; W106-N177 VanDerWaalsContact CZ3-OD1 3.27Å; W106-N177 WeakPolarHBondContact CZ3-OD1 3.5Å; G171-N177 PolarHBondContact O-ND2 2.98Å; G171-N177 PolarHBondContact O-OD1 3.07Å; D174-N177 PolarHBondContact N-ND2 2.87Å; D174-N177 WeakPolarHBondContact O-CB 2.92Å; D174-N177 PolarHBondContact O-ND2 3.44Å
178	G	86.7	Confident	89.4	Confident	48 Å²	48	101.2 Å²	101.2	50%	0.495	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	21.2	-177.2	0	0	0	0	0	114.8	W176	W176-G178 PolarHBondContact O-N 2.86Å; W176-G178 VanDerWaalsContact O-N 3.08Å
179	Y	90.4	Very high	90.2	Very high	80 Å²	80	102 Å²	102	31%	0.314	48%	0.476	S	S	.	.			trans	-68.3	129	169	-179.4	-111.8	0	0	0	111	W176 P181 E183 H184	W176-Y179 HydrophobicContact CE3-CD2 4.02Å; W176-Y179 HydrophobicContact CE3-CE2 4.44Å; W176-Y179 HydrophobicContact CE3-CG 4.15Å; W176-Y179 HydrophobicContact CZ3-CD2 4.25Å; W176-Y179 HydrophobicContact CZ3-CE2 4.27Å; W176-Y179 WeakPolarHBondContact O-CB 3.49Å; W176-Y179 PolarHBondContact O-N 3.33Å; Y179-P181 WeakPolarHBondContact O-CD 3.38Å; Y179-E183 HydrophobicContact CE2-CB 3.93Å; Y179-H184 WeakPolarHBondContact OH-CA 3.43Å; Y179-H184 PolarHBondContact OH-N 3.33Å; Y179-H184 VanDerWaalsContact OH-N 3.16Å
180	D	88.3	Confident	90.7	Very high	82 Å²	82	99.6 Å²	99.6	44%	0.439	47%	0.47	S	S	.	.			trans	-85.4	118.8	171.4	173.7	6.6	0	0	0	109.3	S182 E183	D180-S182 PolarHBondContact O-N 2.95Å; D180-S182 WeakPolarHBondContact OD1-CB 3.45Å; D180-S182 PolarHBondContact OD1-N 3.22Å; D180-S182 PolarHBondContact OD1-OG 3.03Å; D180-S182 WeakPolarHBondContact OD2-CB 3.16Å; D180-S182 PolarHBondContact OD2-OG 2.93Å; D180-E183 HydrophobicContact CB-CG 4.37Å; D180-E183 PolarHBondContact O-N 2.9Å
181	P	90.5	Very high	91.1	Very high	94 Å²	94	99.5 Å²	99.5	61%	0.61	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-55.1	-20.3	175.7	-25.9	35.6	0	0	0	114.2	Y179 E183 H184	Y179-P181 WeakPolarHBondContact O-CD 3.38Å; P181-E183 VanDerWaalsContact C-N 3.27Å; P181-E183 PolarHBondContact O-N 3.45Å; P181-H184 VanDerWaalsContact O-CB 3.29Å; P181-H184 WeakPolarHBondContact O-CB 3.47Å; P181-H184 PolarHBondContact O-N 3.47Å
182	S	91.5	Very high	91.6	Very high	55 Å²	55	102.7 Å²	102.7	39%	0.385	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-64.1	-28.3	173.7	-47.9	0	0	0	0	112.9	D180 H184 K185	D180-S182 PolarHBondContact O-N 2.95Å; D180-S182 WeakPolarHBondContact OD1-CB 3.45Å; D180-S182 PolarHBondContact OD1-N 3.22Å; D180-S182 PolarHBondContact OD1-OG 3.03Å; D180-S182 WeakPolarHBondContact OD2-CB 3.16Å; D180-S182 PolarHBondContact OD2-OG 2.93Å; S182-H184 PolarHBondContact O-N 3.33Å; S182-K185 VanDerWaalsContact O-CB 3.25Å; S182-K185 WeakPolarHBondContact O-CB 3.15Å; S182-K185 WeakPolarHBondContact O-CG 3.39Å; S182-K185 PolarHBondContact O-N 3.48Å; S182-K185 VanDerWaalsContact O-N 3.09Å
183	E	90.9	Very high	92	Very high	78 Å²	78	103.9 Å²	103.9	36%	0.364	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-67.1	-24.1	177.3	-63	-151.5	125.6	0	0	112.4	Y179 D180 P181 K185 R186	Y179-E183 HydrophobicContact CE2-CB 3.93Å; D180-E183 HydrophobicContact CB-CG 4.37Å; D180-E183 PolarHBondContact O-N 2.9Å; P181-E183 VanDerWaalsContact C-N 3.27Å; P181-E183 PolarHBondContact O-N 3.45Å; E183-K185 PolarHBondContact O-N 3.28Å; E183-K185 VanDerWaalsContact O-N 3.15Å; E183-R186 WeakPolarHBondContact O-CB 3.41Å; E183-R186 PolarHBondContact O-N 3.04Å; E183-R186 IonicContact OE1-CZ 2.67Å; E183-R186 IonicContact OE1-NH1 3.82Å; E183-R186 PolarHBondContact OE1-NH1 2.88Å; E183-R186 IonicContact OE1-NH2 3.61Å; E183-R186 PolarHBondContact OE1-NH2 3.4Å
184	H	92.7	Very high	92.3	Very high	112 Å²	112	101.3 Å²	101.3	52%	0.519	47%	0.472	S	S	.	.	H	α-helix	trans	-61.5	-21	173.2	-164.3	-80.6	0	0	0	112.4	Y179 P181 S182 R186 I187 F188	Y179-H184 WeakPolarHBondContact OH-CA 3.43Å; Y179-H184 PolarHBondContact OH-N 3.33Å; Y179-H184 VanDerWaalsContact OH-N 3.16Å; P181-H184 VanDerWaalsContact O-CB 3.29Å; P181-H184 WeakPolarHBondContact O-CB 3.47Å; P181-H184 PolarHBondContact O-N 3.47Å; S182-H184 PolarHBondContact O-N 3.33Å; H184-R186 VanDerWaalsContact C-N 3.3Å; H184-R186 PolarHBondContact O-N 3.03Å; H184-I187 WeakPolarHBondContact O-CB 3.39Å; H184-I187 PolarHBondContact O-N 2.96Å; H184-F188 PolarHBondContact O-N 3.32Å; H184-F188 VanDerWaalsContact O-N 3.15Å
185	K	94.8	Very high	92.5	Very high	136 Å²	136	103.2 Å²	103.2	59%	0.591	48%	0.479	S	S	*	.	H	α-helix	trans	-64.1	-33.6	173.4	-61.6	174	-178.8	171.4	0	112	S182 E183 I187 F188 E189	S182-K185 VanDerWaalsContact O-CB 3.25Å; S182-K185 WeakPolarHBondContact O-CB 3.15Å; S182-K185 WeakPolarHBondContact O-CG 3.39Å; S182-K185 PolarHBondContact O-N 3.48Å; S182-K185 VanDerWaalsContact O-N 3.09Å; E183-K185 PolarHBondContact O-N 3.28Å; E183-K185 VanDerWaalsContact O-N 3.15Å; K185-I187 VanDerWaalsContact C-N 3.31Å; K185-I187 PolarHBondContact O-N 2.96Å; K185-F188 WeakPolarHBondContact O-CB 3.47Å; K185-F188 PolarHBondContact O-N 2.9Å; K185-F188 VanDerWaalsContact O-N 3.16Å; K185-E189 WeakPolarHBondContact O-CG 3.45Å; K185-E189 PolarHBondContact O-N 3.48Å
186	R	94	Very high	92.5	Very high	139 Å²	139	98.3 Å²	98.3	53%	0.525	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-40	175.2	-60.6	-172.2	-169.7	128	8.6	111.5	E183 H184 F188 E189 E190	E183-R186 WeakPolarHBondContact O-CB 3.41Å; E183-R186 PolarHBondContact O-N 3.04Å; E183-R186 IonicContact OE1-CZ 2.67Å; E183-R186 IonicContact OE1-NH1 3.82Å; E183-R186 PolarHBondContact OE1-NH1 2.88Å; E183-R186 IonicContact OE1-NH2 3.61Å; E183-R186 PolarHBondContact OE1-NH2 3.4Å; H184-R186 VanDerWaalsContact C-N 3.3Å; H184-R186 PolarHBondContact O-N 3.03Å; R186-F188 VanDerWaalsContact C-N 3.35Å; R186-E189 PolarHBondContact O-N 2.86Å; R186-E190 WeakPolarHBondContact O-CG 3.49Å; R186-E190 PolarHBondContact O-N 3.4Å
187	I	94.3	Very high	92.7	Very high	70 Å²	70	94.2 Å²	94.2	36%	0.359	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-44.3	175.2	-53.8	176.3	0	0	0	109.7	H184 K185 E189 E190 Y191	H184-I187 WeakPolarHBondContact O-CB 3.39Å; H184-I187 PolarHBondContact O-N 2.96Å; K185-I187 VanDerWaalsContact C-N 3.31Å; K185-I187 PolarHBondContact O-N 2.96Å; I187-E189 PolarHBondContact O-N 3.37Å; I187-E190 PolarHBondContact O-N 3.31Å; I187-Y191 HydrophobicContact CG2-CD2 3.93Å; I187-Y191 HydrophobicContact CG2-CE2 3.92Å; I187-Y191 WeakPolarHBondContact O-CD2 3.35Å; I187-Y191 PolarHBondContact O-N 2.83Å
188	F	92.8	Very high	92.9	Very high	136 Å²	136	100.7 Å²	100.7	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-59.4	-45.2	175.1	-177.1	-88.5	0	0	0	112.2	H184 K185 R186 E190 Y191 Q192	H184-F188 PolarHBondContact O-N 3.32Å; H184-F188 VanDerWaalsContact O-N 3.15Å; K185-F188 WeakPolarHBondContact O-CB 3.47Å; K185-F188 PolarHBondContact O-N 2.9Å; K185-F188 VanDerWaalsContact O-N 3.16Å; R186-F188 VanDerWaalsContact C-N 3.35Å; F188-E190 PolarHBondContact O-N 3.03Å; F188-Y191 PolarHBondContact O-N 2.83Å; F188-Q192 WeakPolarHBondContact O-CB 3.5Å; F188-Q192 PolarHBondContact O-N 2.93Å
189	E	95.2	Very high	93.1	Very high	87 Å²	87	102.1 Å²	102.1	41%	0.407	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-39.5	175.3	-68.9	172.6	-137.7	0	0	113	K185 R186 I187 Q192 R193	K185-E189 WeakPolarHBondContact O-CG 3.45Å; K185-E189 PolarHBondContact O-N 3.48Å; R186-E189 PolarHBondContact O-N 2.86Å; I187-E189 PolarHBondContact O-N 3.37Å; E189-Q192 PolarHBondContact O-N 3.19Å; E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.47Å; E189-R193 PolarHBondContact O-N 3.19Å; E189-R193 IonicContact OE2-CZ 2.77Å; E189-R193 IonicContact OE2-NH2 3.03Å; E189-R193 PolarHBondContact OE2-NH2 2.86Å
190	E	95.5	Very high	93.3	Very high	102 Å²	102	103 Å²	103	48%	0.477	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-44.1	175.8	-76	170.2	-166.1	0	0	111.6	R186 I187 F188 R193 L194	R186-E190 WeakPolarHBondContact O-CG 3.49Å; R186-E190 PolarHBondContact O-N 3.4Å; I187-E190 PolarHBondContact O-N 3.31Å; F188-E190 PolarHBondContact O-N 3.03Å; E190-R193 PolarHBondContact O-N 2.91Å; E190-L194 VanDerWaalsContact O-CG 3.3Å; E190-L194 WeakPolarHBondContact O-CG 3.44Å; E190-L194 PolarHBondContact O-N 2.95Å
191	Y	95.7	Very high	93.5	Very high	155 Å²	155	101.4 Å²	101.4	61%	0.608	48%	0.483	S	S	*	.	H	α-helix	trans	-63.6	-41	173.4	-88.3	-103.2	0	0	0	111.9	I187 F188 L194 E195	I187-Y191 HydrophobicContact CG2-CD2 3.93Å; I187-Y191 HydrophobicContact CG2-CE2 3.92Å; I187-Y191 WeakPolarHBondContact O-CD2 3.35Å; I187-Y191 PolarHBondContact O-N 2.83Å; F188-Y191 PolarHBondContact O-N 2.83Å; Y191-L194 WeakPolarHBondContact O-CB 3.25Å; Y191-L194 PolarHBondContact O-N 3.03Å; Y191-E195 PolarHBondContact O-N 2.98Å
192	Q	94.9	Very high	93.6	Very high	89 Å²	89	100.8 Å²	100.8	42%	0.416	47%	0.47	S	S	.	.	H	α-helix	trans	-60.1	-48.4	175.7	-174.9	-175.2	-30.7	0	0	111.4	F188 E189 L194 E195 E196	F188-Q192 WeakPolarHBondContact O-CB 3.5Å; F188-Q192 PolarHBondContact O-N 2.93Å; E189-Q192 PolarHBondContact O-N 3.19Å; Q192-L194 VanDerWaalsContact C-N 3.27Å; Q192-L194 PolarHBondContact O-N 3.27Å; Q192-E195 PolarHBondContact O-N 3.15Å; Q192-E195 VanDerWaalsContact O-N 3.07Å; Q192-E196 WeakPolarHBondContact CG-OE1 3.27Å; Q192-E196 PolarHBondContact NE2-OE1 2.98Å; Q192-E196 WeakPolarHBondContact O-CG 3.42Å; Q192-E196 PolarHBondContact O-N 3.03Å
193	R	95.1	Very high	93.6	Very high	134 Å²	134	100.1 Å²	100.1	51%	0.506	47%	0.468	S	S	.	.	H	α-helix	trans	-60.5	-36.3	176.3	-66.9	170.1	-150.4	151	4.8	112	E189 E190 A197	E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.47Å; E189-R193 PolarHBondContact O-N 3.19Å; E189-R193 IonicContact OE2-CZ 2.77Å; E189-R193 IonicContact OE2-NH2 3.03Å; E189-R193 PolarHBondContact OE2-NH2 2.86Å; E190-R193 PolarHBondContact O-N 2.91Å; R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.47Å; R193-A197 PolarHBondContact O-N 2.93Å
194	L	93.7	Very high	93.7	Very high	97 Å²	97	102.8 Å²	102.8	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-68.3	-35.6	174.1	-73	169.6	0	0	0	112.5	E190 Y191 Q192 R198	E190-L194 VanDerWaalsContact O-CG 3.3Å; E190-L194 WeakPolarHBondContact O-CG 3.44Å; E190-L194 PolarHBondContact O-N 2.95Å; Y191-L194 WeakPolarHBondContact O-CB 3.25Å; Y191-L194 PolarHBondContact O-N 3.03Å; Q192-L194 VanDerWaalsContact C-N 3.27Å; Q192-L194 PolarHBondContact O-N 3.27Å; L194-R198 WeakPolarHBondContact O-CB 3.49Å; L194-R198 WeakPolarHBondContact O-CD 3.4Å; L194-R198 WeakPolarHBondContact O-CG 3.48Å; L194-R198 PolarHBondContact O-N 2.89Å
195	E	92.8	Very high	93.6	Very high	110 Å²	110	103.9 Å²	103.9	51%	0.514	48%	0.482	S	S	.	.	H	α-helix	trans	-71.6	-39.7	173.7	-72.3	-166.8	171.4	0	0	112.7	Y191 Q192 R198 K199	Y191-E195 PolarHBondContact O-N 2.98Å; Q192-E195 PolarHBondContact O-N 3.15Å; Q192-E195 VanDerWaalsContact O-N 3.07Å; E195-R198 CarbonylContact O-C 3.59Å; E195-R198 WeakPolarHBondContact O-CB 3.48Å; E195-R198 PolarHBondContact O-N 3.32Å; E195-K199 WeakPolarHBondContact O-CB 3.25Å; E195-K199 WeakPolarHBondContact O-CG 3.47Å; E195-K199 PolarHBondContact O-N 3.49Å
196	E	93.8	Very high	93.2	Very high	91 Å²	91	101.8 Å²	101.8	43%	0.425	48%	0.476	S	S	.	.	H	α-helix	trans	-61.2	-47.4	172.2	-72	168.4	-173.9	0	0	111	Q192 R198 K199 I200	Q192-E196 WeakPolarHBondContact CG-OE1 3.27Å; Q192-E196 PolarHBondContact NE2-OE1 2.98Å; Q192-E196 WeakPolarHBondContact O-CG 3.42Å; Q192-E196 PolarHBondContact O-N 3.03Å; E196-R198 VanDerWaalsContact C-N 3.31Å; E196-R198 PolarHBondContact O-N 3.44Å; E196-K199 PolarHBondContact O-N 3.41Å; E196-K199 VanDerWaalsContact O-N 3.14Å; E196-I200 WeakPolarHBondContact O-CG1 3.44Å; E196-I200 PolarHBondContact O-N 3.08Å
197	A	94.2	Very high	92.9	Very high	55 Å²	55	100.8 Å²	100.8	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-60.4	-39	174.1	0	0	0	0	0	112.3	R193 A201	R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.47Å; R193-A197 PolarHBondContact O-N 2.93Å; A197-A201 VanDerWaalsContact O-CB 3.25Å; A197-A201 WeakPolarHBondContact O-CB 3.39Å; A197-A201 PolarHBondContact O-N 2.93Å
198	R	92.5	Very high	92.5	Very high	164 Å²	164	102.4 Å²	102.4	62%	0.619	48%	0.484	S	S	*	.	H	α-helix	trans	-65.2	-43.1	172.3	-75.7	165.5	178.2	-169.6	0.9	111.9	L194 E195 E196 A201 K202	L194-R198 WeakPolarHBondContact O-CB 3.49Å; L194-R198 WeakPolarHBondContact O-CD 3.4Å; L194-R198 WeakPolarHBondContact O-CG 3.48Å; L194-R198 PolarHBondContact O-N 2.89Å; E195-R198 CarbonylContact O-C 3.59Å; E195-R198 WeakPolarHBondContact O-CB 3.48Å; E195-R198 PolarHBondContact O-N 3.32Å; E196-R198 VanDerWaalsContact C-N 3.31Å; E196-R198 PolarHBondContact O-N 3.44Å; R198-A201 PolarHBondContact O-N 2.88Å; R198-K202 WeakPolarHBondContact O-CB 3.14Å; R198-K202 WeakPolarHBondContact O-CG 3.33Å; R198-K202 PolarHBondContact O-N 3.25Å
199	K	92	Very high	92.1	Very high	78 Å²	78	103 Å²	103	34%	0.339	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-44.3	177.2	-79.1	-178.6	166.7	-167.4	0	110.5	E195 E196 K202 A203 L232 D233	E195-K199 WeakPolarHBondContact O-CB 3.25Å; E195-K199 WeakPolarHBondContact O-CG 3.47Å; E195-K199 PolarHBondContact O-N 3.49Å; E196-K199 PolarHBondContact O-N 3.41Å; E196-K199 VanDerWaalsContact O-N 3.14Å; K199-K202 PolarHBondContact O-N 2.78Å; K199-A203 WeakPolarHBondContact O-CB 3.48Å; K199-A203 PolarHBondContact O-N 3.14Å; K199-L232 HydrophobicContact CD-CD2 3.98Å; K199-L232 HydrophobicContact CD-CG 4Å; K199-L232 PolarHBondContact NZ-O 3.28Å; K199-D233 IonicContact NZ-OD1 2.76Å; K199-D233 PolarHBondContact NZ-OD1 3.27Å
200	I	94.3	Very high	91.5	Very high	98 Å²	98	104.6 Å²	104.6	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-45.5	174.5	-65	163.9	0	0	0	111.8	E196 K202 A203 K204	E196-I200 WeakPolarHBondContact O-CG1 3.44Å; E196-I200 PolarHBondContact O-N 3.08Å; I200-K202 VanDerWaalsContact C-N 3.26Å; I200-K202 PolarHBondContact O-N 3.26Å; I200-A203 PolarHBondContact O-N 3.38Å; I200-K204 HydrophobicContact CG2-CD 4.32Å; I200-K204 WeakPolarHBondContact O-CG 3.21Å; I200-K204 PolarHBondContact O-N 2.91Å
201	A	92.5	Very high	91	Very high	50 Å²	50	102.1 Å²	102.1	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-26.2	178.5	0	0	0	0	0	113.2	A197 R198 K205	A197-A201 VanDerWaalsContact O-CB 3.25Å; A197-A201 WeakPolarHBondContact O-CB 3.39Å; A197-A201 PolarHBondContact O-N 2.93Å; R198-A201 PolarHBondContact O-N 2.88Å; A201-K205 WeakPolarHBondContact O-CD 2.96Å; A201-K205 VanDerWaalsContact O-CG 3.3Å; A201-K205 WeakPolarHBondContact O-CG 3.18Å
202	K	92.1	Very high	90.3	Very high	81 Å²	81	100.6 Å²	100.6	35%	0.352	49%	0.49	S	S	.	.	H	α-helix	trans	-73.9	-47.3	169.7	-75.2	170.5	158.8	-146.2	0	111.3	R198 K199 I200 K205 L206 F236	R198-K202 WeakPolarHBondContact O-CB 3.14Å; R198-K202 WeakPolarHBondContact O-CG 3.33Å; R198-K202 PolarHBondContact O-N 3.25Å; K199-K202 PolarHBondContact O-N 2.78Å; I200-K202 VanDerWaalsContact C-N 3.26Å; I200-K202 PolarHBondContact O-N 3.26Å; K202-K205 PolarHBondContact O-N 2.86Å; K202-K205 VanDerWaalsContact O-N 3.16Å; K202-L206 PolarHBondContact O-N 3.02Å; K202-L206 VanDerWaalsContact O-N 3.09Å; K202-F236 HydrophobicContact CB-CE2 4.03Å; K202-F236 HydrophobicContact CB-CZ 3.95Å; K202-F236 HydrophobicContact CD-CD2 4.16Å; K202-F236 HydrophobicContact CD-CE1 4.09Å; K202-F236 HydrophobicContact CD-CE2 3.45Å; K202-F236 VanDerWaalsContact CD-CE2 3.45Å; K202-F236 HydrophobicContact CD-CZ 3.43Å; K202-F236 VanDerWaalsContact CD-CZ 3.43Å; K202-F236 VanDerWaalsContact CE-CE1 3.46Å; K202-F236 HydrophobicContact CG-CE1 4.32Å; K202-F236 HydrophobicContact CG-CE2 3.89Å; K202-F236 HydrophobicContact CG-CZ 3.5Å; K202-F236 VanDerWaalsContact CG-CZ 3.5Å; K202-F236 VanDerWaalsContact NZ-CE1 3.32Å
203	A	92.1	Very high	89.4	Confident	41 Å²	41	99.1 Å²	99.1	34%	0.339	49%	0.494	S	S	.	.	H	α-helix	trans	-57.3	-50.5	178.3	0	0	0	0	0	111.9	K199 I200 K205 L206 E207	K199-A203 WeakPolarHBondContact O-CB 3.48Å; K199-A203 PolarHBondContact O-N 3.14Å; I200-A203 PolarHBondContact O-N 3.38Å; A203-K205 PolarHBondContact O-N 3.38Å; A203-L206 WeakPolarHBondContact O-CA 2.96Å; A203-L206 WeakPolarHBondContact O-CB 3.18Å; A203-L206 PolarHBondContact O-N 3.49Å; A203-E207 WeakPolarHBondContact O-CG 3.36Å; A203-E207 PolarHBondContact O-N 2.9Å
204	K	92.4	Very high	88.2	Confident	133 Å²	133	96 Å²	96	58%	0.578	50%	0.496	S	S	*	.	H	α-helix	trans	-57.4	-34.1	176.6	-70.5	-175.3	176.6	-171.2	0	113.5	I200 E207 E208	I200-K204 HydrophobicContact CG2-CD 4.32Å; I200-K204 WeakPolarHBondContact O-CG 3.21Å; I200-K204 PolarHBondContact O-N 2.91Å; K204-E207 WeakPolarHBondContact CA-OE2 3.37Å; K204-E208 VanDerWaalsContact O-CB 3.27Å; K204-E208 WeakPolarHBondContact O-CB 3.5Å; K204-E208 PolarHBondContact O-N 3.33Å
205	K	90.6	Very high	86.7	Confident	136 Å²	136	99 Å²	99	59%	0.591	51%	0.508	S	S	*	.	H	α-helix	trans	-75.7	-21.1	175	-74.4	177.7	179.1	-175	0	113.7	A201 K202 A203 K209	A201-K205 WeakPolarHBondContact O-CD 2.96Å; A201-K205 VanDerWaalsContact O-CG 3.3Å; A201-K205 WeakPolarHBondContact O-CG 3.18Å; K202-K205 PolarHBondContact O-N 2.86Å; K202-K205 VanDerWaalsContact O-N 3.16Å; A203-K205 PolarHBondContact O-N 3.38Å; K205-K209 WeakPolarHBondContact O-CD 3.3Å; K205-K209 VanDerWaalsContact O-CG 3.23Å; K205-K209 WeakPolarHBondContact O-CG 3.29Å; K205-K209 PolarHBondContact O-N 2.94Å
206	L	86	Confident	85	Confident	91 Å²	91	97.1 Å²	97.1	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-80.9	-43.2	170	-67.3	172.2	0	0	0	110.3	K202 A203 E208 K209 L210	K202-L206 PolarHBondContact O-N 3.02Å; K202-L206 VanDerWaalsContact O-N 3.09Å; A203-L206 WeakPolarHBondContact O-CA 2.96Å; A203-L206 WeakPolarHBondContact O-CB 3.18Å; A203-L206 PolarHBondContact O-N 3.49Å; L206-E208 PolarHBondContact O-N 3.25Å; L206-K209 WeakPolarHBondContact O-CB 3.15Å; L206-K209 PolarHBondContact O-N 2.97Å; L206-L210 WeakPolarHBondContact O-CB 3.39Å; L206-L210 VanDerWaalsContact O-CG 3.32Å; L206-L210 WeakPolarHBondContact O-CG 3.36Å; L206-L210 PolarHBondContact O-N 2.78Å
207	E	87.5	Confident	82.6	Confident	118 Å²	118	97 Å²	97	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-57.3	-47.9	172.7	-68	165.6	171.8	0	0	111.5	A203 K204 K209 L210 A211	A203-E207 WeakPolarHBondContact O-CG 3.36Å; A203-E207 PolarHBondContact O-N 2.9Å; K204-E207 WeakPolarHBondContact CA-OE2 3.37Å; E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 2.9Å; E207-L210 PolarHBondContact O-N 3.4Å; E207-A211 WeakPolarHBondContact O-CB 3.36Å; E207-A211 PolarHBondContact O-N 2.9Å
208	E	87.3	Confident	79.8	Confident	104 Å²	104	98.4 Å²	98.4	49%	0.486	55%	0.547	S	S	.	.	H	α-helix	trans	-61.1	-36.1	176.3	-168.7	-164.7	156.5	0	0	112.6	K204 L206 K212	K204-E208 VanDerWaalsContact O-CB 3.27Å; K204-E208 WeakPolarHBondContact O-CB 3.5Å; K204-E208 PolarHBondContact O-N 3.33Å; L206-E208 PolarHBondContact O-N 3.25Å; E208-K212 HydrophobicContact CG-CD 4.42Å; E208-K212 WeakPolarHBondContact O-CB 3.24Å; E208-K212 WeakPolarHBondContact O-CD 3.46Å; E208-K212 VanDerWaalsContact O-CG 3.29Å; E208-K212 WeakPolarHBondContact O-CG 3.35Å; E208-K212 PolarHBondContact O-N 3.09Å; E208-K212 IonicContact OE1-NZ 2.93Å; E208-K212 PolarHBondContact OE1-NZ 3.36Å
209	K	83.9	Confident	77.1	Confident	148 Å²	148	93.7 Å²	93.7	64%	0.643	55%	0.549	S	S	*	.	H	α-helix	trans	-70.1	-42.1	174	-80.6	176.5	174.5	-167.3	0	112.1	K205 L206 E207 K212 A213	K205-K209 WeakPolarHBondContact O-CD 3.3Å; K205-K209 VanDerWaalsContact O-CG 3.23Å; K205-K209 WeakPolarHBondContact O-CG 3.29Å; K205-K209 PolarHBondContact O-N 2.94Å; L206-K209 WeakPolarHBondContact O-CB 3.15Å; L206-K209 PolarHBondContact O-N 2.97Å; E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 2.9Å; K209-K212 PolarHBondContact O-N 3.25Å; K209-A213 WeakPolarHBondContact O-CB 3.07Å; K209-A213 PolarHBondContact O-N 3.35Å
210	L	83	Confident	74.4	Confident	122 Å²	122	99.6 Å²	99.6	64%	0.639	58%	0.578	S	S	*	*	H	α-helix	trans	-67.5	-40.1	179.1	-72.5	169.2	0	0	0	111.4	L206 E207 A213 A214	L206-L210 WeakPolarHBondContact O-CB 3.39Å; L206-L210 VanDerWaalsContact O-CG 3.32Å; L206-L210 WeakPolarHBondContact O-CG 3.36Å; L206-L210 PolarHBondContact O-N 2.78Å; E207-L210 PolarHBondContact O-N 3.4Å; L210-A213 PolarHBondContact O-N 2.71Å; L210-A214 WeakPolarHBondContact O-CB 3.31Å; L210-A214 PolarHBondContact O-N 2.78Å
211	A	83.9	Confident	71.6	Confident	50 Å²	50	103.7 Å²	103.7	41%	0.413	60%	0.595	S	S	.	*	H	α-helix	trans	-59	-50.4	172.6	0	0	0	0	0	111.3	E207 A213 A214 E215	E207-A211 WeakPolarHBondContact O-CB 3.36Å; E207-A211 PolarHBondContact O-N 2.9Å; A211-A213 VanDerWaalsContact C-N 3.28Å; A211-A213 PolarHBondContact O-N 3Å; A211-A214 PolarHBondContact O-N 2.95Å; A211-A214 VanDerWaalsContact O-N 3.13Å; A211-E215 WeakPolarHBondContact O-CG 3.46Å; A211-E215 PolarHBondContact O-N 2.88Å
212	K	82.6	Confident	69	Low	122 Å²	122	109.3 Å²	109.3	53%	0.53	61%	0.613	S	S	.	*	H	α-helix	trans	-63.6	-31	176.9	-71.6	170.1	-179.2	177.5	0	113.3	E208 K209 G216	E208-K212 HydrophobicContact CG-CD 4.42Å; E208-K212 WeakPolarHBondContact O-CB 3.24Å; E208-K212 WeakPolarHBondContact O-CD 3.46Å; E208-K212 VanDerWaalsContact O-CG 3.29Å; E208-K212 WeakPolarHBondContact O-CG 3.35Å; E208-K212 PolarHBondContact O-N 3.09Å; E208-K212 IonicContact OE1-NZ 2.93Å; E208-K212 PolarHBondContact OE1-NZ 3.36Å; K209-K212 PolarHBondContact O-N 3.25Å; K212-G216 PolarHBondContact O-N 3.48Å; K212-G216 VanDerWaalsContact O-N 3.09Å
213	A	75.5	Confident	66.6	Low	59 Å²	59	110.5 Å²	110.5	49%	0.488	63%	0.629	S	S	.	*	H	α-helix	trans	-72.1	-37.6	173.6	0	0	0	0	0	112.2	K209 L210 A211 G216 S217	K209-A213 WeakPolarHBondContact O-CB 3.07Å; K209-A213 PolarHBondContact O-N 3.35Å; L210-A213 PolarHBondContact O-N 2.71Å; A211-A213 VanDerWaalsContact C-N 3.28Å; A211-A213 PolarHBondContact O-N 3Å; A213-G216 PolarHBondContact O-N 3.48Å; A213-S217 WeakPolarHBondContact O-CB 3.3Å; A213-S217 PolarHBondContact O-N 3.48Å
214	A	69.7	Low	63.9	Low	67 Å²	67	113.4 Å²	113.4	55%	0.554	65%	0.653	S	S	*	*	H	α-helix	trans	-68.6	-46.4	175.2	0	0	0	0	0	111.8	L210 A211 G216 S217	L210-A214 WeakPolarHBondContact O-CB 3.31Å; L210-A214 PolarHBondContact O-N 2.78Å; A211-A214 PolarHBondContact O-N 2.95Å; A211-A214 VanDerWaalsContact O-N 3.13Å; A214-G216 PolarHBondContact O-N 2.97Å; A214-S217 PolarHBondContact O-N 2.84Å
215	E	62.4	Low	61	Low	162 Å²	162	112.1 Å²	112.1	76%	0.757	67%	0.667	S	S	*	*	H	α-helix	trans	-59.2	-33.1	173.3	-70.8	174.5	168.5	0	0	112.1	A211 S217	A211-E215 WeakPolarHBondContact O-CG 3.46Å; A211-E215 PolarHBondContact O-N 2.88Å; E215-S217 VanDerWaalsContact C-N 3.35Å
216	G	57	Low	58.4	Low	69 Å²	69	111.1 Å²	111.1	71%	0.711	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-3.5	174.7	0	0	0	0	0	115.8	K212 A213 A214	K212-G216 PolarHBondContact O-N 3.48Å; K212-G216 VanDerWaalsContact O-N 3.09Å; A213-G216 PolarHBondContact O-N 3.48Å; A214-G216 PolarHBondContact O-N 2.97Å
217	S	43	Very low	56	Low	88 Å²	88	112 Å²	112	62%	0.615	70%	0.697	S	S	*	*			trans	-124.4	47.3	-170.7	-172.9	0	0	0	0	112.7	A213 A214 E215 G219	A213-S217 WeakPolarHBondContact O-CB 3.3Å; A213-S217 PolarHBondContact O-N 3.48Å; A214-S217 PolarHBondContact O-N 2.84Å; E215-S217 VanDerWaalsContact C-N 3.35Å; S217-G219 PolarHBondContact O-N 2.71Å
218	G	35.7	Very low	53.4	Low	86 Å²	86	110.6 Å²	110.6	89%	0.887	71%	0.706	S	S	*	*			trans	-66.1	88.9	177.2	0	0	0	0	0	113.9
219	G	34.7	Very low	51.1	Low	65 Å²	65	114.9 Å²	114.9	67%	0.67	72%	0.723	S	S	*	*			trans	122.3	82.4	157.9	0	0	0	0	0	116.9	S217	S217-G219 PolarHBondContact O-N 2.71Å
220	Q	37.2	Very low	48.9	Very low	201 Å²	201	113.9 Å²	113.9	94%	0.939	73%	0.732	S	S	*	*				-167.9	138.1	115	-104.1	171.3	-4.8	0	0	113
221	E	34.7	Very low	46.7	Very low	185 Å²	185	112.2 Å²	112.2	86%	0.864	73%	0.73	S	S	*	*			trans	-65.3	161.8	174.2	-71.9	163.8	175.6	0	0	111.9
222	E	37.7	Very low	45	Very low	167 Å²	167	115.6 Å²	115.6	78%	0.78	74%	0.741	S	S	*	*			cis	-157.3	-169.3	1	-113.5	-73.5	80.6	0	0	107
223	P	42.5	Very low	43.3	Very low	107 Å²	107	115.5 Å²	115.5	70%	0.695	75%	0.746	S	S	*	*			trans	-115.5	171.3	-141.6	41.7	-26.5	0	0	0	115.9
224	A	34.6	Very low	41.7	Very low	101 Å²	101	118.7 Å²	118.7	84%	0.835	76%	0.755	S	S	*	*			trans	-145.4	120.3	165.1	0	0	0	0	0	111.8
225	A	32.1	Very low	40.4	Very low	107 Å²	107	121.8 Å²	121.8	88%	0.884	76%	0.762	S	S	*	*			trans	-84.1	131.8	-179.9	0	0	0	0	0	112.5
226	S	34.7	Very low	39.4	Very low	115 Å²	115	120.1 Å²	120.1	80%	0.804	75%	0.753	S	S	*	*			trans	-171.6	-2.7	160.9	54.5	0	0	0	0	115.9	A228	S226-A228 VanDerWaalsContact C-N 3.29Å; S226-A228 PolarHBondContact O-N 2.65Å
227	A	36.7	Very low	38.9	Very low	108 Å²	108	124.1 Å²	124.1	89%	0.893	76%	0.758	S	S	*	*			trans	-71.3	72.1	-175.7	0	0	0	0	0	113.9	K229	A227-K229 PolarHBondContact O-N 3.24Å
228	A	33.2	Very low	39	Very low	90 Å²	90	123.8 Å²	123.8	74%	0.744	76%	0.76	S	S	*	*			trans	-76.5	113.2	-177.9	0	0	0	0	0	112.7	S226	S226-A228 VanDerWaalsContact C-N 3.29Å; S226-A228 PolarHBondContact O-N 2.65Å
229	K	37.3	Very low	39.5	Very low	194 Å²	194	128.6 Å²	128.6	84%	0.843	76%	0.76	S	S	*	*			trans	66.5	106.8	170.5	-59.3	-178	177.6	-178.3	0	116.2	A227 S231	A227-K229 PolarHBondContact O-N 3.24Å; K229-S231 PolarHBondContact O-N 2.81Å
230	P	38.8	Very low	39.8	Very low	126 Å²	126	130.5 Å²	130.5	82%	0.818	76%	0.755	S	S	*	*			trans	-67.5	116.9	161	28.8	-32.3	0	0	0	109.6
231	S	36.9	Very low	40.3	Very low	87 Å²	87	123.6 Å²	123.6	61%	0.608	74%	0.738	S	S	*	*			trans	-81.4	122.8	171.3	-164.2	0	0	0	0	108.8	K229 D233	K229-S231 PolarHBondContact O-N 2.81Å; S231-D233 PolarHBondContact O-N 2.87Å
232	L	47.9	Very low	41	Very low	121 Å²	121	121 Å²	121	63%	0.634	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	26.1	-157.3	-169.3	51.7	0	0	0	115.3	K199	K199-L232 HydrophobicContact CD-CD2 3.98Å; K199-L232 HydrophobicContact CD-CG 4Å; K199-L232 PolarHBondContact NZ-O 3.28Å
233	D	46.1	Very low	41.5	Very low	120 Å²	120	119.5 Å²	119.5	64%	0.642	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142	-6.6	-160.2	-57.7	-66.1	0	0	0	117.7	K199 S231	K199-D233 IonicContact NZ-OD1 2.76Å; K199-D233 PolarHBondContact NZ-OD1 3.27Å; S231-D233 PolarHBondContact O-N 2.87Å
234	D	42.6	Very low	41.9	Very low	127 Å²	127	121.8 Å²	121.8	68%	0.679	72%	0.716	S	S	*	*	S	Bend	trans	-107.3	-33	-179.2	-91.9	-72.5	0	0	0	115.4	F236	D234-F236 PolarHBondContact O-N 3.1Å
235	D	43.3	Very low	42.8	Very low	132 Å²	132	120.2 Å²	120.2	71%	0.706	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	59.3	-163.9	-60.9	-50.4	0	0	0	115.3
236	F	41.3	Very low	43.8	Very low	126 Å²	126	122.9 Å²	122.9	55%	0.553	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.5	-0.4	175.2	-112.1	-84.1	0	0	0	118	K202 D234	K202-F236 HydrophobicContact CB-CE2 4.03Å; K202-F236 HydrophobicContact CB-CZ 3.95Å; K202-F236 HydrophobicContact CD-CD2 4.16Å; K202-F236 HydrophobicContact CD-CE1 4.09Å; K202-F236 HydrophobicContact CD-CE2 3.45Å; K202-F236 VanDerWaalsContact CD-CE2 3.45Å; K202-F236 HydrophobicContact CD-CZ 3.43Å; K202-F236 VanDerWaalsContact CD-CZ 3.43Å; K202-F236 VanDerWaalsContact CE-CE1 3.46Å; K202-F236 HydrophobicContact CG-CE1 4.32Å; K202-F236 HydrophobicContact CG-CE2 3.89Å; K202-F236 HydrophobicContact CG-CZ 3.5Å; K202-F236 VanDerWaalsContact CG-CZ 3.5Å; K202-F236 VanDerWaalsContact NZ-CE1 3.32Å; D234-F236 PolarHBondContact O-N 3.1Å
237	D	46.7	Very low	44.3	Very low	153 Å²	153	124.7 Å²	124.7	82%	0.818	71%	0.705	S	S	*	*	S	Bend	trans	-149.2	6.2	178.7	-119.3	-26.6	0	0	0	113.9
238	A	45	Very low	44.7	Very low	81 Å²	81	125.8 Å²	125.8	67%	0.669	70%	0.695	S	S	*	*	S	Bend	trans	-89.6	-32.5	-161.7	0	0	0	0	0	116.1
239	E	44.5	Very low	45.3	Very low	187 Å²	187	129.2 Å²	129.2	87%	0.874	70%	0.701	S	S	*	*	S	Bend	trans	-111.4	-26.2	-161.6	-159.2	159.1	-132.5	0	0	115.4
240	D	42.6	Very low	45.8	Very low	106 Å²	106	125.7 Å²	125.7	57%	0.567	69%	0.689	S	S	*	*	S	Bend	trans	-91.8	-27.1	175.7	-109.3	-29.8	0	0	0	113.5	D242 K243 Y244	D240-D242 PolarHBondContact O-N 2.91Å; D240-K243 PolarHBondContact O-N 3.46Å; D240-Y244 PolarHBondContact O-N 3.11Å; D240-Y244 WeakPolarHBondContact OD1-CE2 3.42Å
241	G	46.2	Very low	45.9	Very low	56 Å²	56	125.9 Å²	125.9	58%	0.577	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-28.5	-168.5	0	0	0	0	0	115.6	K243	G241-K243 VanDerWaalsContact C-N 3.35Å
242	D	49.5	Very low	46.4	Very low	129 Å²	129	125.4 Å²	125.4	69%	0.69	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	1.3	-178.8	-149	48.6	0	0	0	112.7	D240 K603	D240-D242 PolarHBondContact O-N 2.91Å; D242-K603 VanDerWaalsContact CG-NZ 3.27Å; D242-K603 IonicContact OD1-NZ 2.71Å; D242-K603 PolarHBondContact OD1-NZ 3.2Å; D242-K603 IonicContact OD2-NZ 3.23Å; D242-K603 PolarHBondContact OD2-NZ 3.15Å
243	K	48.2	Very low	46.2	Very low	137 Å²	137	126.1 Å²	126.1	60%	0.596	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-42.1	-178.1	-167.2	-179.9	-178.9	-173.6	0	113.3	D240 G241 G245	D240-K243 PolarHBondContact O-N 3.46Å; G241-K243 VanDerWaalsContact C-N 3.35Å; K243-G245 PolarHBondContact O-N 2.74Å
244	Y	51.4	Low	46	Very low	155 Å²	155	130.3 Å²	130.3	61%	0.608	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-6.1	179.6	-83.1	-84.8	0	0	0	114.9	D240 L248	D240-Y244 PolarHBondContact O-N 3.11Å; D240-Y244 WeakPolarHBondContact OD1-CE2 3.42Å; Y244-L248 HydrophobicContact CD1-CD1 3.81Å; Y244-L248 HydrophobicContact CE1-CD1 3.9Å
245	G	54.7	Low	46	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-9.7	-173.5	0	0	0	0	0	117.4	K243	K243-G245 PolarHBondContact O-N 2.74Å
246	D	51.3	Low	46.1	Very low	163 Å²	163	128.4 Å²	128.4	87%	0.872	69%	0.694	S	S	*	*	S	Bend	trans	-136.3	-6	-170.6	-124.3	-5	0	0	0	114
247	E	46.5	Very low	46.8	Very low	153 Å²	153	125.9 Å²	125.9	72%	0.715	69%	0.692	S	S	*	*	S	Bend	trans	-124.7	0.1	-166.8	-66.2	-167.1	149.3	0	0	117
248	L	45	Very low	47.3	Very low	132 Å²	132	127.7 Å²	127.7	69%	0.691	69%	0.693	S	S	*	*			trans	-109.3	71.1	173.3	-75.9	-176.9	0	0	0	113.1	Y244 M250	Y244-L248 HydrophobicContact CD1-CD1 3.81Å; Y244-L248 HydrophobicContact CE1-CD1 3.9Å; L248-M250 VanDerWaalsContact C-N 3.26Å; L248-M250 PolarHBondContact O-N 3.36Å
249	D	45.9	Very low	47.7	Very low	161 Å²	161	130.8 Å²	130.8	86%	0.861	69%	0.694	S	S	*	*			trans	-72.5	80.3	163.3	-171.9	18.8	0	0	0	109.7	P251	D249-P251 VanDerWaalsContact O-CD 3.31Å; D249-P251 WeakPolarHBondContact O-CD 3.49Å
250	M	48.1	Very low	48	Very low	120 Å²	120	130.6 Å²	130.6	59%	0.591	69%	0.685	S	S	*	*			trans	-72.6	114.3	-173.9	-169.1	-169.7	76.4	0	0	111	L248 G252 Q253	L248-M250 VanDerWaalsContact C-N 3.26Å; L248-M250 PolarHBondContact O-N 3.36Å; M250-G252 PolarHBondContact O-N 3.23Å; M250-Q253 HydrophobicContact CE-CB 4.24Å
251	P	40.2	Very low	48.5	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	102.4	-172.2	29.2	-34.9	0	0	0	111.3	D249	D249-P251 VanDerWaalsContact O-CD 3.31Å; D249-P251 WeakPolarHBondContact O-CD 3.49Å
252	G	47.1	Very low	48.6	Very low	78 Å²	78	133.4 Å²	133.4	80%	0.804	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.4	-27.4	172.9	0	0	0	0	0	114.8	M250	M250-G252 PolarHBondContact O-N 3.23Å
253	Q	44.1	Very low	49	Very low	135 Å²	135	135.2 Å²	135.2	63%	0.631	70%	0.698	S	S	*	*			trans	-119.1	100.4	-175	-161.4	156.3	31.9	0	0	111.4	M250 F255	M250-Q253 HydrophobicContact CE-CB 4.24Å; Q253-F255 PolarHBondContact O-N 2.69Å
254	K	41.6	Very low	49.9	Very low	208 Å²	208	137.3 Å²	137.3	90%	0.904	70%	0.702	S	S	*	*			trans	-63	100.7	-178.6	-64.9	-171	179.3	-176.2	0	110.8	D256	K254-D256 PolarHBondContact O-N 2.99Å
255	F	42.8	Very low	50.8	Low	156 Å²	156	136.3 Å²	136.3	68%	0.684	71%	0.708	S	S	*	*			trans	-75.5	71.6	176.9	-169.6	-95.6	0	0	0	110.5	Q253 S257	Q253-F255 PolarHBondContact O-N 2.69Å; F255-S257 PolarHBondContact O-N 2.91Å
256	D	44.6	Very low	52	Low	64 Å²	64	141.6 Å²	141.6	34%	0.342	72%	0.719	S	S	.	*			trans	-69.4	100.3	172.3	-170.1	-8.8	0	0	0	109.4	K254 K258 Q259 R260	K254-D256 PolarHBondContact O-N 2.99Å; D256-K258 PolarHBondContact O-N 3.4Å; D256-K258 WeakPolarHBondContact OD1-CB 3.33Å; D256-K258 PolarHBondContact OD1-N 3.47Å; D256-Q259 HydrophobicContact CB-CB 4.3Å; D256-Q259 HydrophobicContact CB-CG 4.18Å; D256-Q259 PolarHBondContact O-N 2.95Å; D256-Q259 WeakPolarHBondContact OD2-CG 3.19Å; D256-Q259 PolarHBondContact OD2-NE2 2.89Å; D256-R260 PolarHBondContact O-N 2.98Å
257	S	56.2	Low	53.7	Low	73 Å²	73	141.9 Å²	141.9	51%	0.51	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.5	-16.6	-179.2	-58.3	0	0	0	0	113.1	F255	F255-S257 PolarHBondContact O-N 2.91Å
258	K	57.4	Low	55.7	Low	190 Å²	190	139.2 Å²	139.2	83%	0.826	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-24	175.5	-60.9	176.9	177	178.4	0	113.4	D256	D256-K258 PolarHBondContact O-N 3.4Å; D256-K258 WeakPolarHBondContact OD1-CB 3.33Å; D256-K258 PolarHBondContact OD1-N 3.47Å
259	Q	55.1	Low	57.8	Low	147 Å²	147	143.9 Å²	143.9	69%	0.687	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-18.1	-170.7	-61.9	-175.4	24.5	0	0	113.9	D256	D256-Q259 HydrophobicContact CB-CB 4.3Å; D256-Q259 HydrophobicContact CB-CG 4.18Å; D256-Q259 PolarHBondContact O-N 2.95Å; D256-Q259 WeakPolarHBondContact OD2-CG 3.19Å; D256-Q259 PolarHBondContact OD2-NE2 2.89Å
260	R	50.2	Low	59.9	Low	182 Å²	182	143.6 Å²	143.6	69%	0.687	70%	0.7	S	S	*	*	S	Bend	trans	-100.6	16.6	-178.7	-91.6	-174.8	172.2	-89.5	1.3	116	D256	D256-R260 PolarHBondContact O-N 2.98Å
261	Q	53.6	Low	62	Low	122 Å²	122	142.8 Å²	142.8	57%	0.57	70%	0.698	S	S	*	*			trans	-99.8	25	169.9	-63.7	-159	22	0	0	113.9	I263 R264	Q261-I263 PolarHBondContact O-N 3.34Å; Q261-R264 HydrophobicContact CB-CB 4.39Å; Q261-R264 PolarHBondContact O-N 3.09Å
262	S	47.7	Very low	64.5	Low	100 Å²	100	140.8 Å²	140.8	70%	0.699	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	121.1	165.2	38.7	0	0	0	0	109.7
263	I	58.4	Low	66.7	Low	166 Å²	166	138.1 Å²	138.1	85%	0.851	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.5	36.5	-176.4	-28.6	176.2	0	0	0	114.7	Q261	Q261-I263 PolarHBondContact O-N 3.34Å
264	R	66.2	Low	69.1	Low	181 Å²	181	134.2 Å²	134.2	68%	0.683	64%	0.635	S	S	*	*			trans	-80.6	126.6	146.1	-166.5	174.9	-175.8	90.8	-2	107.9	Q261 L266	Q261-R264 HydrophobicContact CB-CB 4.39Å; Q261-R264 PolarHBondContact O-N 3.09Å; R264-L266 PolarHBondContact O-N 2.94Å
265	N	69.7	Low	71.6	Confident	135 Å²	135	129 Å²	129	72%	0.722	61%	0.61	S	S	*	*			trans	-53.6	123.2	-179	-74.5	-27.7	0	0	0	111	R267	N265-R267 PolarHBondContact O-N 3.09Å
266	L	79.6	Confident	74	Confident	178 Å²	178	125.5 Å²	125.5	93%	0.932	60%	0.598	S	S	*	*	S	Bend	trans	-67.6	-16.3	-175.4	-66	98.2	0	0	0	113.7	R264 I268	R264-L266 PolarHBondContact O-N 2.94Å; L266-I268 PolarHBondContact O-N 2.88Å
267	R	87	Confident	76.2	Confident	168 Å²	168	124.5 Å²	124.5	63%	0.634	59%	0.59	S	S	*	*	S	Bend	trans	-73.6	111.6	170.7	176.4	178.9	-74.7	-161.3	-2.3	109.3	N265 R269	N265-R267 PolarHBondContact O-N 3.09Å; R267-R269 PolarHBondContact O-N 3.16Å
268	I	88.8	Confident	77.9	Confident	97 Å²	97	123.1 Å²	123.1	50%	0.497	58%	0.578	S	S	.	*			trans	-51.6	128.4	162.4	-59	171.6	0	0	0	107.8	L266 E270 D271	L266-I268 PolarHBondContact O-N 2.88Å; I268-E270 HydrophobicContact CG2-CB 3.97Å; I268-E270 VanDerWaalsContact CG2-OE2 3.28Å; I268-E270 WeakPolarHBondContact CG2-OE2 3.36Å; I268-D271 HydrophobicContact CB-CB 4.33Å; I268-D271 WeakPolarHBondContact CD1-OD2 3.43Å; I268-D271 HydrophobicContact CG2-CB 4.21Å; I268-D271 WeakPolarHBondContact CG2-OD2 3.5Å
269	R	90.4	Very high	79.6	Confident	230 Å²	230	120.7 Å²	120.7	87%	0.868	57%	0.573	S	S	*	*	S	Bend	trans	-87.1	-23.3	-173.6	177.9	173.3	170.2	83.7	0	111.9	R267 D271	R267-R269 PolarHBondContact O-N 3.16Å; R269-D271 VanDerWaalsContact C-N 3.29Å
270	E	89.9	Confident	81.3	Confident	156 Å²	156	118.4 Å²	118.4	73%	0.729	57%	0.565	S	S	*	*	S	Bend	trans	-66.4	-32.6	174.8	-62.7	75.1	-174.4	0	0	111.4	I268	I268-E270 HydrophobicContact CG2-CB 3.97Å; I268-E270 VanDerWaalsContact CG2-OE2 3.28Å; I268-E270 WeakPolarHBondContact CG2-OE2 3.36Å
271	D	91	Very high	83.2	Confident	103 Å²	103	115.8 Å²	115.8	55%	0.551	57%	0.572	S	S	*	*	S	Bend	trans	-86.3	114.2	-179.9	-63.4	-23.2	0	0	0	110.8	I268 R269	I268-D271 HydrophobicContact CB-CB 4.33Å; I268-D271 WeakPolarHBondContact CD1-OD2 3.43Å; I268-D271 HydrophobicContact CG2-CB 4.21Å; I268-D271 WeakPolarHBondContact CG2-OD2 3.5Å; R269-D271 VanDerWaalsContact C-N 3.29Å
272	T	92.3	Very high	84.9	Confident	87 Å²	87	117.1 Å²	117.1	53%	0.534	58%	0.583	S	S	.	*			trans	-78.9	134.5	174.2	35.7	0	0	0	0	110.2	F277	T272-F277 WeakPolarHBondContact OG1-CE1 3.43Å
273	A	93.9	Very high	86.9	Confident	22 Å²	22	114.5 Å²	114.5	18%	0.182	56%	0.564	C	S	.	*			trans	-70.6	141.8	177.9	0	0	0	0	0	110.1	Y275 L276	A273-Y275 VanDerWaalsContact C-N 3.31Å; A273-Y275 HydrophobicContact CB-CD1 4.01Å; A273-Y275 HydrophobicContact CB-CE1 3.5Å; A273-Y275 VanDerWaalsContact CB-CE1 3.5Å; A273-Y275 PolarHBondContact O-N 2.91Å; A273-Y275 VanDerWaalsContact O-N 3.15Å; A273-L276 HydrophobicContact CB-CD1 4.07Å; A273-L276 HydrophobicContact CB-CG 4.32Å; A273-L276 WeakPolarHBondContact O-CA 3.3Å; A273-L276 WeakPolarHBondContact O-CB 3.42Å; A273-L276 PolarHBondContact O-N 3.49Å
274	K	94	Very high	88.5	Confident	54 Å²	54	107.3 Å²	107.3	24%	0.235	53%	0.53	C	S	.	.	G	3₁₀ helix	trans	-50.2	-46.1	-170.8	-66.6	-178.8	175.8	173.5	0	114	L276 F277 Y286 R291 M293 F310 D313	K274-L276 PolarHBondContact O-N 2.89Å; K274-L276 VanDerWaalsContact O-N 3.1Å; K274-F277 HydrophobicContact CG-CE2 4.48Å; K274-F277 WeakPolarHBondContact O-CB 3.28Å; K274-F277 VanDerWaalsContact O-CD2 3.27Å; K274-F277 WeakPolarHBondContact O-CD2 3.48Å; K274-F277 PolarHBondContact O-N 3.18Å; K274-Y286 HydrophobicContact CB-CD2 4.21Å; K274-Y286 HydrophobicContact CB-CE2 4.18Å; K274-Y286 HydrophobicContact CD-CE2 4.37Å; K274-R291 PolarHBondContact NZ-O 3.01Å; K274-M293 VanDerWaalsContact C-SD 3.53Å; K274-M293 HydrophobicContact CB-CE 3.9Å; K274-M293 HydrophobicContact CB-CG 3.74Å; K274-M293 HydrophobicContact CB-SD 3.74Å; K274-M293 HydrophobicContact CD-CB 4.48Å; K274-M293 HydrophobicContact CD-CG 4.19Å; K274-M293 VanDerWaalsContact O-CE 3.27Å; K274-M293 WeakPolarHBondContact O-CE 3.36Å; K274-F310 HydrophobicContact CD-CE1 4.19Å; K274-F310 HydrophobicContact CD-CE2 4.33Å; K274-F310 HydrophobicContact CD-CZ 3.81Å; K274-F310 HydrophobicContact CG-CE1 4.28Å; K274-F310 HydrophobicContact CG-CZ 4.3Å; K274-D313 IonicContact NZ-OD1 3.48Å; K274-D313 PolarHBondContact NZ-OD1 3.44Å; K274-D313 IonicContact NZ-OD2 3.68Å; K274-D313 PolarHBondContact NZ-OD2 3.18Å
275	Y	94.5	Very high	89.9	Confident	99 Å²	99	107.3 Å²	107.3	39%	0.388	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-71.6	5.4	178.1	66.8	-88.5	0	0	0	115.2	A273 Y286	A273-Y275 VanDerWaalsContact C-N 3.31Å; A273-Y275 HydrophobicContact CB-CD1 4.01Å; A273-Y275 HydrophobicContact CB-CE1 3.5Å; A273-Y275 VanDerWaalsContact CB-CE1 3.5Å; A273-Y275 PolarHBondContact O-N 2.91Å; A273-Y275 VanDerWaalsContact O-N 3.15Å; Y275-Y286 AromaticContact CD1-CD1 3.63Å; Y275-Y286 HydrophobicContact CD1-CD1 3.63Å; Y275-Y286 AromaticContact CD1-CE1 3.36Å; Y275-Y286 HydrophobicContact CD1-CE1 3.36Å; Y275-Y286 HydrophobicContact CD1-CE2 4.46Å; Y275-Y286 HydrophobicContact CD1-CG 4.31Å; Y275-Y286 AromaticContact CD1-CZ 3.81Å; Y275-Y286 AromaticContact CE1-CE1 3.95Å; Y275-Y286 HydrophobicContact CE1-CE1 3.95Å; Y275-Y286 AromaticContact CG-CD1 3.97Å; Y275-Y286 HydrophobicContact CG-CD1 3.97Å; Y275-Y286 HydrophobicContact CG-CE1 4.15Å
276	L	93.7	Very high	91.1	Very high	82 Å²	82	103.5 Å²	103.5	43%	0.429	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-112.9	0.1	174	-58.2	176.3	0	0	0	112.3	A273 K274 L279	A273-L276 HydrophobicContact CB-CD1 4.07Å; A273-L276 HydrophobicContact CB-CG 4.32Å; A273-L276 WeakPolarHBondContact O-CA 3.3Å; A273-L276 WeakPolarHBondContact O-CB 3.42Å; A273-L276 PolarHBondContact O-N 3.49Å; K274-L276 PolarHBondContact O-N 2.89Å; K274-L276 VanDerWaalsContact O-N 3.1Å; L276-L279 HydrophobicContact CD2-CD2 3.9Å
277	F	91.1	Very high	91.8	Very high	42 Å²	42	96.9 Å²	96.9	18%	0.184	47%	0.473	C	S	.	.	S	Bend	trans	-69	-36.5	173.2	-77.3	-51.5	0	0	0	112.3	T272 K274 M293 P297 F298 P309 F310	T272-F277 WeakPolarHBondContact OG1-CE1 3.43Å; K274-F277 HydrophobicContact CG-CE2 4.48Å; K274-F277 WeakPolarHBondContact O-CB 3.28Å; K274-F277 VanDerWaalsContact O-CD2 3.27Å; K274-F277 WeakPolarHBondContact O-CD2 3.48Å; K274-F277 PolarHBondContact O-N 3.18Å; F277-M293 HydrophobicContact CD2-CE 4.47Å; F277-P297 HydrophobicContact CB-CB 3.96Å; F277-P297 HydrophobicContact CB-CG 3.67Å; F277-P297 HydrophobicContact CD2-CG 4.18Å; F277-P297 HydrophobicContact CG-CG 4.26Å; F277-F298 HydrophobicContact CB-CE1 4.4Å; F277-F298 HydrophobicContact CB-CE2 3.96Å; F277-F298 HydrophobicContact CB-CZ 3.64Å; F277-F298 HydrophobicContact CD1-CE2 4.09Å; F277-F298 AromaticContact CD1-CZ 3.77Å; F277-F298 HydrophobicContact CD1-CZ 3.77Å; F277-F298 HydrophobicContact CG-CE2 4.03Å; F277-F298 AromaticContact CG-CZ 3.92Å; F277-F298 HydrophobicContact CG-CZ 3.92Å; F277-P309 HydrophobicContact CE1-CB 4.08Å; F277-P309 HydrophobicContact CE1-CG 4.46Å; F277-P309 HydrophobicContact CZ-CB 4.4Å; F277-F310 HydrophobicContact CD2-CB 4.11Å; F277-F310 AromaticContact CD2-CD1 3.9Å; F277-F310 HydrophobicContact CD2-CD1 3.9Å; F277-F310 HydrophobicContact CD2-CG 4.31Å; F277-F310 HydrophobicContact CE2-CB 3.42Å; F277-F310 VanDerWaalsContact CE2-CB 3.42Å; F277-F310 AromaticContact CE2-CD1 3.77Å; F277-F310 HydrophobicContact CE2-CD1 3.77Å; F277-F310 AromaticContact CE2-CG 3.75Å; F277-F310 HydrophobicContact CE2-CG 3.75Å; F277-F310 HydrophobicContact CZ-CB 3.73Å; F277-F310 HydrophobicContact CZ-CG 4.48Å
278	N	91.2	Very high	92.3	Very high	45 Å²	45	93.1 Å²	93.1	24%	0.241	47%	0.472	C	S	.	.			trans	-133.9	142.6	165.4	-168	-8.9	0	0	0	108	D280 P297	N278-D280 PolarHBondContact ND2-OD2 3.36Å; N278-D280 WeakPolarHBondContact OD1-CB 3.27Å; N278-D280 PolarHBondContact OD1-N 3.19Å; N278-D280 PolarHBondContact OD1-OD2 2.63Å; N278-P297 HydrophobicContact CB-CB 4.09Å; N278-P297 WeakPolarHBondContact CB-O 3.47Å; N278-P297 PolarHBondContact ND2-O 2.85Å
279	L	92.5	Very high	92.6	Very high	138 Å²	138	96.7 Å²	96.7	72%	0.723	48%	0.484	S	S	*	.			trans	-103.2	-5.9	178	-61.7	176.3	0	0	0	112.4	L276	L276-L279 HydrophobicContact CD2-CD2 3.9Å
280	D	92.3	Very high	92.9	Very high	99 Å²	99	90.3 Å²	90.3	53%	0.529	47%	0.471	S	S	.	.			trans	-61.8	128.2	173.3	-59.5	-34.5	0	0	0	109.8	N278 N282 S283	N278-D280 PolarHBondContact ND2-OD2 3.36Å; N278-D280 WeakPolarHBondContact OD1-CB 3.27Å; N278-D280 PolarHBondContact OD1-N 3.19Å; N278-D280 PolarHBondContact OD1-OD2 2.63Å; D280-N282 PolarHBondContact O-N 2.92Å; D280-N282 VanDerWaalsContact O-N 3.15Å; D280-S283 WeakPolarHBondContact O-CB 3.44Å; D280-S283 PolarHBondContact O-N 3.33Å; D280-S283 VanDerWaalsContact O-N 3.15Å; D280-S283 PolarHBondContact O-OG 2.83Å
281	P	90.4	Very high	93.1	Very high	127 Å²	127	90.7 Å²	90.7	83%	0.825	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.8	-177.8	27.4	-35.5	0	0	0	113.1
282	N	89	Confident	93.3	Very high	151 Å²	151	86.4 Å²	86.4	81%	0.807	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	20.9	179.9	-60.1	-8	0	0	0	112.5	D280	D280-N282 PolarHBondContact O-N 2.92Å; D280-N282 VanDerWaalsContact O-N 3.15Å
283	S	89.1	Confident	93.3	Very high	44 Å²	44	82.3 Å²	82.3	31%	0.308	42%	0.419	S	S	.	.	S	Bend	trans	-86.9	-143.4	174.8	66.4	0	0	0	0	111.7	D280	D280-S283 WeakPolarHBondContact O-CB 3.44Å; D280-S283 PolarHBondContact O-N 3.33Å; D280-S283 VanDerWaalsContact O-N 3.15Å; D280-S283 PolarHBondContact O-OG 2.83Å
284	A	92.1	Very high	93.3	Very high	16 Å²	16	88.4 Å²	88.4	13%	0.132	44%	0.438	C	S	.	.			trans	-79.9	123.9	-177.7	0	0	0	0	0	112	Y286 M293 G295 P297	A284-Y286 PolarHBondContact O-N 3.19Å; A284-M293 HydrophobicContact CB-CE 4.06Å; A284-M293 HydrophobicContact CB-SD 4.34Å; A284-G295 WeakPolarHBondContact CB-O 3.47Å; A284-P297 HydrophobicContact CB-CB 4.17Å
285	Y	94.7	Very high	93.2	Very high	180 Å²	180	87.1 Å²	87.1	71%	0.706	44%	0.44	S	S	*	.			trans	-62.6	122.8	177.5	178.2	-100.2	0	0	0	112.5	D287 M293	Y285-D287 HydrophobicContact CE1-CB 3.99Å; Y285-M293 WeakPolarHBondContact O-CA 3.26Å
286	Y	95.9	Very high	93	Very high	56 Å²	56	84.1 Å²	84.1	22%	0.22	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	114.1	171.5	-179.2	-118.5	0	0	0	111.2	K274 Y275 A284 S288 R291 A292 M293	K274-Y286 HydrophobicContact CB-CD2 4.21Å; K274-Y286 HydrophobicContact CB-CE2 4.18Å; K274-Y286 HydrophobicContact CD-CE2 4.37Å; Y275-Y286 AromaticContact CD1-CD1 3.63Å; Y275-Y286 HydrophobicContact CD1-CD1 3.63Å; Y275-Y286 AromaticContact CD1-CE1 3.36Å; Y275-Y286 HydrophobicContact CD1-CE1 3.36Å; Y275-Y286 HydrophobicContact CD1-CE2 4.46Å; Y275-Y286 HydrophobicContact CD1-CG 4.31Å; Y275-Y286 AromaticContact CD1-CZ 3.81Å; Y275-Y286 AromaticContact CE1-CE1 3.95Å; Y275-Y286 HydrophobicContact CE1-CE1 3.95Å; Y275-Y286 AromaticContact CG-CD1 3.97Å; Y275-Y286 HydrophobicContact CG-CD1 3.97Å; Y275-Y286 HydrophobicContact CG-CE1 4.15Å; A284-Y286 PolarHBondContact O-N 3.19Å; Y286-S288 PolarHBondContact O-N 3.07Å; Y286-R291 VanDerWaalsContact CE2-C 3.44Å; Y286-R291 HydrophobicContact CE2-CB 4.23Å; Y286-R291 WeakPolarHBondContact OH-CB 3.3Å; Y286-A292 WeakPolarHBondContact CA-O 3.19Å; Y286-A292 WeakPolarHBondContact CD2-O 3.27Å; Y286-M293 HydrophobicContact CD2-CG 3.5Å; Y286-M293 VanDerWaalsContact CD2-CG 3.5Å; Y286-M293 HydrophobicContact CD2-SD 4.33Å; Y286-M293 HydrophobicContact CG-CG 4.05Å; Y286-M293 HydrophobicContact CG-SD 4.47Å
287	D	95.1	Very high	92.9	Very high	39 Å²	39	80.4 Å²	80.4	21%	0.209	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	109	164.9	173.4	23.5	0	0	0	109.2	Y285 K289 T290 R291 A292	Y285-D287 HydrophobicContact CE1-CB 3.99Å; D287-K289 PolarHBondContact O-N 3.29Å; D287-K289 WeakPolarHBondContact OD1-CA 3.49Å; D287-K289 WeakPolarHBondContact OD1-CB 3.45Å; D287-K289 PolarHBondContact OD1-N 3.27Å; D287-T290 WeakPolarHBondContact OD2-CB 3.44Å; D287-T290 WeakPolarHBondContact OD2-CG2 3.49Å; D287-T290 PolarHBondContact OD2-N 2.81Å; D287-T290 PolarHBondContact OD2-OG1 3.44Å; D287-R291 WeakPolarHBondContact O-CA 3.46Å; D287-R291 PolarHBondContact O-N 3.37Å; D287-A292 PolarHBondContact N-O 2.87Å; D287-A292 PolarHBondContact O-N 3.26Å
288	S	95.5	Very high	92.8	Very high	89 Å²	89	79.7 Å²	79.7	62%	0.622	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-18.8	177.2	62	0	0	0	0	113.7	Y286	Y286-S288 PolarHBondContact O-N 3.07Å
289	K	96.6	Very high	92.4	Very high	171 Å²	171	83.8 Å²	83.8	74%	0.743	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-56.8	177.7	-168.4	-172.7	179.6	75.4	0	111	D287 R291	D287-K289 PolarHBondContact O-N 3.29Å; D287-K289 WeakPolarHBondContact OD1-CA 3.49Å; D287-K289 WeakPolarHBondContact OD1-CB 3.45Å; D287-K289 PolarHBondContact OD1-N 3.27Å; K289-R291 PolarHBondContact O-NH1 3.18Å; K289-R291 VanDerWaalsContact O-NH1 3.11Å
290	T	95.4	Very high	91.9	Very high	96 Å²	96	85 Å²	85	59%	0.589	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-15.1	177.1	61.9	0	0	0	0	114.1	D287 A292	D287-T290 WeakPolarHBondContact OD2-CB 3.44Å; D287-T290 WeakPolarHBondContact OD2-CG2 3.49Å; D287-T290 PolarHBondContact OD2-N 2.81Å; D287-T290 PolarHBondContact OD2-OG1 3.44Å; T290-A292 VanDerWaalsContact C-N 3.34Å
291	R	94.9	Very high	91.3	Very high	165 Å²	165	82.8 Å²	82.8	62%	0.623	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	33.3	-176	-55	167.8	-179.5	71.2	-3.2	113.4	K274 Y286 D287 K289	K274-R291 PolarHBondContact NZ-O 3.01Å; Y286-R291 VanDerWaalsContact CE2-C 3.44Å; Y286-R291 HydrophobicContact CE2-CB 4.23Å; Y286-R291 WeakPolarHBondContact OH-CB 3.3Å; D287-R291 WeakPolarHBondContact O-CA 3.46Å; D287-R291 PolarHBondContact O-N 3.37Å; K289-R291 PolarHBondContact O-NH1 3.18Å; K289-R291 VanDerWaalsContact O-NH1 3.11Å
292	A	94.4	Very high	90.7	Very high	12 Å²	12	80.3 Å²	80.3	10%	0.099	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145.1	179.1	0	0	0	0	0	112.5	Y286 D287 T290 D313	Y286-A292 WeakPolarHBondContact CA-O 3.19Å; Y286-A292 WeakPolarHBondContact CD2-O 3.27Å; D287-A292 PolarHBondContact N-O 2.87Å; D287-A292 PolarHBondContact O-N 3.26Å; T290-A292 VanDerWaalsContact C-N 3.34Å; A292-D313 WeakPolarHBondContact CA-OD2 3.31Å; A292-D313 WeakPolarHBondContact CB-OD2 3.27Å
293	M	94	Very high	90.3	Very high	2 Å²	2	78.7 Å²	78.7	1%	0.01	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	116.6	160.7	-62.5	-156.2	-37.9	0	0	107.9	K274 F277 A284 Y285 Y286 P297 F310 D313	K274-M293 VanDerWaalsContact C-SD 3.53Å; K274-M293 HydrophobicContact CB-CE 3.9Å; K274-M293 HydrophobicContact CB-CG 3.74Å; K274-M293 HydrophobicContact CB-SD 3.74Å; K274-M293 HydrophobicContact CD-CB 4.48Å; K274-M293 HydrophobicContact CD-CG 4.19Å; K274-M293 VanDerWaalsContact O-CE 3.27Å; K274-M293 WeakPolarHBondContact O-CE 3.36Å; F277-M293 HydrophobicContact CD2-CE 4.47Å; A284-M293 HydrophobicContact CB-CE 4.06Å; A284-M293 HydrophobicContact CB-SD 4.34Å; Y285-M293 WeakPolarHBondContact O-CA 3.26Å; Y286-M293 HydrophobicContact CD2-CG 3.5Å; Y286-M293 VanDerWaalsContact CD2-CG 3.5Å; Y286-M293 HydrophobicContact CD2-SD 4.33Å; Y286-M293 HydrophobicContact CG-CG 4.05Å; Y286-M293 HydrophobicContact CG-SD 4.47Å; M293-P297 HydrophobicContact CE-CB 3.78Å; M293-P297 HydrophobicContact CE-CG 3.56Å; M293-F310 HydrophobicContact CB-CE1 4.12Å; M293-F310 HydrophobicContact CB-CZ 4.45Å; M293-F310 HydrophobicContact CE-CD1 4.2Å; M293-F310 HydrophobicContact CE-CE1 3.8Å; M293-D313 PolarHBondContact N-OD2 3.1Å; M293-D313 WeakPolarHBondContact O-CB 3.48Å; M293-D313 PolarHBondContact O-N 2.91Å; M293-D313 VanDerWaalsContact O-OD2 3.13Å
294	R	92.8	Very high	89.6	Confident	150 Å²	150	79.7 Å²	79.7	57%	0.566	41%	0.414	S	S	*	.			trans	-74.5	-51.9	-179.5	-93.1	99.8	72.9	71.8	-5.1	112.5	N314	R294-N314 WeakPolarHBondContact CG-OD1 3.47Å; R294-N314 VanDerWaalsContact O-CB 3.3Å; R294-N314 WeakPolarHBondContact O-CB 3.32Å; R294-N314 PolarHBondContact O-N 3.2Å
295	G	91.4	Very high	88.7	Confident	27 Å²	27	85.9 Å²	85.9	28%	0.278	44%	0.44	S	S	.	.	S	Bend	trans	-73.6	169.5	176.7	0	0	0	0	0	113.2	A284 G312	A284-G295 WeakPolarHBondContact CB-O 3.47Å; G295-G312 VanDerWaalsContact O-CA 3.31Å; G295-G312 WeakPolarHBondContact O-CA 3.48Å
296	N	91	Very high	87.7	Confident	35 Å²	35	82.8 Å²	82.8	19%	0.187	44%	0.444	C	S	.	.			trans	-93	121.3	179.6	171	8.2	0	0	0	109.5	F298 E299 A311	N296-F298 PolarHBondContact O-N 2.83Å; N296-F298 WeakPolarHBondContact OD1-CB 3.5Å; N296-F298 PolarHBondContact OD1-N 3.09Å; N296-E299 WeakPolarHBondContact CA-OE1 3.49Å; N296-E299 HydrophobicContact CB-CG 3.81Å; N296-E299 WeakPolarHBondContact CB-OE1 3.29Å; N296-E299 PolarHBondContact N-OE1 2.89Å; N296-E299 VanDerWaalsContact O-CG 3.31Å; N296-E299 WeakPolarHBondContact O-CG 3.48Å; N296-E299 PolarHBondContact O-N 3.15Å; N296-A311 WeakPolarHBondContact CB-O 3.13Å
297	P	91.6	Very high	86.8	Confident	5 Å²	5	86.7 Å²	86.7	3%	0.032	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-8.8	-178.1	27.9	-34.7	0	0	0	114.1	F277 N278 A284 M293 F310	F277-P297 HydrophobicContact CB-CB 3.96Å; F277-P297 HydrophobicContact CB-CG 3.67Å; F277-P297 HydrophobicContact CD2-CG 4.18Å; F277-P297 HydrophobicContact CG-CG 4.26Å; N278-P297 HydrophobicContact CB-CB 4.09Å; N278-P297 WeakPolarHBondContact CB-O 3.47Å; N278-P297 PolarHBondContact ND2-O 2.85Å; A284-P297 HydrophobicContact CB-CB 4.17Å; M293-P297 HydrophobicContact CE-CB 3.78Å; M293-P297 HydrophobicContact CE-CG 3.56Å; P297-F310 HydrophobicContact CG-CD1 4.32Å
298	F	88.4	Confident	86.1	Confident	27 Å²	27	85.9 Å²	85.9	12%	0.118	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	5.4	-174	-61.5	-69.1	0	0	0	115	F277 N296 N300 S301 V308	F277-F298 HydrophobicContact CB-CE1 4.4Å; F277-F298 HydrophobicContact CB-CE2 3.96Å; F277-F298 HydrophobicContact CB-CZ 3.64Å; F277-F298 HydrophobicContact CD1-CE2 4.09Å; F277-F298 AromaticContact CD1-CZ 3.77Å; F277-F298 HydrophobicContact CD1-CZ 3.77Å; F277-F298 HydrophobicContact CG-CE2 4.03Å; F277-F298 AromaticContact CG-CZ 3.92Å; F277-F298 HydrophobicContact CG-CZ 3.92Å; N296-F298 PolarHBondContact O-N 2.83Å; N296-F298 WeakPolarHBondContact OD1-CB 3.5Å; N296-F298 PolarHBondContact OD1-N 3.09Å; F298-N300 VanDerWaalsContact C-N 3.34Å; F298-N300 PolarHBondContact O-N 2.88Å; F298-S301 WeakPolarHBondContact CB-OG 3.47Å; F298-S301 VanDerWaalsContact O-CB 3.3Å; F298-S301 WeakPolarHBondContact O-CB 3.31Å; F298-S301 PolarHBondContact O-N 3.11Å; F298-S301 PolarHBondContact O-OG 3.05Å; F298-V308 HydrophobicContact CB-CG2 4.15Å; F298-V308 HydrophobicContact CD2-CB 4.39Å; F298-V308 HydrophobicContact CD2-CG1 3.47Å; F298-V308 VanDerWaalsContact CD2-CG1 3.47Å; F298-V308 HydrophobicContact CD2-CG2 4.23Å; F298-V308 HydrophobicContact CE2-CG1 3.97Å; F298-V308 HydrophobicContact CG-CG1 4.31Å; F298-V308 HydrophobicContact CG-CG2 4.29Å
299	E	83.5	Confident	85.6	Confident	130 Å²	130	86.5 Å²	86.5	61%	0.607	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-48	-49.8	-174.9	-73.8	161.6	-158	0	0	113.2	N296 S301	N296-E299 WeakPolarHBondContact CA-OE1 3.49Å; N296-E299 HydrophobicContact CB-CG 3.81Å; N296-E299 WeakPolarHBondContact CB-OE1 3.29Å; N296-E299 PolarHBondContact N-OE1 2.89Å; N296-E299 VanDerWaalsContact O-CG 3.31Å; N296-E299 WeakPolarHBondContact O-CG 3.48Å; N296-E299 PolarHBondContact O-N 3.15Å; E299-S301 VanDerWaalsContact C-N 3.29Å; E299-S301 PolarHBondContact O-N 3.05Å
300	N	82.6	Confident	85.3	Confident	165 Å²	165	79.9 Å²	79.9	88%	0.882	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-80.7	1.3	-179.7	-63.6	-30.1	0	0	0	114.7	F298	F298-N300 VanDerWaalsContact C-N 3.34Å; F298-N300 PolarHBondContact O-N 2.88Å
301	S	80	Confident	85.1	Confident	51 Å²	51	76.4 Å²	76.4	36%	0.357	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-90.6	-7	-169.4	76.3	0	0	0	0	115.4	F298 E299 K303	F298-S301 WeakPolarHBondContact CB-OG 3.47Å; F298-S301 VanDerWaalsContact O-CB 3.3Å; F298-S301 WeakPolarHBondContact O-CB 3.31Å; F298-S301 PolarHBondContact O-N 3.11Å; F298-S301 PolarHBondContact O-OG 3.05Å; E299-S301 VanDerWaalsContact C-N 3.29Å; E299-S301 PolarHBondContact O-N 3.05Å; S301-K303 PolarHBondContact O-N 3.47Å; S301-K303 VanDerWaalsContact O-N 3.08Å
302	G	76.4	Confident	84.9	Confident	75 Å²	75	68.6 Å²	68.6	77%	0.773	39%	0.386	S	S	*	.			trans	65.6	6	178.7	0	0	0	0	0	115.9
303	K	80.2	Confident	84.8	Confident	117 Å²	117	69.3 Å²	69.3	51%	0.509	39%	0.389	S	S	.	.			trans	-76.6	138.2	-179.9	-66.1	173.1	-174.1	169.5	0	110.8	S301 V308	S301-K303 PolarHBondContact O-N 3.47Å; S301-K303 VanDerWaalsContact O-N 3.08Å; K303-V308 HydrophobicContact CB-CG2 4.3Å
304	P	75.3	Confident	84.7	Confident	65 Å²	65	72.8 Å²	72.8	42%	0.422	41%	0.407	S	S	.	.			trans	-66.8	144.1	174.8	29.8	-34.7	0	0	0	110.4	S306 E307	P304-S306 PolarHBondContact O-N 3.32Å; P304-E307 HydrophobicContact CG-CB 4.28Å; P304-E307 HydrophobicContact CG-CG 3.95Å; P304-E307 PolarHBondContact O-N 2.96Å
305	E	72.2	Confident	84.6	Confident	146 Å²	146	70.3 Å²	70.3	68%	0.682	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-52.1	-34.5	-176.7	-62.4	171.3	167.4	0	0	113	E307 V308	E305-E307 PolarHBondContact O-N 3.03Å; E305-E307 VanDerWaalsContact O-N 3.14Å; E305-V308 WeakPolarHBondContact O-CB 3.3Å; E305-V308 PolarHBondContact O-N 3.42Å; E305-V308 VanDerWaalsContact O-N 3.09Å
306	S	75.5	Confident	84.6	Confident	115 Å²	115	73.3 Å²	73.3	80%	0.804	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-63.5	-15.1	177.1	58.4	0	0	0	0	115.4	P304	P304-S306 PolarHBondContact O-N 3.32Å
307	E	75.9	Confident	84.6	Confident	138 Å²	138	77.7 Å²	77.7	65%	0.645	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-106.2	-6	177.2	-65	-178.3	-177.5	0	0	112.6	P304 E305 P309	P304-E307 HydrophobicContact CG-CB 4.28Å; P304-E307 HydrophobicContact CG-CG 3.95Å; P304-E307 PolarHBondContact O-N 2.96Å; E305-E307 PolarHBondContact O-N 3.03Å; E305-E307 VanDerWaalsContact O-N 3.14Å; E307-P309 WeakPolarHBondContact O-CD 3.49Å
308	V	81	Confident	84.6	Confident	23 Å²	23	84.5 Å²	84.5	14%	0.139	45%	0.453	C	S	.	.			trans	-84.6	121.1	-179.4	166.6	0	0	0	0	110.1	F298 K303 E305 F310 A311	F298-V308 HydrophobicContact CB-CG2 4.15Å; F298-V308 HydrophobicContact CD2-CB 4.39Å; F298-V308 HydrophobicContact CD2-CG1 3.47Å; F298-V308 VanDerWaalsContact CD2-CG1 3.47Å; F298-V308 HydrophobicContact CD2-CG2 4.23Å; F298-V308 HydrophobicContact CE2-CG1 3.97Å; F298-V308 HydrophobicContact CG-CG1 4.31Å; F298-V308 HydrophobicContact CG-CG2 4.29Å; K303-V308 HydrophobicContact CB-CG2 4.3Å; E305-V308 WeakPolarHBondContact O-CB 3.3Å; E305-V308 PolarHBondContact O-N 3.42Å; E305-V308 VanDerWaalsContact O-N 3.09Å; V308-F310 VanDerWaalsContact C-N 3.25Å; V308-F310 VanDerWaalsContact CG1-C 3.47Å; V308-F310 VanDerWaalsContact CG1-O 3.3Å; V308-F310 WeakPolarHBondContact CG1-O 3.49Å; V308-F310 PolarHBondContact O-N 2.62Å; V308-A311 HydrophobicContact CG1-CB 4.25Å
309	P	85.4	Confident	84.6	Confident	102 Å²	102	86.9 Å²	86.9	66%	0.662	47%	0.467	S	S	*	.	S	Bend	trans	-68.8	-21	179.4	-21.7	34	0	0	0	114.6	F277 E307	F277-P309 HydrophobicContact CE1-CB 4.08Å; F277-P309 HydrophobicContact CE1-CG 4.46Å; F277-P309 HydrophobicContact CZ-CB 4.4Å; E307-P309 WeakPolarHBondContact O-CD 3.49Å
310	F	89.9	Confident	85	Confident	31 Å²	31	83 Å²	83	14%	0.136	46%	0.462	C	S	.	.			trans	-159.6	112.1	-175.6	174.8	-100.7	0	0	0	110.3	K274 F277 M293 P297 V308 G312 D313	K274-F310 HydrophobicContact CD-CE1 4.19Å; K274-F310 HydrophobicContact CD-CE2 4.33Å; K274-F310 HydrophobicContact CD-CZ 3.81Å; K274-F310 HydrophobicContact CG-CE1 4.28Å; K274-F310 HydrophobicContact CG-CZ 4.3Å; F277-F310 HydrophobicContact CD2-CB 4.11Å; F277-F310 AromaticContact CD2-CD1 3.9Å; F277-F310 HydrophobicContact CD2-CD1 3.9Å; F277-F310 HydrophobicContact CD2-CG 4.31Å; F277-F310 HydrophobicContact CE2-CB 3.42Å; F277-F310 VanDerWaalsContact CE2-CB 3.42Å; F277-F310 AromaticContact CE2-CD1 3.77Å; F277-F310 HydrophobicContact CE2-CD1 3.77Å; F277-F310 AromaticContact CE2-CG 3.75Å; F277-F310 HydrophobicContact CE2-CG 3.75Å; F277-F310 HydrophobicContact CZ-CB 3.73Å; F277-F310 HydrophobicContact CZ-CG 4.48Å; M293-F310 HydrophobicContact CB-CE1 4.12Å; M293-F310 HydrophobicContact CB-CZ 4.45Å; M293-F310 HydrophobicContact CE-CD1 4.2Å; M293-F310 HydrophobicContact CE-CE1 3.8Å; P297-F310 HydrophobicContact CG-CD1 4.32Å; V308-F310 VanDerWaalsContact C-N 3.25Å; V308-F310 VanDerWaalsContact CG1-C 3.47Å; V308-F310 VanDerWaalsContact CG1-O 3.3Å; V308-F310 WeakPolarHBondContact CG1-O 3.49Å; V308-F310 PolarHBondContact O-N 2.62Å; F310-G312 VanDerWaalsContact CE1-CA 3.44Å; F310-G312 VanDerWaalsContact CZ-C 3.46Å; F310-G312 PolarHBondContact O-N 2.85Å; F310-D313 WeakPolarHBondContact CE2-OD1 3.23Å; F310-D313 WeakPolarHBondContact CZ-OD1 3.47Å
311	A	89.9	Confident	85.5	Confident	24 Å²	24	81.8 Å²	81.8	20%	0.198	46%	0.456	C	S	.	.			trans	-95.7	28.2	-176.6	0	0	0	0	0	113.7	N296 V308 F315	N296-A311 WeakPolarHBondContact CB-O 3.13Å; V308-A311 HydrophobicContact CG1-CB 4.25Å; A311-F315 HydrophobicContact CB-CB 4.22Å; A311-F315 HydrophobicContact CB-CD1 4.34Å; A311-F315 HydrophobicContact CB-CD2 4.25Å; A311-F315 HydrophobicContact CB-CG 4.03Å
312	G	91.3	Very high	86.2	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	45%	0.454	C	S	.	.			trans	85.7	153.5	-174.3	0	0	0	0	0	113.5	G295 F310 N314 F315	G295-G312 VanDerWaalsContact O-CA 3.31Å; G295-G312 WeakPolarHBondContact O-CA 3.48Å; F310-G312 VanDerWaalsContact CE1-CA 3.44Å; F310-G312 VanDerWaalsContact CZ-C 3.46Å; F310-G312 PolarHBondContact O-N 2.85Å; G312-N314 PolarHBondContact O-N 2.89Å; G312-F315 PolarHBondContact O-N 3.13Å
313	D	93	Very high	87	Confident	28 Å²	28	83.6 Å²	83.6	15%	0.15	44%	0.442	C	S	.	.	H	α-helix	trans	-71.4	-17.2	177.1	-67	-46.7	0	0	0	112	K274 A292 M293 F310 R317	K274-D313 IonicContact NZ-OD1 3.48Å; K274-D313 PolarHBondContact NZ-OD1 3.44Å; K274-D313 IonicContact NZ-OD2 3.68Å; K274-D313 PolarHBondContact NZ-OD2 3.18Å; A292-D313 WeakPolarHBondContact CA-OD2 3.31Å; A292-D313 WeakPolarHBondContact CB-OD2 3.27Å; M293-D313 PolarHBondContact N-OD2 3.1Å; M293-D313 WeakPolarHBondContact O-CB 3.48Å; M293-D313 PolarHBondContact O-N 2.91Å; M293-D313 VanDerWaalsContact O-OD2 3.13Å; F310-D313 WeakPolarHBondContact CE2-OD1 3.23Å; F310-D313 WeakPolarHBondContact CZ-OD1 3.47Å; D313-R317 WeakPolarHBondContact O-CB 3.35Å; D313-R317 WeakPolarHBondContact O-CD 3.29Å; D313-R317 WeakPolarHBondContact O-CG 3.45Å; D313-R317 PolarHBondContact O-N 3.27Å; D313-R317 PolarHBondContact O-NE 3.33Å
314	N	92.3	Very high	87.6	Confident	74 Å²	74	82.6 Å²	82.6	40%	0.396	44%	0.442	S	S	.	.	H	α-helix	trans	-71.9	-33.5	176.3	-80.1	-2.3	0	0	0	113.2	R294 G312	R294-N314 WeakPolarHBondContact CG-OD1 3.47Å; R294-N314 VanDerWaalsContact O-CB 3.3Å; R294-N314 WeakPolarHBondContact O-CB 3.32Å; R294-N314 PolarHBondContact O-N 3.2Å; G312-N314 PolarHBondContact O-N 2.89Å
315	F	90.1	Very high	88.5	Confident	98 Å²	98	84.7 Å²	84.7	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-61.9	-60.3	176.9	-176	-87.5	0	0	0	109.7	A311 G312 R317 Y318 D319	A311-F315 HydrophobicContact CB-CB 4.22Å; A311-F315 HydrophobicContact CB-CD1 4.34Å; A311-F315 HydrophobicContact CB-CD2 4.25Å; A311-F315 HydrophobicContact CB-CG 4.03Å; G312-F315 PolarHBondContact O-N 3.13Å; F315-R317 PolarHBondContact O-N 2.89Å; F315-Y318 PolarHBondContact O-N 2.56Å; F315-Y318 VanDerWaalsContact O-N 3.14Å; F315-D319 WeakPolarHBondContact CD1-OD2 3.49Å; F315-D319 VanDerWaalsContact CE1-OD2 3.24Å; F315-D319 WeakPolarHBondContact CE1-OD2 3.47Å
316	V	91	Very high	89.6	Confident	91 Å²	91	81.3 Å²	81.3	55%	0.552	43%	0.433	S	S	*	.	H	α-helix	trans	-63.1	-18.5	-176.9	-171.9	0	0	0	0	113.6	D319	V316-D319 WeakPolarHBondContact CA-OD2 3.42Å
317	R	91.8	Very high	90.4	Very high	127 Å²	127	80.6 Å²	80.6	48%	0.479	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.3	177.4	-85.2	166.6	-162.8	-138.2	-2.7	114.5	D313 F315	D313-R317 WeakPolarHBondContact O-CB 3.35Å; D313-R317 WeakPolarHBondContact O-CD 3.29Å; D313-R317 WeakPolarHBondContact O-CG 3.45Å; D313-R317 PolarHBondContact O-N 3.27Å; D313-R317 PolarHBondContact O-NE 3.33Å; F315-R317 PolarHBondContact O-N 2.89Å
318	Y	90.8	Very high	91.3	Very high	148 Å²	148	77.3 Å²	77.3	58%	0.58	40%	0.402	S	S	*	.	S	Bend	trans	-110.4	6	179.8	-66.1	-73.3	0	0	0	112.4	F315 Q323	F315-Y318 PolarHBondContact O-N 2.56Å; F315-Y318 VanDerWaalsContact O-N 3.14Å; Y318-Q323 VanDerWaalsContact O-CG 3.23Å; Y318-Q323 WeakPolarHBondContact O-CG 3.17Å; Y318-Q323 PolarHBondContact O-NE2 3.32Å
319	D	89.6	Confident	92	Very high	76 Å²	76	77.6 Å²	77.6	41%	0.406	40%	0.402	S	S	.	.	S	Bend	trans	-80.3	143	174.5	-75.5	-33.1	0	0	0	112	F315 V316	F315-D319 WeakPolarHBondContact CD1-OD2 3.49Å; F315-D319 VanDerWaalsContact CE1-OD2 3.24Å; F315-D319 WeakPolarHBondContact CE1-OD2 3.47Å; V316-D319 WeakPolarHBondContact CA-OD2 3.42Å
320	G	90.4	Very high	92.4	Very high	49 Å²	49	75.6 Å²	75.6	51%	0.505	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	-149.1	174.2	0	0	0	0	0	114.4	V322 Q323	G320-V322 PolarHBondContact O-N 2.85Å; G320-Q323 PolarHBondContact O-N 3.4Å
321	D	93.2	Very high	92.7	Very high	139 Å²	139	75.1 Å²	75.1	74%	0.743	39%	0.386	S	S	*	.	H	α-helix	trans	-54.3	-15.4	-167.9	-50.1	4.3	0	0	0	114.9	Q323 D324 M325	D321-Q323 VanDerWaalsContact C-N 3.28Å; D321-Q323 PolarHBondContact O-N 2.8Å; D321-D324 PolarHBondContact O-N 2.93Å; D321-M325 WeakPolarHBondContact O-CB 3.22Å; D321-M325 PolarHBondContact O-N 2.97Å
322	V	94.5	Very high	92.9	Very high	52 Å²	52	74.2 Å²	74.2	32%	0.315	38%	0.378	S	S	.	.	H	α-helix	trans	-59	-38.6	173.2	-178.3	0	0	0	0	111.5	G320 M325 I326	G320-V322 PolarHBondContact O-N 2.85Å; V322-M325 PolarHBondContact O-N 2.8Å; V322-I326 HydrophobicContact CG1-CD1 3.96Å; V322-I326 VanDerWaalsContact O-CG1 3.27Å; V322-I326 WeakPolarHBondContact O-CG1 3.5Å; V322-I326 PolarHBondContact O-N 3.26Å
323	Q	93	Very high	93.1	Very high	112 Å²	112	81.1 Å²	81.1	52%	0.523	40%	0.404	S	S	.	.	H	α-helix	trans	-68.1	-51	178	-59.3	-175	10.2	0	0	110.8	Y318 G320 D321 M325 I326 D327	Y318-Q323 VanDerWaalsContact O-CG 3.23Å; Y318-Q323 WeakPolarHBondContact O-CG 3.17Å; Y318-Q323 PolarHBondContact O-NE2 3.32Å; G320-Q323 PolarHBondContact O-N 3.4Å; D321-Q323 VanDerWaalsContact C-N 3.28Å; D321-Q323 PolarHBondContact O-N 2.8Å; Q323-M325 PolarHBondContact O-N 3.48Å; Q323-I326 PolarHBondContact O-N 3.37Å; Q323-I326 VanDerWaalsContact O-N 3.07Å; Q323-D327 PolarHBondContact O-N 2.8Å
324	D	92.8	Very high	93.1	Very high	97 Å²	97	83.4 Å²	83.4	52%	0.519	41%	0.414	S	S	.	.	H	α-helix	trans	-54.7	-39	175	-93.7	12.1	0	0	0	112.1	D321 R328	D321-D324 PolarHBondContact O-N 2.93Å; D324-R328 WeakPolarHBondContact O-CG 3.21Å; D324-R328 PolarHBondContact O-N 3.49Å
325	M	94.2	Very high	93.1	Very high	109 Å²	109	81 Å²	81	54%	0.537	40%	0.401	S	S	.	.	H	α-helix	trans	-69.6	-40.2	176.8	-171.9	-171.4	71.7	0	0	112.6	D321 V322 Q323 R328 Q329 L345	D321-M325 WeakPolarHBondContact O-CB 3.22Å; D321-M325 PolarHBondContact O-N 2.97Å; V322-M325 PolarHBondContact O-N 2.8Å; Q323-M325 PolarHBondContact O-N 3.48Å; M325-R328 PolarHBondContact O-N 3.32Å; M325-Q329 PolarHBondContact O-N 2.76Å; M325-L345 HydrophobicContact CG-CD2 4.17Å
326	I	95.2	Very high	93.2	Very high	74 Å²	74	81.4 Å²	81.4	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.2	-71.5	164.7	0	0	0	109.9	V322 Q323 R328 Q329 V330	V322-I326 HydrophobicContact CG1-CD1 3.96Å; V322-I326 VanDerWaalsContact O-CG1 3.27Å; V322-I326 WeakPolarHBondContact O-CG1 3.5Å; V322-I326 PolarHBondContact O-N 3.26Å; Q323-I326 PolarHBondContact O-N 3.37Å; Q323-I326 VanDerWaalsContact O-N 3.07Å; I326-R328 PolarHBondContact O-N 3.14Å; I326-Q329 WeakPolarHBondContact O-CB 3.08Å; I326-Q329 PolarHBondContact O-N 3.01Å; I326-V330 HydrophobicContact CG2-CG2 4.45Å; I326-V330 WeakPolarHBondContact O-CG2 3.45Å; I326-V330 PolarHBondContact O-N 3.47Å
327	D	94.3	Very high	93.3	Very high	100 Å²	100	82.8 Å²	82.8	54%	0.535	41%	0.408	S	S	.	.	H	α-helix	trans	-58.8	-35.3	174	-82.9	12	0	0	0	112.1	Q323 F331	Q323-D327 PolarHBondContact O-N 2.8Å; D327-F331 WeakPolarHBondContact O-CB 3.17Å; D327-F331 PolarHBondContact O-N 3.26Å
328	R	94.2	Very high	93.3	Very high	69 Å²	69	83.4 Å²	83.4	26%	0.26	41%	0.414	S	S	.	.	H	α-helix	trans	-72.7	-34.4	174.3	-66.8	-15.9	166.6	-173.1	-12.7	112.6	D324 M325 I326 A332 L345 L352	D324-R328 WeakPolarHBondContact O-CG 3.21Å; D324-R328 PolarHBondContact O-N 3.49Å; M325-R328 PolarHBondContact O-N 3.32Å; I326-R328 PolarHBondContact O-N 3.14Å; R328-A332 PolarHBondContact O-N 2.92Å; R328-L345 HydrophobicContact CB-CD1 3.99Å; R328-L352 HydrophobicContact CB-CD2 3.78Å; R328-L352 HydrophobicContact CG-CD2 4.15Å
329	Q	94.9	Very high	93.1	Very high	30 Å²	30	81.7 Å²	81.7	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-69.5	-42.6	175	-175	65.1	55.6	0	0	111.6	M325 I326 A332 W333 L345	M325-Q329 PolarHBondContact O-N 2.76Å; I326-Q329 WeakPolarHBondContact O-CB 3.08Å; I326-Q329 PolarHBondContact O-N 3.01Å; Q329-A332 VanDerWaalsContact O-CB 3.23Å; Q329-A332 WeakPolarHBondContact O-CB 3.49Å; Q329-A332 PolarHBondContact O-N 3.41Å; Q329-A332 VanDerWaalsContact O-N 3.16Å; Q329-W333 HydrophobicContact CG-CD2 4.42Å; Q329-W333 HydrophobicContact CG-CE3 4.49Å; Q329-W333 HydrophobicContact CG-CH2 3.82Å; Q329-W333 HydrophobicContact CG-CZ2 3.71Å; Q329-W333 HydrophobicContact CG-CZ3 4.21Å; Q329-W333 VanDerWaalsContact NE2-CE2 3.31Å; Q329-W333 VanDerWaalsContact NE2-NE1 3.19Å; Q329-W333 PolarHBondContact O-N 2.9Å; Q329-L345 HydrophobicContact CB-CD2 4.1Å; Q329-L345 VanDerWaalsContact OE1-CD2 3.27Å
330	V	94.9	Very high	93	Very high	59 Å²	59	81.2 Å²	81.2	36%	0.358	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-41.6	173.8	174.8	0	0	0	0	110.5	I326 A332 W333 E334	I326-V330 HydrophobicContact CG2-CG2 4.45Å; I326-V330 WeakPolarHBondContact O-CG2 3.45Å; I326-V330 PolarHBondContact O-N 3.47Å; V330-A332 VanDerWaalsContact C-N 3.3Å; V330-A332 PolarHBondContact O-N 3.17Å; V330-W333 HydrophobicContact CG2-CE3 4.37Å; V330-W333 HydrophobicContact CG2-CZ3 4.39Å; V330-W333 PolarHBondContact O-N 2.95Å; V330-E334 PolarHBondContact O-N 3.37Å
331	F	94.6	Very high	92.8	Very high	22 Å²	22	82.1 Å²	82.1	10%	0.096	42%	0.42	C	S	.	.	H	α-helix	trans	-61	-35.3	171.6	177.9	-105.8	0	0	0	112.9	D327 M335 L352 L355 A356 V359	D327-F331 WeakPolarHBondContact O-CB 3.17Å; D327-F331 PolarHBondContact O-N 3.26Å; F331-M335 HydrophobicContact CD1-CG 4.23Å; F331-M335 HydrophobicContact CD2-CG 3.9Å; F331-M335 HydrophobicContact CD2-SD 4.42Å; F331-M335 HydrophobicContact CE1-CG 3.88Å; F331-M335 HydrophobicContact CE2-CG 3.51Å; F331-M335 HydrophobicContact CE2-SD 3.58Å; F331-M335 VanDerWaalsContact CE2-SD 3.58Å; F331-M335 HydrophobicContact CG-CG 4.25Å; F331-M335 HydrophobicContact CZ-CE 4.05Å; F331-M335 HydrophobicContact CZ-CG 3.51Å; F331-M335 HydrophobicContact CZ-SD 3.7Å; F331-M335 WeakPolarHBondContact O-CB 3.18Å; F331-M335 WeakPolarHBondContact O-CG 3.3Å; F331-M335 PolarHBondContact O-N 3.09Å; F331-L352 HydrophobicContact CD1-CD2 4.01Å; F331-L352 HydrophobicContact CD1-CG 4.19Å; F331-L352 HydrophobicContact CE1-CG 4.47Å; F331-L355 HydrophobicContact CE1-CB 4.17Å; F331-L355 HydrophobicContact CZ-CB 4.32Å; F331-A356 HydrophobicContact CD1-CB 3.78Å; F331-A356 HydrophobicContact CE1-CB 3.66Å; F331-A356 HydrophobicContact CG-CB 4.48Å; F331-A356 HydrophobicContact CZ-CB 4.29Å; F331-V359 HydrophobicContact CE2-CB 4.1Å; F331-V359 HydrophobicContact CE2-CG1 4.03Å; F331-V359 HydrophobicContact CE2-CG2 4.02Å; F331-V359 HydrophobicContact CZ-CB 4.24Å; F331-V359 HydrophobicContact CZ-CG2 3.94Å
332	A	95	Very high	92.6	Very high	4 Å²	4	81.2 Å²	81.2	3%	0.033	42%	0.416	C	S	.	.	H	α-helix	trans	-58.7	-51.7	173.6	0	0	0	0	0	111	R328 Q329 V330 M335 H336 L352	R328-A332 PolarHBondContact O-N 2.92Å; Q329-A332 VanDerWaalsContact O-CB 3.23Å; Q329-A332 WeakPolarHBondContact O-CB 3.49Å; Q329-A332 PolarHBondContact O-N 3.41Å; Q329-A332 VanDerWaalsContact O-N 3.16Å; V330-A332 VanDerWaalsContact C-N 3.3Å; V330-A332 PolarHBondContact O-N 3.17Å; A332-M335 PolarHBondContact O-N 3.3Å; A332-H336 WeakPolarHBondContact O-CB 3.21Å; A332-H336 PolarHBondContact O-N 2.9Å; A332-L352 HydrophobicContact CB-CD1 3.56Å
333	W	94.4	Very high	92.3	Very high	145 Å²	145	79.1 Å²	79.1	55%	0.549	40%	0.403	S	S	.	.	H	α-helix	trans	-63.2	-45.4	178.7	-61.2	-35.7	0	0	0	111.8	Q329 V330 M335 H336 D337	Q329-W333 HydrophobicContact CG-CD2 4.42Å; Q329-W333 HydrophobicContact CG-CE3 4.49Å; Q329-W333 HydrophobicContact CG-CH2 3.82Å; Q329-W333 HydrophobicContact CG-CZ2 3.71Å; Q329-W333 HydrophobicContact CG-CZ3 4.21Å; Q329-W333 VanDerWaalsContact NE2-CE2 3.31Å; Q329-W333 VanDerWaalsContact NE2-NE1 3.19Å; Q329-W333 PolarHBondContact O-N 2.9Å; V330-W333 HydrophobicContact CG2-CE3 4.37Å; V330-W333 HydrophobicContact CG2-CZ3 4.39Å; V330-W333 PolarHBondContact O-N 2.95Å; W333-M335 VanDerWaalsContact C-N 3.3Å; W333-M335 PolarHBondContact O-N 3.22Å; W333-H336 PolarHBondContact O-N 3.43Å; W333-D337 WeakPolarHBondContact O-CB 3.45Å; W333-D337 PolarHBondContact O-N 3.02Å
334	E	93.7	Very high	92.3	Very high	76 Å²	76	78.2 Å²	78.2	36%	0.355	40%	0.398	S	S	.	.	H	α-helix	trans	-57.9	-39.6	175.4	-78.5	-165.5	-135.5	0	0	113.2	V330 K338	V330-E334 PolarHBondContact O-N 3.37Å; E334-K338 HydrophobicContact CB-CD 4.33Å; E334-K338 VanDerWaalsContact CD-NZ 3.33Å; E334-K338 WeakPolarHBondContact O-CB 3.41Å; E334-K338 WeakPolarHBondContact O-CG 3.3Å; E334-K338 PolarHBondContact O-N 3.11Å; E334-K338 IonicContact OE2-NZ 2.64Å; E334-K338 PolarHBondContact OE2-NZ 3.29Å
335	M	92.2	Very high	92.3	Very high	24 Å²	24	74.9 Å²	74.9	12%	0.118	38%	0.381	C	S	.	.	H	α-helix	trans	-75.8	-35.4	-178.9	-67.8	-69.6	-71.9	0	0	112.3	F331 A332 W333 L339 L341	F331-M335 HydrophobicContact CD1-CG 4.23Å; F331-M335 HydrophobicContact CD2-CG 3.9Å; F331-M335 HydrophobicContact CD2-SD 4.42Å; F331-M335 HydrophobicContact CE1-CG 3.88Å; F331-M335 HydrophobicContact CE2-CG 3.51Å; F331-M335 HydrophobicContact CE2-SD 3.58Å; F331-M335 VanDerWaalsContact CE2-SD 3.58Å; F331-M335 HydrophobicContact CG-CG 4.25Å; F331-M335 HydrophobicContact CZ-CE 4.05Å; F331-M335 HydrophobicContact CZ-CG 3.51Å; F331-M335 HydrophobicContact CZ-SD 3.7Å; F331-M335 WeakPolarHBondContact O-CB 3.18Å; F331-M335 WeakPolarHBondContact O-CG 3.3Å; F331-M335 PolarHBondContact O-N 3.09Å; A332-M335 PolarHBondContact O-N 3.3Å; W333-M335 VanDerWaalsContact C-N 3.3Å; W333-M335 PolarHBondContact O-N 3.22Å; M335-L339 HydrophobicContact CE-CD1 3.88Å; M335-L339 WeakPolarHBondContact O-CB 3.01Å; M335-L339 PolarHBondContact O-N 3.36Å; M335-L339 HydrophobicContact SD-CD1 3.81Å; M335-L341 HydrophobicContact CE-CD1 3.63Å; M335-L341 PolarHBondContact O-N 3.03Å
336	H	92.7	Very high	92.3	Very high	107 Å²	107	75.9 Å²	75.9	50%	0.495	38%	0.384	S	S	.	.	H	α-helix	trans	-63.3	-54.4	171.4	176.8	-90.8	0	0	0	110.6	A332 W333 G340	A332-H336 WeakPolarHBondContact O-CB 3.21Å; A332-H336 PolarHBondContact O-N 2.9Å; W333-H336 PolarHBondContact O-N 3.43Å; H336-G340 VanDerWaalsContact O-CA 3.25Å; H336-G340 WeakPolarHBondContact O-CA 3.43Å; H336-G340 PolarHBondContact O-N 3.14Å
337	D	92.8	Very high	92.2	Very high	119 Å²	119	75.7 Å²	75.7	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-76	-33.3	-169.7	-61.3	-14.3	0	0	0	113.4	W333	W333-D337 WeakPolarHBondContact O-CB 3.45Å; W333-D337 PolarHBondContact O-N 3.02Å
338	K	91.2	Very high	92.2	Very high	140 Å²	140	73.8 Å²	73.8	61%	0.609	38%	0.383	S	S	*	.	H	α-helix	trans	-92.1	-25	-176.7	-59.1	173.2	-176.3	179.7	0	114.2	E334	E334-K338 HydrophobicContact CB-CD 4.33Å; E334-K338 VanDerWaalsContact CD-NZ 3.33Å; E334-K338 WeakPolarHBondContact O-CB 3.41Å; E334-K338 WeakPolarHBondContact O-CG 3.3Å; E334-K338 PolarHBondContact O-N 3.11Å; E334-K338 IonicContact OE2-NZ 2.64Å; E334-K338 PolarHBondContact OE2-NZ 3.29Å
339	L	87.1	Confident	92.2	Very high	112 Å²	112	73.6 Å²	73.6	59%	0.586	39%	0.391	S	S	*	.	H	α-helix	trans	-127.8	-4.1	-171.8	-63.6	172	0	0	0	113.9	M335 L341	M335-L339 HydrophobicContact CE-CD1 3.88Å; M335-L339 WeakPolarHBondContact O-CB 3.01Å; M335-L339 PolarHBondContact O-N 3.36Å; M335-L339 HydrophobicContact SD-CD1 3.81Å; L339-L341 HydrophobicContact CB-CB 4.45Å; L339-L341 HydrophobicContact CB-CD1 3.81Å; L339-L341 HydrophobicContact CB-CG 3.89Å; L339-L341 HydrophobicContact CD1-CD1 3.85Å; L339-L341 HydrophobicContact CG-CD1 4.49Å; L339-L341 PolarHBondContact O-N 2.76Å
340	G	88.2	Confident	92.2	Very high	66 Å²	66	76.9 Å²	76.9	68%	0.68	41%	0.413	S	S	*	.			trans	63.8	20.7	-175.3	0	0	0	0	0	113.4	H336 D342	H336-G340 VanDerWaalsContact O-CA 3.25Å; H336-G340 WeakPolarHBondContact O-CA 3.43Å; H336-G340 PolarHBondContact O-N 3.14Å; G340-D342 PolarHBondContact O-N 3.37Å
341	L	86	Confident	92.2	Very high	68 Å²	68	79.4 Å²	79.4	36%	0.356	42%	0.416	S	S	.	.			trans	-86.5	104.3	-176.3	-73.8	171.5	0	0	0	110.1	M335 L339 V343	M335-L341 HydrophobicContact CE-CD1 3.63Å; M335-L341 PolarHBondContact O-N 3.03Å; L339-L341 HydrophobicContact CB-CB 4.45Å; L339-L341 HydrophobicContact CB-CD1 3.81Å; L339-L341 HydrophobicContact CB-CG 3.89Å; L339-L341 HydrophobicContact CD1-CD1 3.85Å; L339-L341 HydrophobicContact CG-CD1 4.49Å; L339-L341 PolarHBondContact O-N 2.76Å; L341-V343 HydrophobicContact CB-CG2 4.25Å; L341-V343 PolarHBondContact O-N 2.68Å
342	D	88.5	Confident	92.2	Very high	121 Å²	121	78.4 Å²	78.4	65%	0.647	41%	0.412	S	S	*	.			trans	-64	94.8	172.2	-174.2	15.5	0	0	0	110.8	G340 R351	G340-D342 PolarHBondContact O-N 3.37Å; D342-R351 PolarHBondContact O-NH1 3.18Å
343	V	88	Confident	92.1	Very high	7 Å²	7	82.2 Å²	82.2	4%	0.042	43%	0.429	C	S	.	.			trans	-146.2	88.9	-176.9	-177.4	0	0	0	0	108.3	L341 L352 L355	L341-V343 HydrophobicContact CB-CG2 4.25Å; L341-V343 PolarHBondContact O-N 2.68Å; V343-L352 HydrophobicContact CG1-CB 3.66Å; V343-L352 HydrophobicContact CG1-CD1 4.19Å; V343-L352 HydrophobicContact CG1-CG 4.04Å; V343-L355 HydrophobicContact CG1-CD1 4.09Å; V343-L355 HydrophobicContact CG2-CD1 3.89Å
344	H	92.9	Very high	92.2	Very high	94 Å²	94	80.1 Å²	80.1	44%	0.435	43%	0.428	S	S	.	.			trans	-99.3	133.4	-175.7	-173.6	-97.4	0	0	0	112	Q346 A347 D348	H344-Q346 VanDerWaalsContact C-N 3.31Å; H344-Q346 PolarHBondContact CE1-OE1 3.24Å; H344-Q346 PolarHBondContact ND1-OE1 3.39Å; H344-Q346 PolarHBondContact O-N 3.29Å; H344-A347 HydrophobicContact CB-CB 4.11Å; H344-A347 PolarHBondContact O-N 3.3Å; H344-D348 PolarHBondContact O-N 3.2Å
345	L	93.4	Very high	92.2	Very high	27 Å²	27	78.6 Å²	78.6	14%	0.141	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-39.9	-170.9	-176.6	66.4	0	0	0	113.7	M325 R328 Q329 P349 L352	M325-L345 HydrophobicContact CG-CD2 4.17Å; R328-L345 HydrophobicContact CB-CD1 3.99Å; Q329-L345 HydrophobicContact CB-CD2 4.1Å; Q329-L345 VanDerWaalsContact OE1-CD2 3.27Å; L345-P349 WeakPolarHBondContact O-CA 3.29Å; L345-P349 VanDerWaalsContact O-CB 3.3Å; L345-P349 WeakPolarHBondContact O-CB 3.23Å; L345-L352 HydrophobicContact CB-CD1 4.1Å; L345-L352 HydrophobicContact CD1-CD1 4Å; L345-L352 HydrophobicContact CD1-CD2 4.02Å
346	Q	94	Very high	92.3	Very high	129 Å²	129	77.6 Å²	77.6	60%	0.603	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-15.1	-178.5	-63.8	78.6	1.1	0	0	113.7	H344	H344-Q346 VanDerWaalsContact C-N 3.31Å; H344-Q346 PolarHBondContact CE1-OE1 3.24Å; H344-Q346 PolarHBondContact ND1-OE1 3.39Å; H344-Q346 PolarHBondContact O-N 3.29Å
347	A	94.2	Very high	92.4	Very high	71 Å²	71	76.7 Å²	76.7	59%	0.587	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-46.6	-179.2	0	0	0	0	0	111.5	H344 P349	H344-A347 HydrophobicContact CB-CB 4.11Å; H344-A347 PolarHBondContact O-N 3.3Å; A347-P349 VanDerWaalsContact O-CD 3.27Å; A347-P349 WeakPolarHBondContact O-CD 3.5Å
348	D	93.1	Very high	92.5	Very high	59 Å²	59	78 Å²	78	32%	0.316	41%	0.412	S	S	.	.	S	Bend	trans	-120.7	47.4	-173.5	-103.4	11.4	0	0	0	112	H344 T350 R351 L352	H344-D348 PolarHBondContact O-N 3.2Å; D348-T350 PolarHBondContact O-N 3.42Å; D348-R351 HydrophobicContact CB-CB 4.12Å; D348-R351 PolarHBondContact O-N 3.22Å; D348-R351 VanDerWaalsContact O-N 3.15Å; D348-R351 WeakPolarHBondContact OD2-CD 3.17Å; D348-R351 IonicContact OD2-CZ 2.73Å; D348-R351 IonicContact OD2-NE 2.63Å; D348-R351 IonicContact OD2-NH1 2.68Å; D348-R351 PolarHBondContact OD2-NH1 3.37Å; D348-L352 PolarHBondContact O-N 2.93Å
349	P	95.3	Very high	92.7	Very high	65 Å²	65	73.5 Å²	73.5	42%	0.422	40%	0.397	S	S	.	.	H	α-helix	trans	-57.5	-44	-168.4	20.8	-32.7	0	0	0	113.4	L345 A347 L352 E353	L345-P349 WeakPolarHBondContact O-CA 3.29Å; L345-P349 VanDerWaalsContact O-CB 3.3Å; L345-P349 WeakPolarHBondContact O-CB 3.23Å; A347-P349 VanDerWaalsContact O-CD 3.27Å; A347-P349 WeakPolarHBondContact O-CD 3.5Å; P349-L352 PolarHBondContact O-N 3.35Å; P349-E353 WeakPolarHBondContact O-CB 3.36Å; P349-E353 PolarHBondContact O-N 2.88Å
350	T	95	Very high	93	Very high	100 Å²	100	70.6 Å²	70.6	61%	0.613	39%	0.385	S	S	*	.	H	α-helix	trans	-72.9	-34.5	-178.6	53	0	0	0	0	112.2	D348 L354	D348-T350 PolarHBondContact O-N 3.42Å; T350-L354 WeakPolarHBondContact O-CB 3.41Å; T350-L354 VanDerWaalsContact O-CG 3.23Å; T350-L354 WeakPolarHBondContact O-CG 3.2Å; T350-L354 PolarHBondContact O-N 3.08Å
351	R	93.8	Very high	93.4	Very high	111 Å²	111	73.6 Å²	73.6	42%	0.419	38%	0.38	S	S	.	.	H	α-helix	trans	-66	-45.9	172.9	-177.6	-168.9	179	-161.6	-8.1	110.2	D342 D348 L354 L355	D342-R351 PolarHBondContact O-NH1 3.18Å; D348-R351 HydrophobicContact CB-CB 4.12Å; D348-R351 PolarHBondContact O-N 3.22Å; D348-R351 VanDerWaalsContact O-N 3.15Å; D348-R351 WeakPolarHBondContact OD2-CD 3.17Å; D348-R351 IonicContact OD2-CZ 2.73Å; D348-R351 IonicContact OD2-NE 2.63Å; D348-R351 IonicContact OD2-NH1 2.68Å; D348-R351 PolarHBondContact OD2-NH1 3.37Å; R351-L354 PolarHBondContact O-N 2.88Å; R351-L355 HydrophobicContact CG-CD1 4.17Å; R351-L355 WeakPolarHBondContact O-CB 3.07Å; R351-L355 VanDerWaalsContact O-CG 3.29Å; R351-L355 WeakPolarHBondContact O-CG 3.5Å; R351-L355 PolarHBondContact O-N 3.45Å
352	L	94.2	Very high	93.9	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-49.6	174.2	-171.4	154.4	0	0	0	110.8	R328 F331 A332 V343 L345 D348 P349 L354 L355 A356	R328-L352 HydrophobicContact CB-CD2 3.78Å; R328-L352 HydrophobicContact CG-CD2 4.15Å; F331-L352 HydrophobicContact CD1-CD2 4.01Å; F331-L352 HydrophobicContact CD1-CG 4.19Å; F331-L352 HydrophobicContact CE1-CG 4.47Å; A332-L352 HydrophobicContact CB-CD1 3.56Å; V343-L352 HydrophobicContact CG1-CB 3.66Å; V343-L352 HydrophobicContact CG1-CD1 4.19Å; V343-L352 HydrophobicContact CG1-CG 4.04Å; L345-L352 HydrophobicContact CB-CD1 4.1Å; L345-L352 HydrophobicContact CD1-CD1 4Å; L345-L352 HydrophobicContact CD1-CD2 4.02Å; D348-L352 PolarHBondContact O-N 2.93Å; P349-L352 PolarHBondContact O-N 3.35Å; L352-L354 VanDerWaalsContact C-N 3.34Å; L352-L354 PolarHBondContact O-N 3.35Å; L352-L355 PolarHBondContact O-N 2.85Å; L352-A356 HydrophobicContact CD2-CB 4.46Å; L352-A356 WeakPolarHBondContact O-CB 3.46Å; L352-A356 PolarHBondContact O-N 2.62Å
353	E	94.6	Very high	94.2	Very high	85 Å²	85	72.7 Å²	72.7	40%	0.397	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-40.9	-178.9	-160.6	-151.6	-167	0	0	111.9	P349 A356 K357	P349-E353 WeakPolarHBondContact O-CB 3.36Å; P349-E353 PolarHBondContact O-N 2.88Å; E353-A356 PolarHBondContact O-N 3.02Å; E353-K357 VanDerWaalsContact CD-CE 3.44Å; E353-K357 HydrophobicContact CG-CD 4.31Å; E353-K357 WeakPolarHBondContact O-CB 3.24Å; E353-K357 VanDerWaalsContact O-CG 3.25Å; E353-K357 WeakPolarHBondContact O-CG 3.21Å; E353-K357 PolarHBondContact O-N 2.9Å; E353-K357 WeakPolarHBondContact OE1-CE 3.44Å; E353-K357 IonicContact OE1-NZ 3.13Å; E353-K357 PolarHBondContact OE1-NZ 3.18Å; E353-K357 IonicContact OE2-NZ 2.7Å; E353-K357 PolarHBondContact OE2-NZ 2.79Å
354	L	95.4	Very high	94.6	Very high	100 Å²	100	75.4 Å²	75.4	52%	0.524	40%	0.395	S	S	.	.	H	α-helix	trans	-66.7	-38.2	174.5	-74.5	172	0	0	0	112.6	T350 R351 L352 K358	T350-L354 WeakPolarHBondContact O-CB 3.41Å; T350-L354 VanDerWaalsContact O-CG 3.23Å; T350-L354 WeakPolarHBondContact O-CG 3.2Å; T350-L354 PolarHBondContact O-N 3.08Å; R351-L354 PolarHBondContact O-N 2.88Å; L352-L354 VanDerWaalsContact C-N 3.34Å; L352-L354 PolarHBondContact O-N 3.35Å; L354-K358 WeakPolarHBondContact O-CB 3.41Å; L354-K358 VanDerWaalsContact O-CG 3.28Å; L354-K358 WeakPolarHBondContact O-CG 3.38Å; L354-K358 PolarHBondContact O-N 3.2Å
355	L	93.7	Very high	94.7	Very high	45 Å²	45	75.2 Å²	75.2	24%	0.236	40%	0.397	C	S	.	.	H	α-helix	trans	-66.3	-45.3	172.9	-73.8	169.7	0	0	0	111.1	F331 V343 R351 L352 K357 K358 V359	F331-L355 HydrophobicContact CE1-CB 4.17Å; F331-L355 HydrophobicContact CZ-CB 4.32Å; V343-L355 HydrophobicContact CG1-CD1 4.09Å; V343-L355 HydrophobicContact CG2-CD1 3.89Å; R351-L355 HydrophobicContact CG-CD1 4.17Å; R351-L355 WeakPolarHBondContact O-CB 3.07Å; R351-L355 VanDerWaalsContact O-CG 3.29Å; R351-L355 WeakPolarHBondContact O-CG 3.5Å; R351-L355 PolarHBondContact O-N 3.45Å; L352-L355 PolarHBondContact O-N 2.85Å; L355-K357 VanDerWaalsContact C-N 3.34Å; L355-K357 PolarHBondContact O-N 3.34Å; L355-K358 WeakPolarHBondContact O-CB 3.28Å; L355-K358 PolarHBondContact O-N 2.97Å; L355-K358 VanDerWaalsContact O-N 3.14Å; L355-V359 WeakPolarHBondContact O-CB 3.42Å; L355-V359 WeakPolarHBondContact O-CG2 3.37Å; L355-V359 PolarHBondContact O-N 3.01Å
356	A	93.8	Very high	94.9	Very high	3 Å²	3	78.1 Å²	78.1	3%	0.025	42%	0.416	C	S	.	.	H	α-helix	trans	-62.2	-39.3	177.4	0	0	0	0	0	111.9	F331 L352 E353 V359 S360	F331-A356 HydrophobicContact CD1-CB 3.78Å; F331-A356 HydrophobicContact CE1-CB 3.66Å; F331-A356 HydrophobicContact CG-CB 4.48Å; F331-A356 HydrophobicContact CZ-CB 4.29Å; L352-A356 HydrophobicContact CD2-CB 4.46Å; L352-A356 WeakPolarHBondContact O-CB 3.46Å; L352-A356 PolarHBondContact O-N 2.62Å; E353-A356 PolarHBondContact O-N 3.02Å; A356-V359 PolarHBondContact O-N 3.27Å; A356-S360 WeakPolarHBondContact O-CB 3.46Å; A356-S360 PolarHBondContact O-N 3.34Å; A356-S360 PolarHBondContact O-OG 3.33Å
357	K	95.6	Very high	94.9	Very high	88 Å²	88	76.7 Å²	76.7	38%	0.383	41%	0.409	S	S	.	.	H	α-helix	trans	-68.6	-32.6	173.1	-75.3	169.4	179.9	169	0	113.3	E353 L355 S360 K361	E353-K357 VanDerWaalsContact CD-CE 3.44Å; E353-K357 HydrophobicContact CG-CD 4.31Å; E353-K357 WeakPolarHBondContact O-CB 3.24Å; E353-K357 VanDerWaalsContact O-CG 3.25Å; E353-K357 WeakPolarHBondContact O-CG 3.21Å; E353-K357 PolarHBondContact O-N 2.9Å; E353-K357 WeakPolarHBondContact OE1-CE 3.44Å; E353-K357 IonicContact OE1-NZ 3.13Å; E353-K357 PolarHBondContact OE1-NZ 3.18Å; E353-K357 IonicContact OE2-NZ 2.7Å; E353-K357 PolarHBondContact OE2-NZ 2.79Å; L355-K357 VanDerWaalsContact C-N 3.34Å; L355-K357 PolarHBondContact O-N 3.34Å; K357-S360 PolarHBondContact O-OG 3.31Å; K357-K361 WeakPolarHBondContact O-CG 3.4Å; K357-K361 PolarHBondContact O-N 3.12Å
358	K	95.5	Very high	94.9	Very high	146 Å²	146	77.3 Å²	77.3	64%	0.635	40%	0.403	S	S	*	.	H	α-helix	trans	-69.9	-47	171.9	-76.9	171.1	177.7	-177	0	110.9	L354 L355 K361 A362	L354-K358 WeakPolarHBondContact O-CB 3.41Å; L354-K358 VanDerWaalsContact O-CG 3.28Å; L354-K358 WeakPolarHBondContact O-CG 3.38Å; L354-K358 PolarHBondContact O-N 3.2Å; L355-K358 WeakPolarHBondContact O-CB 3.28Å; L355-K358 PolarHBondContact O-N 2.97Å; L355-K358 VanDerWaalsContact O-N 3.14Å; K358-K361 PolarHBondContact O-N 2.94Å; K358-A362 PolarHBondContact O-N 2.97Å
359	V	94.2	Very high	95.1	Very high	46 Å²	46	81.2 Å²	81.2	28%	0.279	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-37.3	178	171.3	0	0	0	0	111.5	F331 L355 A356 A362 K363	F331-V359 HydrophobicContact CE2-CB 4.1Å; F331-V359 HydrophobicContact CE2-CG1 4.03Å; F331-V359 HydrophobicContact CE2-CG2 4.02Å; F331-V359 HydrophobicContact CZ-CB 4.24Å; F331-V359 HydrophobicContact CZ-CG2 3.94Å; L355-V359 WeakPolarHBondContact O-CB 3.42Å; L355-V359 WeakPolarHBondContact O-CG2 3.37Å; L355-V359 PolarHBondContact O-N 3.01Å; A356-V359 PolarHBondContact O-N 3.27Å; V359-A362 PolarHBondContact O-N 2.97Å; V359-K363 HydrophobicContact CG1-CD 4.12Å; V359-K363 HydrophobicContact CG1-CG 4.29Å; V359-K363 WeakPolarHBondContact O-CB 3.44Å; V359-K363 VanDerWaalsContact O-CG 3.3Å; V359-K363 WeakPolarHBondContact O-CG 3.42Å; V359-K363 PolarHBondContact O-N 3.43Å
360	S	94.2	Very high	95	Very high	50 Å²	50	81.4 Å²	81.4	35%	0.35	42%	0.417	S	S	.	.	H	α-helix	trans	-66.7	-37.9	176.3	70.9	0	0	0	0	112.2	A356 K357 K363 C364	A356-S360 WeakPolarHBondContact O-CB 3.46Å; A356-S360 PolarHBondContact O-N 3.34Å; A356-S360 PolarHBondContact O-OG 3.33Å; K357-S360 PolarHBondContact O-OG 3.31Å; S360-K363 PolarHBondContact O-N 3.1Å; S360-C364 PolarHBondContact O-N 3.17Å; S360-C364 VanDerWaalsContact O-N 3.07Å; S360-C364 PolarHBondContact O-SG 2.92Å; S360-C364 VanDerWaalsContact O-SG 3.34Å
361	K	96	Very high	94.9	Very high	130 Å²	130	83.3 Å²	83.3	57%	0.565	41%	0.413	S	S	*	.	H	α-helix	trans	-62.2	-54.7	170.9	-73.6	179.1	178	-167.6	0	110.9	K357 K358 K363 C364 D365	K357-K361 WeakPolarHBondContact O-CG 3.4Å; K357-K361 PolarHBondContact O-N 3.12Å; K358-K361 PolarHBondContact O-N 2.94Å; K361-K363 PolarHBondContact O-N 3.3Å; K361-C364 CarbonylContact O-C 3.47Å; K361-C364 WeakPolarHBondContact O-CA 3.07Å; K361-C364 WeakPolarHBondContact O-CB 3.42Å; K361-C364 PolarHBondContact O-N 3.3Å; K361-D365 VanDerWaalsContact C-OD2 3.28Å; K361-D365 PolarHBondContact O-N 2.99Å; K361-D365 VanDerWaalsContact O-OD2 3.06Å
362	A	95.9	Very high	94.7	Very high	49 Å²	49	80 Å²	80	41%	0.405	41%	0.409	S	S	.	.	H	α-helix	trans	-56.5	-36.2	177.9	0	0	0	0	0	113	K358 V359 D365 V366	K358-A362 PolarHBondContact O-N 2.97Å; V359-A362 PolarHBondContact O-N 2.97Å; A362-D365 PolarHBondContact O-N 3.3Å; A362-V366 WeakPolarHBondContact O-CB 3.27Å; A362-V366 VanDerWaalsContact O-CG2 3.27Å; A362-V366 WeakPolarHBondContact O-CG2 3.23Å; A362-V366 PolarHBondContact O-N 3.33Å
363	K	95.9	Very high	94.6	Very high	120 Å²	120	83.6 Å²	83.6	52%	0.522	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-43	171.9	-78.9	179.3	176.9	-175.5	0	112	V359 S360 K361 Q367	V359-K363 HydrophobicContact CG1-CD 4.12Å; V359-K363 HydrophobicContact CG1-CG 4.29Å; V359-K363 WeakPolarHBondContact O-CB 3.44Å; V359-K363 VanDerWaalsContact O-CG 3.3Å; V359-K363 WeakPolarHBondContact O-CG 3.42Å; V359-K363 PolarHBondContact O-N 3.43Å; S360-K363 PolarHBondContact O-N 3.1Å; K361-K363 PolarHBondContact O-N 3.3Å; K363-Q367 WeakPolarHBondContact O-CB 3.26Å; K363-Q367 VanDerWaalsContact O-CG 3.29Å; K363-Q367 WeakPolarHBondContact O-CG 3.33Å; K363-Q367 PolarHBondContact O-N 2.85Å
364	C	95.3	Very high	94.4	Very high	65 Å²	65	83.7 Å²	83.7	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-42.4	172.9	-68.3	0	0	0	0	112.2	S360 K361 Q367 N368	S360-C364 PolarHBondContact O-N 3.17Å; S360-C364 VanDerWaalsContact O-N 3.07Å; S360-C364 PolarHBondContact O-SG 2.92Å; S360-C364 VanDerWaalsContact O-SG 3.34Å; K361-C364 CarbonylContact O-C 3.47Å; K361-C364 WeakPolarHBondContact O-CA 3.07Å; K361-C364 WeakPolarHBondContact O-CB 3.42Å; K361-C364 PolarHBondContact O-N 3.3Å; C364-Q367 PolarHBondContact O-N 3.19Å; C364-N368 WeakPolarHBondContact O-CB 3.37Å; C364-N368 VanDerWaalsContact O-CG 3.24Å; C364-N368 PolarHBondContact O-N 3.18Å; C364-N368 PolarHBondContact O-ND2 3.09Å
365	D	96.3	Very high	94.1	Very high	89 Å²	89	81.2 Å²	81.2	48%	0.476	42%	0.415	S	S	.	.	H	α-helix	trans	-65.4	-43	-179.2	-54.6	-34.1	0	0	0	110.8	K361 A362 N368 K369	K361-D365 VanDerWaalsContact C-OD2 3.28Å; K361-D365 PolarHBondContact O-N 2.99Å; K361-D365 VanDerWaalsContact O-OD2 3.06Å; A362-D365 PolarHBondContact O-N 3.3Å; D365-N368 PolarHBondContact O-N 2.83Å; D365-K369 WeakPolarHBondContact O-CG 3.49Å; D365-K369 PolarHBondContact O-N 2.88Å
366	V	95.9	Very high	93.8	Very high	89 Å²	89	86.6 Å²	86.6	54%	0.539	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-43	172.1	169.6	0	0	0	0	111.4	A362 N368 K369 V370	A362-V366 WeakPolarHBondContact O-CB 3.27Å; A362-V366 VanDerWaalsContact O-CG2 3.27Å; A362-V366 WeakPolarHBondContact O-CG2 3.23Å; A362-V366 PolarHBondContact O-N 3.33Å; V366-N368 VanDerWaalsContact C-N 3.28Å; V366-N368 PolarHBondContact O-N 3.45Å; V366-K369 PolarHBondContact O-N 3.05Å; V366-V370 HydrophobicContact CG1-CG2 4.36Å; V366-V370 WeakPolarHBondContact O-CB 3.15Å; V366-V370 WeakPolarHBondContact O-CG2 3.25Å; V366-V370 PolarHBondContact O-N 3.27Å
367	Q	95.6	Very high	93.6	Very high	99 Å²	99	94.6 Å²	94.6	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-60.6	-37.2	174.2	-79	-178.7	16.4	0	0	112.4	K363 C364 R371	K363-Q367 WeakPolarHBondContact O-CB 3.26Å; K363-Q367 VanDerWaalsContact O-CG 3.29Å; K363-Q367 WeakPolarHBondContact O-CG 3.33Å; K363-Q367 PolarHBondContact O-N 2.85Å; C364-Q367 PolarHBondContact O-N 3.19Å; Q367-R371 WeakPolarHBondContact O-CB 3.17Å; Q367-R371 WeakPolarHBondContact O-CG 3.39Å; Q367-R371 PolarHBondContact O-N 2.96Å
368	N	94.6	Very high	93.2	Very high	83 Å²	83	99.7 Å²	99.7	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-39.5	177.7	-70.9	-17.5	0	0	0	111.8	C364 D365 V366 R371 A372	C364-N368 WeakPolarHBondContact O-CB 3.37Å; C364-N368 VanDerWaalsContact O-CG 3.24Å; C364-N368 PolarHBondContact O-N 3.18Å; C364-N368 PolarHBondContact O-ND2 3.09Å; D365-N368 PolarHBondContact O-N 2.83Å; V366-N368 VanDerWaalsContact C-N 3.28Å; V366-N368 PolarHBondContact O-N 3.45Å; N368-R371 PolarHBondContact O-N 2.86Å; N368-R371 PolarHBondContact OD1-NH1 3.23Å; N368-A372 PolarHBondContact O-N 2.99Å
369	K	95.5	Very high	92.4	Very high	142 Å²	142	94.8 Å²	94.8	62%	0.617	48%	0.478	S	S	*	.	H	α-helix	trans	-62.4	-46.1	171.5	-70.5	-179.7	-179	-169.2	0	112	D365 V366 R371 A372 E373	D365-K369 WeakPolarHBondContact O-CG 3.49Å; D365-K369 PolarHBondContact O-N 2.88Å; V366-K369 PolarHBondContact O-N 3.05Å; K369-R371 VanDerWaalsContact C-N 3.32Å; K369-R371 PolarHBondContact O-N 3.29Å; K369-A372 WeakPolarHBondContact O-CB 3.47Å; K369-A372 PolarHBondContact O-N 2.65Å; K369-A372 VanDerWaalsContact O-N 3.09Å; K369-E373 WeakPolarHBondContact O-CG 3.42Å; K369-E373 PolarHBondContact O-N 2.89Å
370	V	95.1	Very high	91.6	Very high	69 Å²	69	94.1 Å²	94.1	42%	0.418	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-38.6	175.3	170.1	0	0	0	0	111.7	V366 I374	V366-V370 HydrophobicContact CG1-CG2 4.36Å; V366-V370 WeakPolarHBondContact O-CB 3.15Å; V366-V370 WeakPolarHBondContact O-CG2 3.25Å; V366-V370 PolarHBondContact O-N 3.27Å; V370-I374 HydrophobicContact CG1-CD1 3.79Å; V370-I374 WeakPolarHBondContact O-CB 3.48Å; V370-I374 WeakPolarHBondContact O-CD1 3.28Å; V370-I374 WeakPolarHBondContact O-CG1 3.44Å; V370-I374 PolarHBondContact O-N 3.4Å
371	R	91.2	Very high	90.8	Very high	139 Å²	139	97 Å²	97	53%	0.525	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-42.1	172.1	-74.8	166.5	-173	131.7	10.3	112	Q367 N368 K369 I374 L375	Q367-R371 WeakPolarHBondContact O-CB 3.17Å; Q367-R371 WeakPolarHBondContact O-CG 3.39Å; Q367-R371 PolarHBondContact O-N 2.96Å; N368-R371 PolarHBondContact O-N 2.86Å; N368-R371 PolarHBondContact OD1-NH1 3.23Å; K369-R371 VanDerWaalsContact C-N 3.32Å; K369-R371 PolarHBondContact O-N 3.29Å; R371-I374 PolarHBondContact O-N 2.9Å; R371-L375 WeakPolarHBondContact O-CB 3.47Å; R371-L375 PolarHBondContact O-N 3.48Å
372	A	90.6	Very high	89.6	Confident	42 Å²	42	98.5 Å²	98.5	35%	0.347	50%	0.497	S	S	.	.	H	α-helix	trans	-66.3	-49.1	176.9	0	0	0	0	0	111.8	N368 K369 I374 L375 E376	N368-A372 PolarHBondContact O-N 2.99Å; K369-A372 WeakPolarHBondContact O-CB 3.47Å; K369-A372 PolarHBondContact O-N 2.65Å; K369-A372 VanDerWaalsContact O-N 3.09Å; A372-I374 PolarHBondContact O-N 3.07Å; A372-L375 CarbonylContact O-C 3.42Å; A372-L375 WeakPolarHBondContact O-CA 3.46Å; A372-L375 WeakPolarHBondContact O-CB 3.42Å; A372-L375 PolarHBondContact O-N 2.93Å; A372-E376 WeakPolarHBondContact O-CG 3.45Å; A372-E376 PolarHBondContact O-N 3.43Å
373	E	92.7	Very high	88.3	Confident	76 Å²	76	103.9 Å²	103.9	36%	0.355	51%	0.513	S	S	.	.	H	α-helix	trans	-56.9	-36.1	174.9	-74	178.6	-128.9	0	0	112.6	K369 R377	K369-E373 WeakPolarHBondContact O-CG 3.42Å; K369-E373 PolarHBondContact O-N 2.89Å; E373-R377 WeakPolarHBondContact O-CB 3.48Å; E373-R377 WeakPolarHBondContact O-CG 3.22Å; E373-R377 PolarHBondContact O-N 3.03Å; E373-R377 IonicContact OE2-CZ 3.35Å; E373-R377 IonicContact OE2-NH1 2.67Å; E373-R377 IonicContact OE2-NH2 3.23Å; E373-R377 PolarHBondContact OE2-NH2 2.85Å
374	I	90.2	Very high	87.2	Confident	87 Å²	87	104.2 Å²	104.2	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-68.9	-45	174	-72.5	167.2	0	0	0	110.4	V370 R371 A372 E376 R377 Y378	V370-I374 HydrophobicContact CG1-CD1 3.79Å; V370-I374 WeakPolarHBondContact O-CB 3.48Å; V370-I374 WeakPolarHBondContact O-CD1 3.28Å; V370-I374 WeakPolarHBondContact O-CG1 3.44Å; V370-I374 PolarHBondContact O-N 3.4Å; R371-I374 PolarHBondContact O-N 2.9Å; A372-I374 PolarHBondContact O-N 3.07Å; I374-E376 VanDerWaalsContact C-N 3.31Å; I374-E376 PolarHBondContact O-N 2.99Å; I374-R377 PolarHBondContact O-N 3.23Å; I374-Y378 HydrophobicContact CG2-CD2 4.01Å; I374-Y378 WeakPolarHBondContact O-CB 3.18Å; I374-Y378 WeakPolarHBondContact O-CD2 3.35Å; I374-Y378 PolarHBondContact O-N 3.44Å
375	L	87.4	Confident	85.9	Confident	49 Å²	49	107 Å²	107	26%	0.257	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-37.3	178	-161.1	76	0	0	0	112.2	R371 A372 G379 H381 L384	R371-L375 WeakPolarHBondContact O-CB 3.47Å; R371-L375 PolarHBondContact O-N 3.48Å; A372-L375 CarbonylContact O-C 3.42Å; A372-L375 WeakPolarHBondContact O-CA 3.46Å; A372-L375 WeakPolarHBondContact O-CB 3.42Å; A372-L375 PolarHBondContact O-N 2.93Å; L375-G379 CarbonylContact O-C 3.56Å; L375-G379 WeakPolarHBondContact O-CA 3.34Å; L375-G379 PolarHBondContact O-N 3.43Å; L375-H381 HydrophobicContact CD2-CB 4.29Å; L375-L384 HydrophobicContact CD1-CD1 3.67Å; L375-L384 HydrophobicContact CD1-CG 4.45Å; L375-L384 HydrophobicContact CD2-CD1 3.93Å; L375-L384 HydrophobicContact CG-CD1 4.49Å
376	E	87.6	Confident	84.6	Confident	157 Å²	157	107.7 Å²	107.7	73%	0.734	54%	0.539	S	S	*	.	H	α-helix	trans	-69.7	-42.3	175.9	-72	168.6	-168.5	0	0	112.2	A372 I374	A372-E376 WeakPolarHBondContact O-CG 3.45Å; A372-E376 PolarHBondContact O-N 3.43Å; I374-E376 VanDerWaalsContact C-N 3.31Å; I374-E376 PolarHBondContact O-N 2.99Å
377	R	89.6	Confident	83.5	Confident	172 Å²	172	108.5 Å²	108.5	65%	0.649	54%	0.538	S	S	*	.	H	α-helix	trans	-76.3	-31.8	-177.9	-72.8	175.2	-167.4	147.5	17	114.2	E373 I374	E373-R377 WeakPolarHBondContact O-CB 3.48Å; E373-R377 WeakPolarHBondContact O-CG 3.22Å; E373-R377 PolarHBondContact O-N 3.03Å; E373-R377 IonicContact OE2-CZ 3.35Å; E373-R377 IonicContact OE2-NH1 2.67Å; E373-R377 IonicContact OE2-NH2 3.23Å; E373-R377 PolarHBondContact OE2-NH2 2.85Å; I374-R377 PolarHBondContact O-N 3.23Å
378	Y	87	Confident	82.4	Confident	195 Å²	195	107.3 Å²	107.3	77%	0.765	54%	0.54	S	S	*	.	H	α-helix	trans	-112	-9.6	-174.5	-64.8	-79.7	0	0	0	114	I374	I374-Y378 HydrophobicContact CG2-CD2 4.01Å; I374-Y378 WeakPolarHBondContact O-CB 3.18Å; I374-Y378 WeakPolarHBondContact O-CD2 3.35Å; I374-Y378 PolarHBondContact O-N 3.44Å
379	G	80	Confident	81.2	Confident	43 Å²	43	110.5 Å²	110.5	44%	0.443	55%	0.549	S	S	.	.			trans	75.4	-170.3	-174	0	0	0	0	0	113.4	L375	L375-G379 CarbonylContact O-C 3.56Å; L375-G379 WeakPolarHBondContact O-CA 3.34Å; L375-G379 PolarHBondContact O-N 3.43Å
380	G	76.9	Confident	80	Confident	31 Å²	31	110.2 Å²	110.2	32%	0.32	55%	0.55	S	S	.	*			trans	106	11.5	175.1	0	0	0	0	0	116.5	E382 H383	G380-E382 PolarHBondContact O-N 2.92Å; G380-H383 PolarHBondContact O-N 3.34Å
381	H	76.9	Confident	78.7	Confident	112 Å²	112	113.1 Å²	113.1	52%	0.519	56%	0.563	S	S	.	*	H	α-helix	trans	-54.5	-40.5	171.8	-163.6	-81.6	0	0	0	111.6	L375 H383 L384 E385	L375-H381 HydrophobicContact CD2-CB 4.29Å; H381-H383 PolarHBondContact O-N 3.01Å; H381-L384 PolarHBondContact O-N 2.87Å; H381-E385 IonicContact CE1-OE1 2.74Å; H381-E385 PolarHBondContact CE1-OE1 3.39Å; H381-E385 VanDerWaalsContact CE1-OE1 3.26Å; H381-E385 IonicContact CG-OE1 2.8Å; H381-E385 IonicContact ND1-OE1 3.93Å; H381-E385 PolarHBondContact ND1-OE1 2.68Å; H381-E385 PolarHBondContact O-N 2.83Å; H381-E385 VanDerWaalsContact O-N 3.12Å
382	E	72.4	Confident	77.7	Confident	160 Å²	160	111.6 Å²	111.6	75%	0.748	56%	0.564	S	S	*	*	H	α-helix	trans	-56.9	-13.1	173.5	-57.9	177.5	-175.3	0	0	114.8	G380	G380-E382 PolarHBondContact O-N 2.92Å
383	H	68	Low	76.7	Confident	163 Å²	163	115.2 Å²	115.2	76%	0.755	58%	0.577	S	S	*	*	H	α-helix	trans	-106.5	-10.1	177.3	-58.2	-14.1	0	0	0	112.9	G380 H381	G380-H383 PolarHBondContact O-N 3.34Å; H381-H383 PolarHBondContact O-N 3.01Å
384	L	71.5	Confident	75.6	Confident	127 Å²	127	114.8 Å²	114.8	67%	0.665	59%	0.593	S	S	*	*	H	α-helix	trans	-92	-28	170.4	-65.6	-179.8	0	0	0	111.9	L375 H381 S386	L375-L384 HydrophobicContact CD1-CD1 3.67Å; L375-L384 HydrophobicContact CD1-CG 4.45Å; L375-L384 HydrophobicContact CD2-CD1 3.93Å; L375-L384 HydrophobicContact CG-CD1 4.49Å; H381-L384 PolarHBondContact O-N 2.87Å; L384-S386 PolarHBondContact O-N 3.09Å; L384-S386 VanDerWaalsContact O-N 3.1Å
385	E	68.7	Low	74.7	Confident	123 Å²	123	116.9 Å²	116.9	58%	0.575	60%	0.601	S	S	*	*	S	Bend	trans	-64.2	107	169.9	-74	178.6	-127.1	0	0	110.4	H381 I387	H381-E385 IonicContact CE1-OE1 2.74Å; H381-E385 PolarHBondContact CE1-OE1 3.39Å; H381-E385 VanDerWaalsContact CE1-OE1 3.26Å; H381-E385 IonicContact CG-OE1 2.8Å; H381-E385 IonicContact ND1-OE1 3.93Å; H381-E385 PolarHBondContact ND1-OE1 2.68Å; H381-E385 PolarHBondContact O-N 2.83Å; H381-E385 VanDerWaalsContact O-N 3.12Å; E385-I387 PolarHBondContact O-N 2.81Å
386	S	68.4	Low	73.7	Confident	104 Å²	104	124.6 Å²	124.6	73%	0.727	63%	0.627	S	S	*	*			trans	-63.6	121	175.6	65.3	0	0	0	0	109.8	L384	L384-S386 PolarHBondContact O-N 3.09Å; L384-S386 VanDerWaalsContact O-N 3.1Å
387	I	73.8	Confident	72.9	Confident	105 Å²	105	123.8 Å²	123.8	54%	0.538	62%	0.623	S	S	.	*			trans	-38.1	132.1	171.3	-63.2	170.2	0	0	0	109.8	E385 K389 L391 I392	E385-I387 PolarHBondContact O-N 2.81Å; I387-K389 PolarHBondContact O-N 2.87Å; I387-L391 HydrophobicContact CG2-CB 3.5Å; I387-L391 HydrophobicContact CG2-CD1 4.23Å; I387-I392 HydrophobicContact CB-CD1 4.24Å; I387-I392 HydrophobicContact CB-CG1 3.94Å; I387-I392 HydrophobicContact CG2-CG1 3.97Å; I387-I392 WeakPolarHBondContact O-CD1 3.48Å; I387-I392 WeakPolarHBondContact O-CG1 3.47Å
388	P	73.2	Confident	71.7	Confident	75 Å²	75	120.3 Å²	120.3	49%	0.487	63%	0.625	S	S	.	*			trans	-48	139.5	-178	-31.9	35.5	0	0	0	113.2	E390 L391 I392	P388-E390 PolarHBondContact O-N 3.37Å; P388-L391 HydrophobicContact CB-CD1 4.33Å; P388-L391 HydrophobicContact CG-CD1 4.18Å; P388-L391 WeakPolarHBondContact O-CA 3.29Å; P388-L391 WeakPolarHBondContact O-CB 3.37Å; P388-L391 PolarHBondContact O-N 3.31Å; P388-I392 PolarHBondContact O-N 3.27Å
389	K	68.6	Low	71	Confident	149 Å²	149	119.1 Å²	119.1	65%	0.648	62%	0.621	S	S	*	*	H	α-helix	trans	-54.6	-33.4	-174	-63.7	171.9	-170.2	157.8	0	112.6	I387 I392 L393	I387-K389 PolarHBondContact O-N 2.87Å; K389-I392 PolarHBondContact O-N 3.05Å; K389-L393 VanDerWaalsContact O-CB 3.28Å; K389-L393 WeakPolarHBondContact O-CB 3.5Å; K389-L393 VanDerWaalsContact O-CG 3.26Å; K389-L393 WeakPolarHBondContact O-CG 3.2Å; K389-L393 PolarHBondContact O-N 2.84Å
390	E	69.3	Low	70.8	Confident	136 Å²	136	118.7 Å²	118.7	64%	0.636	61%	0.613	S	S	*	*	H	α-helix	trans	-59.8	-44.1	174.9	-67.2	154.7	-145.9	0	0	112.3	P388 G394 Q395	P388-E390 PolarHBondContact O-N 3.37Å; E390-G394 WeakPolarHBondContact O-CA 3.44Å; E390-G394 PolarHBondContact O-N 3.24Å; E390-Q395 PolarHBondContact O-N 3.48Å
391	L	69.2	Low	70.9	Confident	130 Å²	130	120.1 Å²	120.1	68%	0.681	61%	0.611	S	S	*	*	H	α-helix	trans	-73.1	-34.5	175.7	-78.9	161.7	0	0	0	112.2	I387 P388	I387-L391 HydrophobicContact CG2-CB 3.5Å; I387-L391 HydrophobicContact CG2-CD1 4.23Å; P388-L391 HydrophobicContact CB-CD1 4.33Å; P388-L391 HydrophobicContact CG-CD1 4.18Å; P388-L391 WeakPolarHBondContact O-CA 3.29Å; P388-L391 WeakPolarHBondContact O-CB 3.37Å; P388-L391 PolarHBondContact O-N 3.31Å
392	I	69.4	Low	71.2	Confident	107 Å²	107	121.2 Å²	121.2	55%	0.549	61%	0.612	S	S	.	*	H	α-helix	trans	-67.7	-39	173.9	-67.6	-178.9	0	0	0	111.7	I387 P388 K389	I387-I392 HydrophobicContact CB-CD1 4.24Å; I387-I392 HydrophobicContact CB-CG1 3.94Å; I387-I392 HydrophobicContact CG2-CG1 3.97Å; I387-I392 WeakPolarHBondContact O-CD1 3.48Å; I387-I392 WeakPolarHBondContact O-CG1 3.47Å; P388-I392 PolarHBondContact O-N 3.27Å; K389-I392 PolarHBondContact O-N 3.05Å
393	L	70.1	Confident	71.6	Confident	118 Å²	118	114.6 Å²	114.6	62%	0.618	58%	0.583	S	S	*	*	H	α-helix	trans	-92	-14.3	-175.4	-65.5	171.4	0	0	0	113.5	K389 Q395	K389-L393 VanDerWaalsContact O-CB 3.28Å; K389-L393 WeakPolarHBondContact O-CB 3.5Å; K389-L393 VanDerWaalsContact O-CG 3.26Å; K389-L393 WeakPolarHBondContact O-CG 3.2Å; K389-L393 PolarHBondContact O-N 2.84Å; L393-Q395 HydrophobicContact CB-CB 4.39Å; L393-Q395 PolarHBondContact O-N 2.95Å
394	G	69.5	Low	72.2	Confident	68 Å²	68	113.7 Å²	113.7	70%	0.701	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	64	23.8	-174.8	0	0	0	0	0	113.3	E390	E390-G394 WeakPolarHBondContact O-CA 3.44Å; E390-G394 PolarHBondContact O-N 3.24Å
395	Q	72.2	Confident	72.5	Confident	131 Å²	131	113.3 Å²	113.3	61%	0.612	60%	0.595	S	S	*	*			trans	-133.9	116	-171.1	-73.1	179.1	-12.5	0	0	109.8	E390 L393	E390-Q395 PolarHBondContact O-N 3.48Å; L393-Q395 HydrophobicContact CB-CB 4.39Å; L393-Q395 PolarHBondContact O-N 2.95Å
396	W	66.2	Low	72.9	Confident	210 Å²	210	110 Å²	110	80%	0.795	59%	0.594	S	S	*	*			trans	-90.9	-11	175.9	56.3	-89.6	0	0	0	112.6
397	E	69.8	Low	73.3	Confident	140 Å²	140	114.6 Å²	114.6	65%	0.654	60%	0.595	S	S	*	*			trans	-90.3	112.7	176.5	-64.5	-173.5	151	0	0	111.1
398	S	65.6	Low	73	Confident	99 Å²	99	114.8 Å²	114.8	69%	0.692	60%	0.595	S	S	*	*			trans	-80.4	119.1	167.8	53	0	0	0	0	110.2	A400	S398-A400 PolarHBondContact O-N 2.97Å
399	Y	71	Confident	72.9	Confident	171 Å²	171	116.8 Å²	116.8	67%	0.671	60%	0.6	S	S	*	*			trans	-63.2	108.5	-176.2	174.8	-103.9	0	0	0	112.2	E401 G411	Y399-E401 HydrophobicContact CE1-CG 3.67Å; Y399-G411 WeakPolarHBondContact O-CA 3.45Å
400	A	76.1	Confident	73	Confident	34 Å²	34	117.7 Å²	117.7	28%	0.281	60%	0.6	S	S	.	*			trans	-114.3	118.6	-179.1	0	0	0	0	0	112.8	S398 Y402 R410	S398-A400 PolarHBondContact O-N 2.97Å; A400-Y402 HydrophobicContact CB-CD2 4.34Å; A400-Y402 HydrophobicContact CB-CE2 3.69Å; A400-R410 CarbonylContact C-O 3.59Å; A400-R410 WeakPolarHBondContact CA-O 3.2Å
401	E	79.9	Confident	72.8	Confident	60 Å²	60	113 Å²	113	28%	0.28	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.6	122.7	170	-65.3	170.8	-159	0	0	109.1	Y399 M408 I409 R410	Y399-E401 HydrophobicContact CE1-CG 3.67Å; E401-M408 CarbonylContact O-C 3.56Å; E401-M408 WeakPolarHBondContact O-CA 3.38Å; E401-I409 HydrophobicContact CB-CB 4.21Å; E401-I409 PolarHBondContact O-N 3.05Å; E401-R410 HydrophobicContact CB-CB 3.92Å; E401-R410 HydrophobicContact CG-CB 3.98Å; E401-R410 PolarHBondContact N-O 3.26Å; E401-R410 PolarHBondContact O-N 3.03Å; E401-R410 WeakPolarHBondContact OE1-CD 3.46Å; E401-R410 WeakPolarHBondContact OE2-CB 3.44Å
402	Y	82.7	Confident	72.5	Confident	135 Å²	135	109.7 Å²	109.7	53%	0.529	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.8	145.5	172.3	-66	-102.2	0	0	0	111	A400 R407 M408	A400-Y402 HydrophobicContact CB-CD2 4.34Å; A400-Y402 HydrophobicContact CB-CE2 3.69Å; Y402-R407 CarbonylContact C-O 3.56Å; Y402-M408 HydrophobicContact CD1-CG 3.87Å; Y402-M408 HydrophobicContact CE1-CE 3.91Å; Y402-M408 HydrophobicContact CE1-CG 3.52Å
403	S	80.3	Confident	72.2	Confident	22 Å²	22	112.5 Å²	112.5	15%	0.154	59%	0.591	C	S	.	*			trans	-69	160.4	166.8	72.3	0	0	0	0	110.9	T405 G406 R407	S403-T405 PolarHBondContact O-N 3.44Å; S403-T405 PolarHBondContact OG-N 2.97Å; S403-T405 VanDerWaalsContact OG-N 3.15Å; S403-T405 PolarHBondContact OG-OG1 3.45Å; S403-G406 PolarHBondContact O-N 3.18Å; S403-G406 PolarHBondContact OG-N 2.99Å; S403-R407 PolarHBondContact N-O 2.74Å; S403-R407 PolarHBondContact OG-N 3.38Å; S403-R407 PolarHBondContact OG-O 2.91Å
404	P	80.1	Confident	72	Confident	144 Å²	144	116.3 Å²	116.3	94%	0.935	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-6.4	166.6	-24.6	35.3	0	0	0	114.7
405	T	78.7	Confident	71.7	Confident	118 Å²	118	118.7 Å²	118.7	72%	0.724	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	16.4	175.7	53.4	0	0	0	0	112.9	S403 R407	S403-T405 PolarHBondContact O-N 3.44Å; S403-T405 PolarHBondContact OG-N 2.97Å; S403-T405 VanDerWaalsContact OG-N 3.15Å; S403-T405 PolarHBondContact OG-OG1 3.45Å; T405-R407 VanDerWaalsContact C-N 3.3Å; T405-R407 PolarHBondContact O-N 3.33Å
406	G	77.5	Confident	71.5	Confident	54 Å²	54	118.7 Å²	118.7	56%	0.557	61%	0.614	S	S	*	*	S	Bend	trans	75.5	4.6	173.8	0	0	0	0	0	116.1	S403	S403-G406 PolarHBondContact O-N 3.18Å; S403-G406 PolarHBondContact OG-N 2.99Å
407	R	75.2	Confident	71.7	Confident	200 Å²	200	115.8 Å²	115.8	76%	0.755	62%	0.619	S	S	*	*			trans	-85.1	128.8	175.2	-73.6	-170.9	171.4	-155.9	-2.5	110.7	Y402 S403 T405 I409	Y402-R407 CarbonylContact C-O 3.56Å; S403-R407 PolarHBondContact N-O 2.74Å; S403-R407 PolarHBondContact OG-N 3.38Å; S403-R407 PolarHBondContact OG-O 2.91Å; T405-R407 VanDerWaalsContact C-N 3.3Å; T405-R407 PolarHBondContact O-N 3.33Å; R407-I409 PolarHBondContact O-N 2.85Å
408	M	68.4	Low	71.7	Confident	109 Å²	109	117.4 Å²	117.4	54%	0.537	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.4	124.7	170.7	-59.8	173.3	-163.5	0	0	110.1	E401 Y402 A412	E401-M408 CarbonylContact O-C 3.56Å; E401-M408 WeakPolarHBondContact O-CA 3.38Å; Y402-M408 HydrophobicContact CD1-CG 3.87Å; Y402-M408 HydrophobicContact CE1-CE 3.91Å; Y402-M408 HydrophobicContact CE1-CG 3.52Å; M408-A412 HydrophobicContact SD-CB 3.86Å
409	I	71.3	Confident	72.1	Confident	117 Å²	117	115.6 Å²	115.6	60%	0.6	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.7	-36.3	176	-63.2	173.6	0	0	0	110	E401 R407	E401-I409 HydrophobicContact CB-CB 4.21Å; E401-I409 PolarHBondContact O-N 3.05Å; R407-I409 PolarHBondContact O-N 2.85Å
410	R	69.7	Low	72.1	Confident	168 Å²	168	118.8 Å²	118.8	63%	0.634	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-156.9	150	-173.1	-158.3	-173.3	-168	117	4.3	109.9	A400 E401	A400-R410 CarbonylContact C-O 3.59Å; A400-R410 WeakPolarHBondContact CA-O 3.2Å; E401-R410 HydrophobicContact CB-CB 3.92Å; E401-R410 HydrophobicContact CG-CB 3.98Å; E401-R410 PolarHBondContact N-O 3.26Å; E401-R410 PolarHBondContact O-N 3.03Å; E401-R410 WeakPolarHBondContact OE1-CD 3.46Å; E401-R410 WeakPolarHBondContact OE2-CB 3.44Å
411	G	65.9	Low	71.6	Confident	39 Å²	39	125.9 Å²	125.9	40%	0.402	64%	0.643	S	S	.	*	S	Bend	trans	125.5	-53.2	166.8	0	0	0	0	0	114.6	Y399	Y399-G411 WeakPolarHBondContact O-CA 3.45Å
412	A	63.5	Low	71	Confident	60 Å²	60	130.7 Å²	130.7	50%	0.496	67%	0.666	S	S	.	*	S	Bend	trans	-70.7	142.1	177.9	0	0	0	0	0	112.3	M408	M408-A412 HydrophobicContact SD-CB 3.86Å
413	E	62.8	Low	70.4	Confident	166 Å²	166	130 Å²	130	78%	0.776	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-65.6	148.3	162.5	-63.6	-167.5	161	0	0	109.5
414	K	65	Low	70	Confident	197 Å²	197	135.5 Å²	135.5	86%	0.857	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-74.2	124.4	-176.9	-65.4	179.4	-178.1	178	0	109.2
415	P	64.4	Low	69.6	Low	119 Å²	119	132.7 Å²	132.7	77%	0.773	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-61.4	141.3	174.9	26.1	-33.9	0	0	0	110.3
416	T	67	Low	69.4	Low	130 Å²	130	131 Å²	131	80%	0.798	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-64.1	138.4	172.3	42.7	0	0	0	0	110	K418	T416-K418 PolarHBondContact O-N 2.86Å
417	V	70.5	Confident	69.4	Low	149 Å²	149	132.6 Å²	132.6	90%	0.903	65%	0.654	S	S	*	*			trans	-77	106.5	-177.7	-178.7	0	0	0	0	108.8
418	K	70	Confident	69.5	Low	175 Å²	175	126.6 Å²	126.6	76%	0.761	64%	0.636	S	S	*	*			trans	-71.6	156.4	165.9	-63	-167.4	174.1	-164.1	0	110.4	T416	T416-K418 PolarHBondContact O-N 2.86Å
419	S	74.3	Confident	70.2	Confident	61 Å²	61	126.6 Å²	126.6	43%	0.427	64%	0.639	S	S	.	*			trans	-70.2	173.4	174.9	82.3	0	0	0	0	111.8	Y421 E423	S419-Y421 PolarHBondContact O-N 3.3Å; S419-Y421 PolarHBondContact OG-N 3.3Å; S419-Y421 PolarHBondContact OG-O 2.91Å; S419-E423 WeakPolarHBondContact CB-OE1 3.48Å; S419-E423 PolarHBondContact N-OE1 2.98Å; S419-E423 PolarHBondContact OG-OE1 3.31Å
420	R	71.6	Confident	70.8	Confident	238 Å²	238	121.3 Å²	121.3	90%	0.898	61%	0.611	S	S	*	*	S	Bend	trans	-73.7	-14.7	175.7	176.1	171.7	172.6	178.2	-2.5	112.7
421	Y	64	Low	71.5	Confident	182 Å²	182	118.5 Å²	118.5	71%	0.714	61%	0.613	S	S	*	*	S	Bend	trans	-101.8	150.6	-174.5	-61.8	-83.1	0	0	0	110.2	S419 E423	S419-Y421 PolarHBondContact O-N 3.3Å; S419-Y421 PolarHBondContact OG-N 3.3Å; S419-Y421 PolarHBondContact OG-O 2.91Å; Y421-E423 PolarHBondContact O-N 3.35Å; Y421-E423 VanDerWaalsContact O-N 3.07Å
422	E	68.3	Low	72.4	Confident	162 Å²	162	117.3 Å²	117.3	76%	0.757	60%	0.599	S	S	*	*			trans	-76.3	97.4	172.2	-63.7	-180	168.5	0	0	108	V425	E422-V425 HydrophobicContact CB-CB 4.27Å; E422-V425 HydrophobicContact CB-CG2 3.59Å; E422-V425 PolarHBondContact O-N 3.17Å
423	E	69.8	Low	73.5	Confident	121 Å²	121	119 Å²	119	57%	0.565	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	142.1	174.2	-72.9	149.2	-145.3	0	0	109.9	S419 Y421 V425	S419-E423 WeakPolarHBondContact CB-OE1 3.48Å; S419-E423 PolarHBondContact N-OE1 2.98Å; S419-E423 PolarHBondContact OG-OE1 3.31Å; Y421-E423 PolarHBondContact O-N 3.35Å; Y421-E423 VanDerWaalsContact O-N 3.07Å; E423-V425 VanDerWaalsContact C-N 3.29Å; E423-V425 PolarHBondContact O-N 3.16Å
424	D	71	Confident	74.6	Confident	137 Å²	137	114.9 Å²	114.9	73%	0.733	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	64	9.9	-176.7	-53	-40.2	0	0	0	118.1	F426	D424-F426 HydrophobicContact CB-CE2 4.27Å; D424-F426 VanDerWaalsContact O-CD2 3.29Å; D424-F426 WeakPolarHBondContact O-CD2 3.42Å; D424-F426 PolarHBondContact O-N 3.01Å
425	V	71.8	Confident	75.5	Confident	85 Å²	85	106.9 Å²	106.9	52%	0.515	55%	0.553	S	S	.	*			trans	-84.5	100.6	170.7	-178.2	0	0	0	0	111.2	E422 E423	E422-V425 HydrophobicContact CB-CB 4.27Å; E422-V425 HydrophobicContact CB-CG2 3.59Å; E422-V425 PolarHBondContact O-N 3.17Å; E423-V425 VanDerWaalsContact C-N 3.29Å; E423-V425 PolarHBondContact O-N 3.16Å
426	F	75.8	Confident	76.5	Confident	81 Å²	81	103.6 Å²	103.6	36%	0.355	53%	0.533	S	S	.	.			trans	-107.2	126	177.1	-51.3	-78.5	0	0	0	112.6	D424 H430 V433	D424-F426 HydrophobicContact CB-CE2 4.27Å; D424-F426 VanDerWaalsContact O-CD2 3.29Å; D424-F426 WeakPolarHBondContact O-CD2 3.42Å; D424-F426 PolarHBondContact O-N 3.01Å; F426-H430 WeakPolarHBondContact CB-O 3.35Å; F426-V433 HydrophobicContact CD1-CG2 4.09Å; F426-V433 HydrophobicContact CE1-CG2 4Å
427	N	77	Confident	77.4	Confident	88 Å²	88	99.2 Å²	99.2	47%	0.471	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-67	149.6	176.9	-60.2	41.2	0	0	0	111.8	N429 H430	N427-N429 VanDerWaalsContact C-N 3.3Å; N427-N429 PolarHBondContact O-N 2.93Å; N427-N429 VanDerWaalsContact O-N 3.09Å; N427-H430 PolarHBondContact O-CD2 2.82Å; N427-H430 PolarHBondContact O-N 2.81Å; N427-H430 VanDerWaalsContact O-N 3.1Å
428	N	77.7	Confident	78.1	Confident	74 Å²	74	98.8 Å²	98.8	40%	0.396	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	48	41.4	161.6	-58.4	0.9	0	0	0	115.9	H430 E454 S455 C457	N428-H430 VanDerWaalsContact C-N 3.26Å; N428-H430 PolarHBondContact O-N 3.42Å; N428-E454 PolarHBondContact ND2-O 3.05Å; N428-S455 WeakPolarHBondContact CB-O 3.03Å; N428-C457 PolarHBondContact O-N 3.3Å
429	N	82.9	Confident	79	Confident	109 Å²	109	93.7 Å²	93.7	58%	0.583	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	61.7	20.1	179.1	-70.9	-8.4	0	0	0	116	N427 Y456 C457	N427-N429 VanDerWaalsContact C-N 3.3Å; N427-N429 PolarHBondContact O-N 2.93Å; N427-N429 VanDerWaalsContact O-N 3.09Å; N429-Y456 HydrophobicContact CB-CE2 4.12Å; N429-Y456 PolarHBondContact ND2-OH 2.89Å; N429-C457 HydrophobicContact CB-CB 4.32Å; N429-C457 WeakPolarHBondContact O-CB 3.02Å; N429-C457 PolarHBondContact O-SG 2.79Å
430	H	83.7	Confident	79.4	Confident	6 Å²	6	97.3 Å²	97.3	3%	0.028	48%	0.477	C	S	.	.			trans	-70.5	149.4	166.8	-66.3	-66.6	0	0	0	110.8	F426 N427 N428 S432 Y445 C447 C448 S455	F426-H430 WeakPolarHBondContact CB-O 3.35Å; N427-H430 PolarHBondContact O-CD2 2.82Å; N427-H430 PolarHBondContact O-N 2.81Å; N427-H430 VanDerWaalsContact O-N 3.1Å; N428-H430 VanDerWaalsContact C-N 3.26Å; N428-H430 PolarHBondContact O-N 3.42Å; H430-S432 VanDerWaalsContact C-N 3.34Å; H430-S432 WeakPolarHBondContact CB-O 3.39Å; H430-Y445 HydrophobicContact CB-CD1 4.01Å; H430-Y445 HydrophobicContact CB-CE1 4.32Å; H430-Y445 AromaticContact CD2-CD1 3.69Å; H430-Y445 AromaticContact CD2-CD2 3.93Å; H430-Y445 AromaticContact CD2-CE1 3.46Å; H430-Y445 VanDerWaalsContact CD2-CE1 3.46Å; H430-Y445 WeakPolarHBondContact CD2-CE1 3.34Å; H430-Y445 AromaticContact CD2-CE2 3.72Å; H430-Y445 AromaticContact CD2-CG 3.91Å; H430-Y445 AromaticContact CD2-CZ 3.48Å; H430-Y445 VanDerWaalsContact CD2-CZ 3.48Å; H430-Y445 AromaticContact CE1-CD2 3.4Å; H430-Y445 VanDerWaalsContact CE1-CD2 3.4Å; H430-Y445 WeakPolarHBondContact CE1-CD2 3.35Å; H430-Y445 AromaticContact CE1-CE2 3.77Å; H430-Y445 AromaticContact CE1-CG 3.63Å; H430-Y445 AromaticContact CG-CD1 3.58Å; H430-Y445 AromaticContact CG-CE1 3.82Å; H430-Y445 AromaticContact CG-CG 3.74Å; H430-Y445 AromaticContact ND1-CD1 3.93Å; H430-Y445 AromaticContact ND1-CD2 3.87Å; H430-Y445 AromaticContact ND1-CG 3.58Å; H430-Y445 AromaticContact NE2-CD2 3.45Å; H430-Y445 WeakPolarHBondContact NE2-CD2 3.41Å; H430-Y445 AromaticContact NE2-CE1 3.95Å; H430-Y445 AromaticContact NE2-CE2 3.29Å; H430-Y445 VanDerWaalsContact NE2-CE2 3.29Å; H430-Y445 WeakPolarHBondContact NE2-CE2 3.2Å; H430-Y445 AromaticContact NE2-CG 3.84Å; H430-Y445 AromaticContact NE2-CZ 3.56Å; H430-C447 PolarHBondContact ND1-SG 2.96Å; H430-C448 PolarHBondContact CE1-SG 2.98Å; H430-S455 PolarHBondContact NE2-O 3.34Å
431	T	84.9	Confident	80.2	Confident	110 Å²	110	88.5 Å²	88.5	68%	0.675	46%	0.46	S	S	*	.	S	Bend	trans	-99.8	20.3	169.7	56.3	0	0	0	0	112.2	C447	T431-C447 VanDerWaalsContact OG1-CB 3.24Å; T431-C447 WeakPolarHBondContact OG1-CB 3.16Å
432	S	85.4	Confident	81.3	Confident	14 Å²	14	85 Å²	85	10%	0.098	45%	0.451	C	S	.	.	S	Bend	trans	-157.3	143.1	-173.7	64	0	0	0	0	110.3	H430 S436 Y445 R446 C447	H430-S432 VanDerWaalsContact C-N 3.34Å; H430-S432 WeakPolarHBondContact CB-O 3.39Å; S432-S436 WeakPolarHBondContact CB-OG 3.13Å; S432-S436 PolarHBondContact OG-OG 3.49Å; S432-Y445 WeakPolarHBondContact O-CD1 3.23Å; S432-R446 PolarHBondContact OG-N 3.02Å; S432-R446 VanDerWaalsContact OG-N 3.16Å; S432-C447 PolarHBondContact OG-N 2.9Å; S432-C447 PolarHBondContact OG-SG 3.43Å
433	V	86	Confident	82.3	Confident	96 Å²	96	84 Å²	84	58%	0.582	44%	0.44	S	S	*	.			trans	-69.6	153.1	178	-173.7	0	0	0	0	111.1	F426 G435 S436	F426-V433 HydrophobicContact CD1-CG2 4.09Å; F426-V433 HydrophobicContact CE1-CG2 4Å; V433-G435 PolarHBondContact O-N 2.94Å; V433-S436 VanDerWaalsContact O-CB 3.22Å; V433-S436 WeakPolarHBondContact O-CB 3.3Å; V433-S436 PolarHBondContact O-N 2.88Å; V433-S436 PolarHBondContact O-OG 2.89Å
434	W	84.8	Confident	83.2	Confident	79 Å²	79	78.2 Å²	78.2	30%	0.299	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	132.3	171.5	176	-102	0	0	0	111.1	W443 Y445 I452 K453	W434-W443 WeakPolarHBondContact CH2-O 3.27Å; W434-W443 HydrophobicContact CZ2-CB 4.16Å; W434-W443 WeakPolarHBondContact CZ2-O 3.37Å; W434-Y445 HydrophobicContact CB-CD1 4.3Å; W434-Y445 HydrophobicContact CB-CE1 3.71Å; W434-Y445 HydrophobicContact CD2-CE2 4.48Å; W434-Y445 HydrophobicContact CE3-CD1 4.32Å; W434-Y445 AromaticContact CE3-CD2 3.62Å; W434-Y445 HydrophobicContact CE3-CD2 3.62Å; W434-Y445 HydrophobicContact CE3-CE1 4.11Å; W434-Y445 AromaticContact CE3-CE2 3.36Å; W434-Y445 HydrophobicContact CE3-CE2 3.36Å; W434-Y445 HydrophobicContact CE3-CG 4.12Å; W434-Y445 AromaticContact CE3-CZ 3.64Å; W434-Y445 AromaticContact CZ3-CD2 3.9Å; W434-Y445 HydrophobicContact CZ3-CD2 3.9Å; W434-Y445 AromaticContact CZ3-CE2 3.79Å; W434-Y445 HydrophobicContact CZ3-CE2 3.79Å; W434-I452 VanDerWaalsContact CZ3-C 3.45Å; W434-K453 HydrophobicContact CD2-CB 4.1Å; W434-K453 HydrophobicContact CD2-CG 4.05Å; W434-K453 HydrophobicContact CE3-CB 4.2Å; W434-K453 HydrophobicContact CE3-CG 4.47Å; W434-K453 HydrophobicContact CG-CG 4.35Å; W434-K453 HydrophobicContact CH2-CB 3.86Å; W434-K453 HydrophobicContact CZ2-CB 3.78Å; W434-K453 HydrophobicContact CZ2-CG 4.44Å; W434-K453 VanDerWaalsContact CZ3-CA 3.46Å; W434-K453 HydrophobicContact CZ3-CB 4.08Å; W434-K453 VanDerWaalsContact CZ3-N 3.3Å
435	G	84	Confident	84.1	Confident	28 Å²	28	72 Å²	72	29%	0.289	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	3.1	-173	0	0	0	0	0	114.4	V433 Y437 W443 G444	V433-G435 PolarHBondContact O-N 2.94Å; G435-Y437 VanDerWaalsContact C-N 3.25Å; G435-Y437 PolarHBondContact O-N 3.07Å; G435-W443 WeakPolarHBondContact O-CZ3 3.41Å; G435-G444 PolarHBondContact N-O 3.34Å
436	S	86.3	Confident	84.8	Confident	50 Å²	50	75.2 Å²	75.2	35%	0.35	38%	0.382	S	S	.	.	S	Bend	trans	-77.3	-7.1	172.1	54.4	0	0	0	0	114.2	S432 V433 G444 R446	S432-S436 WeakPolarHBondContact CB-OG 3.13Å; S432-S436 PolarHBondContact OG-OG 3.49Å; V433-S436 VanDerWaalsContact O-CB 3.22Å; V433-S436 WeakPolarHBondContact O-CB 3.3Å; V433-S436 PolarHBondContact O-N 2.88Å; V433-S436 PolarHBondContact O-OG 2.89Å; S436-G444 PolarHBondContact N-O 3.16Å; S436-R446 WeakPolarHBondContact OG-CB 3.39Å; S436-R446 PolarHBondContact OG-N 2.94Å
437	Y	85.9	Confident	85.3	Confident	39 Å²	39	72 Å²	72	15%	0.153	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151.1	174.6	-176.9	-110.6	0	0	0	110.8	G435 F439 W443 G444 H449 L451	G435-Y437 VanDerWaalsContact C-N 3.25Å; G435-Y437 PolarHBondContact O-N 3.07Å; Y437-F439 HydrophobicContact CE1-CB 3.67Å; Y437-W443 CarbonylContact O-C 3.58Å; Y437-W443 WeakPolarHBondContact O-CA 3.34Å; Y437-G444 PolarHBondContact N-O 2.93Å; Y437-G444 PolarHBondContact O-N 3.18Å; Y437-H449 HydrophobicContact CD1-CB 4.14Å; Y437-H449 AromaticContact CD2-CD2 3.65Å; Y437-H449 AromaticContact CD2-NE2 3.91Å; Y437-H449 HydrophobicContact CE1-CB 3.68Å; Y437-H449 AromaticContact CE1-CG 3.86Å; Y437-H449 HydrophobicContact CE2-CB 4.47Å; Y437-H449 AromaticContact CE2-CD2 3.5Å; Y437-H449 AromaticContact CE2-CE1 3.76Å; Y437-H449 AromaticContact CE2-CG 3.74Å; Y437-H449 AromaticContact CE2-ND1 3.88Å; Y437-H449 AromaticContact CE2-NE2 3.55Å; Y437-H449 AromaticContact CZ-CD2 3.8Å; Y437-H449 AromaticContact CZ-CG 3.53Å; Y437-H449 AromaticContact CZ-ND1 3.68Å; Y437-H449 PolarHBondContact OH-ND1 3.22Å; Y437-L451 HydrophobicContact CD1-CD2 4.05Å; Y437-L451 HydrophobicContact CE1-CD2 4.11Å
438	W	85.8	Confident	85.6	Confident	140 Å²	140	67.9 Å²	67.9	53%	0.53	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	126.4	-178.9	172.8	-101.6	0	0	0	110.1	G441 Q442 W443	W438-G441 VanDerWaalsContact CH2-C 3.48Å; W438-G441 WeakPolarHBondContact CH2-O 3.34Å; W438-Q442 WeakPolarHBondContact CA-O 3.42Å; W438-W443 HydrophobicContact CB-CE3 4.25Å; W438-W443 HydrophobicContact CB-CZ3 4.27Å; W438-W443 AromaticContact CE3-CD2 3.54Å; W438-W443 HydrophobicContact CE3-CD2 3.54Å; W438-W443 AromaticContact CE3-CE2 3.6Å; W438-W443 AromaticContact CE3-CE3 3.88Å; W438-W443 HydrophobicContact CE3-CE3 3.88Å; W438-W443 AromaticContact CE3-CG 3.9Å; W438-W443 HydrophobicContact CE3-CG 3.9Å; W438-W443 HydrophobicContact CE3-CH2 4.33Å; W438-W443 HydrophobicContact CE3-CZ2 4.01Å; W438-W443 HydrophobicContact CE3-CZ3 4.27Å; W438-W443 AromaticContact CE3-NE1 3.93Å; W438-W443 AromaticContact CZ3-CD1 3.8Å; W438-W443 AromaticContact CZ3-CD2 3.94Å; W438-W443 HydrophobicContact CZ3-CD2 3.94Å; W438-W443 AromaticContact CZ3-CE2 3.61Å; W438-W443 HydrophobicContact CZ3-CG 4.07Å; W438-W443 HydrophobicContact CZ3-CZ2 4.11Å; W438-W443 AromaticContact CZ3-NE1 3.51Å
439	F	87.1	Confident	85.9	Confident	67 Å²	67	66.1 Å²	66.1	29%	0.294	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	135	178.4	-173.7	-108	0	0	0	110.6	Y437 G441 Q442 L451 F467	Y437-F439 HydrophobicContact CE1-CB 3.67Å; F439-G441 PolarHBondContact O-N 3.5Å; F439-Q442 PolarHBondContact N-O 2.84Å; F439-Q442 PolarHBondContact O-N 3.39Å; F439-L451 HydrophobicContact CB-CD2 4.36Å; F439-L451 HydrophobicContact CD1-CD1 4.38Å; F439-F467 AromaticContact CE2-CE1 3.78Å; F439-F467 HydrophobicContact CE2-CE1 3.78Å; F439-F467 HydrophobicContact CE2-CZ 4.32Å; F439-F467 HydrophobicContact CZ-CD1 4.45Å; F439-F467 AromaticContact CZ-CE1 3.94Å; F439-F467 HydrophobicContact CZ-CE1 3.94Å
440	N	82.9	Confident	86	Confident	138 Å²	138	61.7 Å²	61.7	74%	0.738	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.1	43	176.9	-69.3	-6.2	0	0	0	115.6
441	G	88.6	Confident	86.2	Confident	53 Å²	53	63.8 Å²	63.8	55%	0.546	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	4.9	178	0	0	0	0	0	115.4	W438 F439	W438-G441 VanDerWaalsContact CH2-C 3.48Å; W438-G441 WeakPolarHBondContact CH2-O 3.34Å; F439-G441 PolarHBondContact O-N 3.5Å
442	Q	86.9	Confident	86.2	Confident	108 Å²	108	64.4 Å²	64.4	51%	0.505	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.6	-179.3	-61.2	-175.6	3.7	0	0	111.4	W438 F439 L451	W438-Q442 WeakPolarHBondContact CA-O 3.42Å; F439-Q442 PolarHBondContact N-O 2.84Å; F439-Q442 PolarHBondContact O-N 3.39Å; Q442-L451 HydrophobicContact CB-CB 4.35Å; Q442-L451 HydrophobicContact CB-CD1 4.17Å; Q442-L451 HydrophobicContact CB-CD2 4.1Å; Q442-L451 HydrophobicContact CB-CG 4.43Å
443	W	88.7	Confident	86.1	Confident	140 Å²	140	69.5 Å²	69.5	53%	0.53	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	154	171.9	-65.3	102.7	0	0	0	111	W434 G435 Y437 W438	W434-W443 WeakPolarHBondContact CH2-O 3.27Å; W434-W443 HydrophobicContact CZ2-CB 4.16Å; W434-W443 WeakPolarHBondContact CZ2-O 3.37Å; G435-W443 WeakPolarHBondContact O-CZ3 3.41Å; Y437-W443 CarbonylContact O-C 3.58Å; Y437-W443 WeakPolarHBondContact O-CA 3.34Å; W438-W443 HydrophobicContact CB-CE3 4.25Å; W438-W443 HydrophobicContact CB-CZ3 4.27Å; W438-W443 AromaticContact CE3-CD2 3.54Å; W438-W443 HydrophobicContact CE3-CD2 3.54Å; W438-W443 AromaticContact CE3-CE2 3.6Å; W438-W443 AromaticContact CE3-CE3 3.88Å; W438-W443 HydrophobicContact CE3-CE3 3.88Å; W438-W443 AromaticContact CE3-CG 3.9Å; W438-W443 HydrophobicContact CE3-CG 3.9Å; W438-W443 HydrophobicContact CE3-CH2 4.33Å; W438-W443 HydrophobicContact CE3-CZ2 4.01Å; W438-W443 HydrophobicContact CE3-CZ3 4.27Å; W438-W443 AromaticContact CE3-NE1 3.93Å; W438-W443 AromaticContact CZ3-CD1 3.8Å; W438-W443 AromaticContact CZ3-CD2 3.94Å; W438-W443 HydrophobicContact CZ3-CD2 3.94Å; W438-W443 AromaticContact CZ3-CE2 3.61Å; W438-W443 HydrophobicContact CZ3-CG 4.07Å; W438-W443 HydrophobicContact CZ3-CZ2 4.11Å; W438-W443 AromaticContact CZ3-NE1 3.51Å
444	G	88.9	Confident	86.1	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	-168.7	178.5	0	0	0	0	0	114.1	G435 S436 Y437 S450	G435-G444 PolarHBondContact N-O 3.34Å; S436-G444 PolarHBondContact N-O 3.16Å; Y437-G444 PolarHBondContact N-O 2.93Å; Y437-G444 PolarHBondContact O-N 3.18Å; G444-S450 WeakPolarHBondContact CA-O 3.46Å
445	Y	90	Very high	86.1	Confident	7 Å²	7	67.3 Å²	67.3	3%	0.027	33%	0.333	C	S	.	.			trans	-99.3	129.5	172.8	-61.1	-81.6	0	0	0	111.6	H430 S432 W434 C447 C448 H449 S450 E454	H430-Y445 HydrophobicContact CB-CD1 4.01Å; H430-Y445 HydrophobicContact CB-CE1 4.32Å; H430-Y445 AromaticContact CD2-CD1 3.69Å; H430-Y445 AromaticContact CD2-CD2 3.93Å; H430-Y445 AromaticContact CD2-CE1 3.46Å; H430-Y445 VanDerWaalsContact CD2-CE1 3.46Å; H430-Y445 WeakPolarHBondContact CD2-CE1 3.34Å; H430-Y445 AromaticContact CD2-CE2 3.72Å; H430-Y445 AromaticContact CD2-CG 3.91Å; H430-Y445 AromaticContact CD2-CZ 3.48Å; H430-Y445 VanDerWaalsContact CD2-CZ 3.48Å; H430-Y445 AromaticContact CE1-CD2 3.4Å; H430-Y445 VanDerWaalsContact CE1-CD2 3.4Å; H430-Y445 WeakPolarHBondContact CE1-CD2 3.35Å; H430-Y445 AromaticContact CE1-CE2 3.77Å; H430-Y445 AromaticContact CE1-CG 3.63Å; H430-Y445 AromaticContact CG-CD1 3.58Å; H430-Y445 AromaticContact CG-CE1 3.82Å; H430-Y445 AromaticContact CG-CG 3.74Å; H430-Y445 AromaticContact ND1-CD1 3.93Å; H430-Y445 AromaticContact ND1-CD2 3.87Å; H430-Y445 AromaticContact ND1-CG 3.58Å; H430-Y445 AromaticContact NE2-CD2 3.45Å; H430-Y445 WeakPolarHBondContact NE2-CD2 3.41Å; H430-Y445 AromaticContact NE2-CE1 3.95Å; H430-Y445 AromaticContact NE2-CE2 3.29Å; H430-Y445 VanDerWaalsContact NE2-CE2 3.29Å; H430-Y445 WeakPolarHBondContact NE2-CE2 3.2Å; H430-Y445 AromaticContact NE2-CG 3.84Å; H430-Y445 AromaticContact NE2-CZ 3.56Å; S432-Y445 WeakPolarHBondContact O-CD1 3.23Å; W434-Y445 HydrophobicContact CB-CD1 4.3Å; W434-Y445 HydrophobicContact CB-CE1 3.71Å; W434-Y445 HydrophobicContact CD2-CE2 4.48Å; W434-Y445 HydrophobicContact CE3-CD1 4.32Å; W434-Y445 AromaticContact CE3-CD2 3.62Å; W434-Y445 HydrophobicContact CE3-CD2 3.62Å; W434-Y445 HydrophobicContact CE3-CE1 4.11Å; W434-Y445 AromaticContact CE3-CE2 3.36Å; W434-Y445 HydrophobicContact CE3-CE2 3.36Å; W434-Y445 HydrophobicContact CE3-CG 4.12Å; W434-Y445 AromaticContact CE3-CZ 3.64Å; W434-Y445 AromaticContact CZ3-CD2 3.9Å; W434-Y445 HydrophobicContact CZ3-CD2 3.9Å; W434-Y445 AromaticContact CZ3-CE2 3.79Å; W434-Y445 HydrophobicContact CZ3-CE2 3.79Å; Y445-C447 VanDerWaalsContact C-N 3.27Å; Y445-C447 PolarHBondContact O-N 3.3Å; Y445-C448 PolarHBondContact O-N 2.91Å; Y445-H449 VanDerWaalsContact O-CA 3.32Å; Y445-H449 WeakPolarHBondContact O-CA 3.34Å; Y445-H449 PolarHBondContact O-N 3.25Å; Y445-S450 PolarHBondContact N-O 2.95Å; Y445-E454 PolarHBondContact OH-N 3.01Å
446	R	86.7	Confident	86.2	Confident	153 Å²	153	73 Å²	73	58%	0.577	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.4	-180	-179.3	172.1	168.4	175.4	-5.8	113.7	S432 S436 D488	S432-R446 PolarHBondContact OG-N 3.02Å; S432-R446 VanDerWaalsContact OG-N 3.16Å; S436-R446 WeakPolarHBondContact OG-CB 3.39Å; S436-R446 PolarHBondContact OG-N 2.94Å; R446-D488 IonicContact NH2-OD2 3.43Å
447	C	86.1	Confident	86.2	Confident	14 Å²	14	71.6 Å²	71.6	10%	0.095	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-31.8	-176.8	52.6	0	0	0	0	114.7	H430 T431 S432 Y445 K463	H430-C447 PolarHBondContact ND1-SG 2.96Å; T431-C447 VanDerWaalsContact OG1-CB 3.24Å; T431-C447 WeakPolarHBondContact OG1-CB 3.16Å; S432-C447 PolarHBondContact OG-N 2.9Å; S432-C447 PolarHBondContact OG-SG 3.43Å; Y445-C447 VanDerWaalsContact C-N 3.27Å; Y445-C447 PolarHBondContact O-N 3.3Å; C447-K463 WeakPolarHBondContact O-CE 3.45Å
448	C	83.4	Confident	85.8	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	5.6	-177	59.4	0	0	0	0	115.2	H430 Y445 S450 G459 S462	H430-C448 PolarHBondContact CE1-SG 2.98Å; Y445-C448 PolarHBondContact O-N 2.91Å; C448-S450 PolarHBondContact O-N 3.42Å; C448-S450 VanDerWaalsContact O-N 3.08Å; C448-S450 PolarHBondContact SG-OG 3.09Å; C448-G459 VanDerWaalsContact CB-O 3.29Å; C448-G459 WeakPolarHBondContact CB-O 3.39Å; C448-S462 VanDerWaalsContact O-CB 3.25Å; C448-S462 WeakPolarHBondContact O-CB 3.4Å; C448-S462 PolarHBondContact O-OG 3.19Å
449	H	85.5	Confident	85.5	Confident	38 Å²	38	70.1 Å²	70.1	18%	0.176	35%	0.348	C	S	.	.			trans	58	15.1	-179.1	-62.3	-179	0	0	0	115.3	Y437 Y445 L451	Y437-H449 HydrophobicContact CD1-CB 4.14Å; Y437-H449 AromaticContact CD2-CD2 3.65Å; Y437-H449 AromaticContact CD2-NE2 3.91Å; Y437-H449 HydrophobicContact CE1-CB 3.68Å; Y437-H449 AromaticContact CE1-CG 3.86Å; Y437-H449 HydrophobicContact CE2-CB 4.47Å; Y437-H449 AromaticContact CE2-CD2 3.5Å; Y437-H449 AromaticContact CE2-CE1 3.76Å; Y437-H449 AromaticContact CE2-CG 3.74Å; Y437-H449 AromaticContact CE2-ND1 3.88Å; Y437-H449 AromaticContact CE2-NE2 3.55Å; Y437-H449 AromaticContact CZ-CD2 3.8Å; Y437-H449 AromaticContact CZ-CG 3.53Å; Y437-H449 AromaticContact CZ-ND1 3.68Å; Y437-H449 PolarHBondContact OH-ND1 3.22Å; Y445-H449 VanDerWaalsContact O-CA 3.32Å; Y445-H449 WeakPolarHBondContact O-CA 3.34Å; Y445-H449 PolarHBondContact O-N 3.25Å; H449-L451 PolarHBondContact O-N 2.91Å
450	S	84.2	Confident	85.1	Confident	16 Å²	16	73.4 Å²	73.4	11%	0.112	36%	0.364	C	S	.	.			trans	-71.7	124	-179.8	55.2	0	0	0	0	111.2	G444 Y445 C448 I452 S455	G444-S450 WeakPolarHBondContact CA-O 3.46Å; Y445-S450 PolarHBondContact N-O 2.95Å; C448-S450 PolarHBondContact O-N 3.42Å; C448-S450 VanDerWaalsContact O-N 3.08Å; C448-S450 PolarHBondContact SG-OG 3.09Å; S450-I452 PolarHBondContact O-N 3.05Å; S450-S455 WeakPolarHBondContact CB-OG 3.41Å; S450-S455 PolarHBondContact OG-OG 3.39Å
451	L	87.2	Confident	84.5	Confident	50 Å²	50	74.7 Å²	74.7	26%	0.262	36%	0.363	S	S	.	.			trans	-85.9	16.2	178.3	-55.1	175	0	0	0	112.6	Y437 F439 Q442 H449	Y437-L451 HydrophobicContact CD1-CD2 4.05Å; Y437-L451 HydrophobicContact CE1-CD2 4.11Å; F439-L451 HydrophobicContact CB-CD2 4.36Å; F439-L451 HydrophobicContact CD1-CD1 4.38Å; Q442-L451 HydrophobicContact CB-CB 4.35Å; Q442-L451 HydrophobicContact CB-CD1 4.17Å; Q442-L451 HydrophobicContact CB-CD2 4.1Å; Q442-L451 HydrophobicContact CB-CG 4.43Å; H449-L451 PolarHBondContact O-N 2.91Å
452	I	85.3	Confident	83.5	Confident	122 Å²	122	72.5 Å²	72.5	63%	0.626	34%	0.34	S	S	*	.	S	Bend	trans	-113.9	113.8	-178.8	-59.4	175.3	0	0	0	108.4	W434 S450 S455	W434-I452 VanDerWaalsContact CZ3-C 3.45Å; S450-I452 PolarHBondContact O-N 3.05Å; I452-S455 VanDerWaalsContact O-CB 3.28Å; I452-S455 WeakPolarHBondContact O-CB 3.31Å; I452-S455 PolarHBondContact O-N 3.21Å; I452-S455 PolarHBondContact O-OG 2.75Å
453	K	84.2	Confident	82.8	Confident	122 Å²	122	70.2 Å²	70.2	53%	0.53	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	138.4	176.1	-172.6	170.6	178.4	-85.4	0	109.8	W434 S455	W434-K453 HydrophobicContact CD2-CB 4.1Å; W434-K453 HydrophobicContact CD2-CG 4.05Å; W434-K453 HydrophobicContact CE3-CB 4.2Å; W434-K453 HydrophobicContact CE3-CG 4.47Å; W434-K453 HydrophobicContact CG-CG 4.35Å; W434-K453 HydrophobicContact CH2-CB 3.86Å; W434-K453 HydrophobicContact CZ2-CB 3.78Å; W434-K453 HydrophobicContact CZ2-CG 4.44Å; W434-K453 VanDerWaalsContact CZ3-CA 3.46Å; W434-K453 HydrophobicContact CZ3-CB 4.08Å; W434-K453 VanDerWaalsContact CZ3-N 3.3Å; K453-S455 PolarHBondContact O-N 3.5Å; K453-S455 VanDerWaalsContact O-N 3.12Å
454	E	84.7	Confident	81.6	Confident	104 Å²	104	70.8 Å²	70.8	49%	0.486	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	14.1	-177.8	-68.2	147.8	-133.5	0	0	115.2	N428 Y445	N428-E454 PolarHBondContact ND2-O 3.05Å; Y445-E454 PolarHBondContact OH-N 3.01Å
455	S	84.9	Confident	80.3	Confident	24 Å²	24	76.2 Å²	76.2	17%	0.168	37%	0.37	C	S	.	.			trans	-55.2	154.1	161.8	53.2	0	0	0	0	111.2	N428 H430 S450 I452 K453	N428-S455 WeakPolarHBondContact CB-O 3.03Å; H430-S455 PolarHBondContact NE2-O 3.34Å; S450-S455 WeakPolarHBondContact CB-OG 3.41Å; S450-S455 PolarHBondContact OG-OG 3.39Å; I452-S455 VanDerWaalsContact O-CB 3.28Å; I452-S455 WeakPolarHBondContact O-CB 3.31Å; I452-S455 PolarHBondContact O-N 3.21Å; I452-S455 PolarHBondContact O-OG 2.75Å; K453-S455 PolarHBondContact O-N 3.5Å; K453-S455 VanDerWaalsContact O-N 3.12Å
456	Y	86.5	Confident	78.9	Confident	148 Å²	148	79.6 Å²	79.6	58%	0.58	39%	0.388	S	S	*	.			trans	-80.2	141.7	170.1	-173.9	-92.3	0	0	0	109.9	N429 L458	N429-Y456 HydrophobicContact CB-CE2 4.12Å; N429-Y456 PolarHBondContact ND2-OH 2.89Å; Y456-L458 PolarHBondContact O-N 2.93Å; Y456-L458 VanDerWaalsContact O-N 3.1Å
457	C	86.1	Confident	77.5	Confident	20 Å²	20	77.5 Å²	77.5	14%	0.135	38%	0.383	C	S	.	.			trans	-65.3	111.5	179.4	-174.8	0	0	0	0	111.6	N428 N429 G459	N428-C457 PolarHBondContact O-N 3.3Å; N429-C457 HydrophobicContact CB-CB 4.32Å; N429-C457 WeakPolarHBondContact O-CB 3.02Å; N429-C457 PolarHBondContact O-SG 2.79Å; C457-G459 PolarHBondContact O-N 2.92Å
458	L	78.5	Confident	75.8	Confident	120 Å²	120	82.5 Å²	82.5	63%	0.628	42%	0.416	S	S	*	.			trans	-82.2	5.3	175.1	-63.8	-179.6	0	0	0	113.1	Y456	Y456-L458 PolarHBondContact O-N 2.93Å; Y456-L458 VanDerWaalsContact O-N 3.1Å
459	G	79.4	Confident	74	Confident	28 Å²	28	91.8 Å²	91.8	29%	0.289	46%	0.459	S	S	.	.			trans	61.2	-157.2	-173.5	0	0	0	0	0	112.9	C448 C457 K461 S462	C448-G459 VanDerWaalsContact CB-O 3.29Å; C448-G459 WeakPolarHBondContact CB-O 3.39Å; C457-G459 PolarHBondContact O-N 2.92Å; G459-K461 VanDerWaalsContact C-N 3.31Å; G459-K461 PolarHBondContact O-N 2.89Å; G459-S462 PolarHBondContact O-N 3.25Å
460	E	78.9	Confident	72.2	Confident	136 Å²	136	96.2 Å²	96.2	64%	0.636	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-25	-169.7	-52	-152.3	94.8	0	0	114	S462 K463	E460-S462 PolarHBondContact O-N 3.3Å; E460-S462 VanDerWaalsContact O-N 3.09Å; E460-K463 HydrophobicContact CB-CD 4.34Å; E460-K463 VanDerWaalsContact O-CB 3.24Å; E460-K463 WeakPolarHBondContact O-CB 3.25Å; E460-K463 WeakPolarHBondContact O-CG 3.45Å; E460-K463 PolarHBondContact O-N 2.88Å; E460-K463 IonicContact OE1-NZ 3.37Å; E460-K463 PolarHBondContact OE1-NZ 2.96Å
461	K	69.6	Low	70.3	Confident	166 Å²	166	101.3 Å²	101.3	72%	0.722	52%	0.521	S	S	*	.	H	α-helix	trans	-58.4	-25.4	179.2	-62.3	-176.4	177.9	-176.2	0	113.4	G459 K463	G459-K461 VanDerWaalsContact C-N 3.31Å; G459-K461 PolarHBondContact O-N 2.89Å; K461-K463 VanDerWaalsContact C-N 3.3Å
462	S	68	Low	68.1	Low	7 Å²	7	107.2 Å²	107.2	5%	0.049	55%	0.553	C	S	.	*	H	α-helix	trans	-75.6	-15.7	175.6	175.8	0	0	0	0	113.3	C448 G459 E460 E464 T465 N466	C448-S462 VanDerWaalsContact O-CB 3.25Å; C448-S462 WeakPolarHBondContact O-CB 3.4Å; C448-S462 PolarHBondContact O-OG 3.19Å; G459-S462 PolarHBondContact O-N 3.25Å; E460-S462 PolarHBondContact O-N 3.3Å; E460-S462 VanDerWaalsContact O-N 3.09Å; S462-E464 VanDerWaalsContact C-N 3.34Å; S462-T465 PolarHBondContact O-OG1 3.06Å; S462-N466 PolarHBondContact O-ND2 3.32Å
463	K	71.7	Confident	66.3	Low	60 Å²	60	104 Å²	104	26%	0.261	55%	0.55	S	S	.	*	H	α-helix	trans	-69.4	-35.1	174.8	-59.4	173.6	-177.6	174	0	111.4	C447 E460 K461 F467	C447-K463 WeakPolarHBondContact O-CE 3.45Å; E460-K463 HydrophobicContact CB-CD 4.34Å; E460-K463 VanDerWaalsContact O-CB 3.24Å; E460-K463 WeakPolarHBondContact O-CB 3.25Å; E460-K463 WeakPolarHBondContact O-CG 3.45Å; E460-K463 PolarHBondContact O-N 2.88Å; E460-K463 IonicContact OE1-NZ 3.37Å; E460-K463 PolarHBondContact OE1-NZ 2.96Å; K461-K463 VanDerWaalsContact C-N 3.3Å; K463-F467 WeakPolarHBondContact O-CD2 3.36Å
464	E	64.3	Low	64.2	Low	152 Å²	152	104.6 Å²	104.6	71%	0.71	57%	0.566	S	S	*	*	H	α-helix	trans	-74.4	-45.9	-176.7	-63.2	170.5	174.6	0	0	111.8	S462 N466	S462-E464 VanDerWaalsContact C-N 3.34Å; E464-N466 PolarHBondContact O-N 2.77Å; E464-N466 VanDerWaalsContact O-N 3.11Å
465	T	60.6	Low	62.3	Low	113 Å²	113	105.9 Å²	105.9	69%	0.693	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-9.7	-172.6	54.5	0	0	0	0	115.5	S462	S462-T465 PolarHBondContact O-OG1 3.06Å
466	N	61	Low	59.9	Low	78 Å²	78	109.1 Å²	109.1	42%	0.417	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.5	4.2	-174.1	-76.7	-72.5	0	0	0	114.3	S462 E464	S462-N466 PolarHBondContact O-ND2 3.32Å; E464-N466 PolarHBondContact O-N 2.77Å; E464-N466 VanDerWaalsContact O-N 3.11Å
467	F	56.7	Low	57.6	Low	109 Å²	109	109.5 Å²	109.5	48%	0.478	63%	0.627	S	S	.	*			trans	-117.7	103.9	176.1	-72.4	-81.4	0	0	0	111.8	F439 K463	F439-F467 AromaticContact CE2-CE1 3.78Å; F439-F467 HydrophobicContact CE2-CE1 3.78Å; F439-F467 HydrophobicContact CE2-CZ 4.32Å; F439-F467 HydrophobicContact CZ-CD1 4.45Å; F439-F467 AromaticContact CZ-CE1 3.94Å; F439-F467 HydrophobicContact CZ-CE1 3.94Å; K463-F467 WeakPolarHBondContact O-CD2 3.36Å
468	P	50.5	Low	55.3	Low	119 Å²	119	112.5 Å²	112.5	77%	0.773	65%	0.654	S	S	*	*			trans	-76.9	127.8	164.4	30.7	-31.3	0	0	0	110.3
469	E	46.4	Very low	53.3	Low	196 Å²	196	114.4 Å²	114.4	92%	0.916	66%	0.664	S	S	*	*			trans	-69.9	147.9	176.2	-61.9	-177.4	142.3	0	0	111.8
470	V	47.2	Very low	51.5	Low	131 Å²	131	120.6 Å²	120.6	79%	0.794	69%	0.689	S	S	*	*			trans	-122.2	127.1	177	-179.6	0	0	0	0	108.3
471	P	45.6	Very low	49.9	Very low	122 Å²	122	123.8 Å²	123.8	79%	0.792	70%	0.701	S	S	*	*			trans	-78.2	148.4	-168.2	30.5	-36.2	0	0	0	114.1
472	D	39.3	Very low	49.1	Very low	174 Å²	174	121 Å²	121	93%	0.93	70%	0.699	S	S	*	*			trans	-68.8	133.9	-176.9	-66.7	-66	0	0	0	114.3
473	G	49.3	Very low	48.4	Very low	55 Å²	55	126.1 Å²	126.1	57%	0.567	73%	0.733	S	S	*	*			trans	-142.6	129.8	174.8	0	0	0	0	0	111.9	T475	G473-T475 VanDerWaalsContact C-N 3.32Å; G473-T475 PolarHBondContact O-N 3.18Å
474	P	39.6	Very low	47.1	Very low	134 Å²	134	129.1 Å²	129.1	87%	0.87	76%	0.759	S	S	*	*	S	Bend	trans	-85.2	51.3	-161.8	35.2	-39	0	0	0	115
475	T	43.7	Very low	46.1	Very low	132 Å²	132	130.1 Å²	130.1	81%	0.81	77%	0.765	S	S	*	*			trans	-140.2	49.5	-174.9	55.8	0	0	0	0	115.3	G473	G473-T475 VanDerWaalsContact C-N 3.32Å; G473-T475 PolarHBondContact O-N 3.18Å
476	A	36.3	Very low	45.7	Very low	92 Å²	92	130.7 Å²	130.7	76%	0.76	77%	0.771	S	S	*	*			trans	-157.3	50	171.5	0	0	0	0	0	115.1	A478	A476-A478 PolarHBondContact O-N 3.4Å
477	V	37.5	Very low	44.6	Very low	156 Å²	156	133 Å²	133	95%	0.945	79%	0.788	S	S	*	*			trans	-80	63.9	178.8	-168.2	0	0	0	0	112.1
478	A	36.8	Very low	43.4	Very low	83 Å²	83	134.9 Å²	134.9	69%	0.686	80%	0.803	S	S	*	*			trans	-171.9	103.8	160.4	0	0	0	0	0	111.7	A476	A476-A478 PolarHBondContact O-N 3.4Å
479	L	38.2	Very low	42.6	Very low	160 Å²	160	133 Å²	133	84%	0.838	80%	0.797	S	S	*	*	S	Bend	trans	157.2	112	133.1	-84	164.1	0	0	0	112.1
480	L	41.2	Very low	41.8	Very low	157 Å²	157	131 Å²	131	82%	0.822	79%	0.793	S	S	*	*			trans	55.2	76.8	147.9	-53.2	177.7	0	0	0	118.3	P482	L480-P482 WeakPolarHBondContact O-CD 3.3Å
481	K	45.7	Very low	41.1	Very low	204 Å²	204	131.9 Å²	131.9	89%	0.887	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.6	120.1	155.8	-173	175	-173	172.5	0	109.1
482	P	52.6	Low	40.4	Very low	106 Å²	106	133 Å²	133	69%	0.688	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.6	150.5	178.7	28.8	-34.4	0	0	0	111.7	L480	L480-P482 WeakPolarHBondContact O-CD 3.3Å
483	P	51.7	Low	40	Very low	115 Å²	115	129.8 Å²	129.8	75%	0.747	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70.6	151.8	175.3	30.5	-34.8	0	0	0	111.4
484	P	45.2	Very low	39.1	Very low	124 Å²	124	130.2 Å²	130.2	81%	0.805	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.8	142.9	178.9	30.1	-34.9	0	0	0	111.7
485	M	43.9	Very low	38.7	Very low	172 Å²	172	130.1 Å²	130.1	85%	0.847	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.7	138.3	167.2	-62.5	-168.7	-57.6	0	0	110.1
486	P	51.9	Low	38.2	Very low	126 Å²	126	132.1 Å²	132.1	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-68.9	135.1	167.1	29.9	-32.9	0	0	0	110
487	T	38.7	Very low	37.9	Very low	125 Å²	125	134 Å²	134	77%	0.767	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-85.7	156.1	175	48.7	0	0	0	0	111.7	A489	T487-A489 PolarHBondContact O-N 2.87Å; T487-A489 VanDerWaalsContact O-N 3.12Å
488	D	31.3	Very low	37.5	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	78%	0.78	S	S	*	*	S	Bend	trans	-58.8	107.9	-174.5	-50.1	-85.9	0	0	0	113.3	R446	R446-D488 IonicContact NH2-OD2 3.43Å
489	A	32	Very low	37.3	Very low	79 Å²	79	137.8 Å²	137.8	65%	0.653	79%	0.788	S	S	*	*			trans	-154.7	151.3	168.8	0	0	0	0	0	111.3	T487	T487-A489 PolarHBondContact O-N 2.87Å; T487-A489 VanDerWaalsContact O-N 3.12Å
490	D	31	Very low	37.2	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	78%	0.782	S	S	*	*			trans	51.3	92.8	165	-56.1	-21.7	0	0	0	119
491	T	32.4	Very low	36.7	Very low	148 Å²	148	134.8 Å²	134.8	91%	0.908	77%	0.773	S	S	*	*			trans	-154.9	79	146.7	13.7	0	0	0	0	112.9
492	D	29.6	Very low	36.2	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	77%	0.771	S	S	*	*			trans	-79.3	152.3	152.4	-174.9	6	0	0	0	109.5
493	S	31.9	Very low	35.2	Very low	105 Å²	105	134.1 Å²	134.1	73%	0.734	77%	0.772	S	S	*	*	S	Bend	trans	63.6	46	156.2	-70.8	0	0	0	0	119
494	G	30.4	Very low	34.5	Very low	64 Å²	64	135.7 Å²	135.7	66%	0.66	77%	0.774	S	S	*	*				60.3	154.8	123.3	0	0	0	0	0	122.9
495	N	30.3	Very low	33.8	Very low	133 Å²	133	138.6 Å²	138.6	71%	0.711	77%	0.774	S	S	*	*			trans	-170.6	158.8	152.5	-117.1	-89.9	0	0	0	112.2
496	K	33.8	Very low	33.5	Very low	173 Å²	173	136.4 Å²	136.4	75%	0.752	77%	0.766	S	S	*	*			trans	53.3	105.6	160.9	-57.9	158.6	-170.3	171.7	0	115.8
497	V	29.5	Very low	32.6	Very low	131 Å²	131	136.6 Å²	136.6	79%	0.794	76%	0.764	S	S	*	*			cis	53.9	79.9	42.8	-161.6	0	0	0	0	113
498	N	30.5	Very low	32.6	Very low	159 Å²	159	138.2 Å²	138.2	85%	0.85	77%	0.767	S	S	*	*			trans	-115	91.1	149.2	-98.1	-9.5	0	0	0	107.3
499	L	32.5	Very low	32.6	Very low	161 Å²	161	140.8 Å²	140.8	84%	0.843	77%	0.771	S	S	*	*			trans	-125	81.9	173.9	-168.8	80.9	0	0	0	108.9	N501	L499-N501 PolarHBondContact O-N 3.47Å
500	D	35.3	Very low	33	Very low	133 Å²	133	145 Å²	145	71%	0.711	78%	0.777	S	S	*	*			trans	-69.5	114.5	-176.3	-107.8	-55.7	0	0	0	112.5
501	N	31.8	Very low	33.2	Very low	120 Å²	120	146.2 Å²	146.2	64%	0.642	78%	0.775	S	S	*	*			trans	35.5	92.9	131.2	-68.7	-60.8	0	0	0	118	L499	L499-N501 PolarHBondContact O-N 3.47Å
502	H	35.3	Very low	33.4	Very low	183 Å²	183	149 Å²	149	85%	0.847	77%	0.774	S	S	*	*				-153	87	121.1	-112.8	-64.4	0	0	0	113.2	N504	H502-N504 PolarHBondContact O-N 2.82Å
503	T	30.5	Very low	33.5	Very low	114 Å²	114	153.1 Å²	153.1	70%	0.699	78%	0.779	S	S	*	*			trans	-70.5	97.5	175.4	57	0	0	0	0	111.8	K505	T503-K505 PolarHBondContact O-N 3.14Å; T503-K505 VanDerWaalsContact O-N 3.1Å
504	N	37.6	Very low	33.8	Very low	148 Å²	148	158 Å²	158	79%	0.791	79%	0.787	S	S	*	*			trans	-82.1	87.7	175.4	-125.4	-45.2	0	0	0	111.2	H502 N506	H502-N504 PolarHBondContact O-N 2.82Å; N504-N506 PolarHBondContact O-N 3Å; N504-N506 VanDerWaalsContact O-N 3.09Å
505	K	30.9	Very low	34	Very low	185 Å²	185	163.7 Å²	163.7	80%	0.804	80%	0.796	S	S	*	*			trans	-56.6	108.7	-178.3	-70.7	173	174.4	170.1	0	112	T503	T503-K505 PolarHBondContact O-N 3.14Å; T503-K505 VanDerWaalsContact O-N 3.1Å
506	N	37.1	Very low	34.3	Very low	126 Å²	126	162 Å²	162	67%	0.674	80%	0.801	S	S	*	*			trans	-134.1	100.8	162.6	-100.8	-75.2	0	0	0	111.3	N504 L508	N504-N506 PolarHBondContact O-N 3Å; N504-N506 VanDerWaalsContact O-N 3.09Å; N506-L508 PolarHBondContact O-N 3.42Å
507	V	33.4	Very low	34.2	Very low	130 Å²	130	163.7 Å²	163.7	79%	0.788	81%	0.808	S	S	*	*			trans	-73.6	120.8	-178	176.7	0	0	0	0	111.1
508	L	37.8	Very low	34.5	Very low	158 Å²	158	162.8 Å²	162.8	83%	0.827	81%	0.807	S	S	*	*			trans	-135.2	56.8	168.6	-82.7	172.6	0	0	0	111.5	N506 H510	N506-L508 PolarHBondContact O-N 3.42Å; L508-H510 PolarHBondContact O-N 2.87Å
509	K	31.7	Very low	34.6	Very low	203 Å²	203	165 Å²	165	88%	0.883	81%	0.809	S	S	*	*			trans	-71.1	112.7	161.6	-85.4	-173.7	173.6	179.8	0	108.6
510	H	40.3	Very low	34.8	Very low	167 Å²	167	162.9 Å²	162.9	77%	0.773	81%	0.808	S	S	*	*			trans	-130.6	131.5	171.7	-129.8	-82	0	0	0	112.1	L508	L508-H510 PolarHBondContact O-N 2.87Å
511	K	34.8	Very low	34.5	Very low	183 Å²	183	161.4 Å²	161.4	80%	0.796	82%	0.815	S	S	*	*			trans	-23.7	130.6	179.7	-59.2	174.3	176.5	-178.8	0	117.1
512	K	36.4	Very low	34.7	Very low	206 Å²	206	160.7 Å²	160.7	90%	0.896	82%	0.819	S	S	*	*				-165.2	125.9	105.8	-102.5	167.5	-176.3	176.8	0	112.1
513	R	31.7	Very low	34.4	Very low	234 Å²	234	157.2 Å²	157.2	88%	0.883	82%	0.815	S	S	*	*			trans	-93.1	142	157.7	-71.2	168.4	72.4	176.1	2.7	107.6
514	K	39.1	Very low	34.4	Very low	207 Å²	207	157 Å²	157	90%	0.9	82%	0.817	S	S	*	*			trans	-143.1	162.9	156.8	-89.6	-154.4	170.6	-168	0	108.9
515	H	34	Very low	34	Very low	184 Å²	184	155.2 Å²	155.2	85%	0.852	82%	0.816	S	S	*	*			trans	-103.5	139.1	-162.6	-63.3	-111.7	0	0	0	114.3
516	A	36.5	Very low	34.1	Very low	98 Å²	98	151.1 Å²	151.1	81%	0.81	81%	0.811	S	S	*	*			trans	-167.9	134	140.1	0	0	0	0	0	106
517	K	31	Very low	33.9	Very low	208 Å²	208	149.6 Å²	149.6	90%	0.904	81%	0.81	S	S	*	*			cis	91.8	49.2	8.9	-144.8	-169.3	-179.8	-177.1	0	118.4
518	S	37.4	Very low	33.9	Very low	111 Å²	111	148.5 Å²	148.5	78%	0.776	81%	0.808	S	S	*	*			trans	-139	144.5	144.4	41.8	0	0	0	0	107.4
519	K	32	Very low	33.7	Very low	205 Å²	205	145.6 Å²	145.6	89%	0.891	80%	0.801	S	S	*	*			cis	85.5	66.6	27.9	-76.1	-158.6	166	-164.2	0	116.7
520	S	35.8	Very low	33.8	Very low	117 Å²	117	141.3 Å²	141.3	82%	0.818	80%	0.796	S	S	*	*			trans	-164.9	139.8	137.5	41.1	0	0	0	0	107.6
521	A	29	Very low	33.6	Very low	103 Å²	103	138.5 Å²	138.5	85%	0.851	80%	0.796	S	S	*	*			cis	96	74.2	12.3	0	0	0	0	0	116.5
522	S	36.1	Very low	33.8	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	79%	0.789	S	S	*	*			trans	-160.4	124.7	155.9	35.4	0	0	0	0	106.4
523	S	28.8	Very low	33.8	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	78%	0.783	S	S	*	*				52.4	112.4	73.2	71.2	0	0	0	0	111.5
524	C	31.5	Very low	34.2	Very low	111 Å²	111	123.4 Å²	123.4	75%	0.75	78%	0.775	S	S	*	*				-154.2	148.6	55.6	35.3	0	0	0	0	109.2
525	S	29.1	Very low	34.2	Very low	110 Å²	110	119.1 Å²	119.1	77%	0.769	77%	0.771	S	S	*	*				50.4	131	70.1	77.9	0	0	0	0	113.5
526	S	33	Very low	34.3	Very low	99 Å²	99	117 Å²	117	69%	0.692	77%	0.766	S	S	*	*			cis	-162.3	177.6	18.7	53.7	0	0	0	0	114.3
527	S	33.4	Very low	34.5	Very low	93 Å²	93	117.1 Å²	117.1	65%	0.65	76%	0.761	S	S	*	*			trans	70.2	127.5	135.6	59.4	0	0	0	0	122.9
528	S	32	Very low	34.9	Very low	108 Å²	108	111.7 Å²	111.7	76%	0.755	75%	0.749	S	S	*	*			trans	67	146.2	136.8	54.6	0	0	0	0	120.8
529	S	34.4	Very low	34.9	Very low	97 Å²	97	114.8 Å²	114.8	68%	0.678	75%	0.751	S	S	*	*			cis	-174.5	164.5	-13.2	49.4	0	0	0	0	110.7
530	S	33.3	Very low	35.3	Very low	112 Å²	112	113.3 Å²	113.3	78%	0.783	75%	0.747	S	S	*	*			trans	61.8	151.2	158.3	37.9	0	0	0	0	117.9
531	S	37.3	Very low	35.5	Very low	108 Å²	108	114.5 Å²	114.5	76%	0.755	74%	0.742	S	S	*	*			cis	-160.4	-171.7	-12.6	60.5	0	0	0	0	107.1
532	S	37.1	Very low	36	Very low	93 Å²	93	116 Å²	116	65%	0.65	74%	0.735	S	S	*	*			cis	-165.9	172.8	3.4	12.2	0	0	0	0	108.9
533	S	38.2	Very low	36	Very low	110 Å²	110	117.6 Å²	117.6	77%	0.769	74%	0.735	S	S	*	*			trans	65.9	140.1	154.4	44.5	0	0	0	0	119.9
534	S	39.1	Very low	36.3	Very low	103 Å²	103	117.9 Å²	117.9	72%	0.72	74%	0.736	S	S	*	*			cis	-170.9	156.2	-6.7	44.3	0	0	0	0	113.4
535	S	39.8	Very low	36.7	Very low	117 Å²	117	118.6 Å²	118.6	82%	0.818	74%	0.737	S	S	*	*			trans	76.6	142.9	159.6	-47.8	0	0	0	0	117.7
536	D	36.1	Very low	36.9	Very low	141 Å²	141	120.4 Å²	120.4	75%	0.754	74%	0.738	S	S	*	*			cis	-148.5	162.1	0.6	-156.6	-4.8	0	0	0	112
537	S	39.6	Very low	37.3	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	74%	0.74	S	S	*	*			trans	-8.8	156.5	161.4	-52.9	0	0	0	0	120.3
538	S	39.4	Very low	37.5	Very low	93 Å²	93	125.5 Å²	125.5	65%	0.65	75%	0.745	S	S	*	*			cis	-175.6	167.2	-14.3	59.9	0	0	0	0	107.1
539	E	38.8	Very low	37.8	Very low	176 Å²	176	127.4 Å²	127.4	82%	0.822	75%	0.746	S	S	*	*			cis	-142.8	-153	-11	-108.5	150.3	127.9	0	0	105.5
540	E	38.7	Very low	37.9	Very low	174 Å²	174	131.2 Å²	131.2	81%	0.813	75%	0.753	S	S	*	*			cis	-148.5	141.7	10.4	-82.9	-172.2	79.5	0	0	111.8
541	M	41	Very low	38.2	Very low	143 Å²	143	133.8 Å²	133.8	70%	0.704	76%	0.757	S	S	*	*			trans	45.5	110.6	130.4	-54.1	-70.8	-87.2	0	0	125
542	L	38.8	Very low	38.1	Very low	134 Å²	134	139.5 Å²	139.5	70%	0.702	76%	0.762	S	S	*	*				59.3	150.7	123.6	-54.2	-173.1	0	0	0	121
543	D	35.7	Very low	38	Very low	137 Å²	137	144.2 Å²	144.2	73%	0.733	77%	0.774	S	S	*	*			cis	-162	178	0.1	-136.3	-35.6	0	0	0	114.3
544	C	36.4	Very low	37.8	Very low	116 Å²	116	143.6 Å²	143.6	78%	0.784	78%	0.775	S	S	*	*			trans	77.8	146.6	145.4	-156	0	0	0	0	122.3
545	V	39.5	Very low	37.8	Very low	126 Å²	126	143.6 Å²	143.6	76%	0.764	77%	0.771	S	S	*	*			trans	-93.1	145.4	-163.7	-81.5	0	0	0	0	116.6
546	N	34.4	Very low	37.6	Very low	148 Å²	148	145.4 Å²	145.4	79%	0.791	77%	0.768	S	S	*	*				21.1	119.6	128.5	-178.8	100	0	0	0	120.3
547	E	39.7	Very low	37.5	Very low	160 Å²	160	147.9 Å²	147.9	75%	0.748	78%	0.775	S	S	*	*			trans	-159.9	149.7	143.6	-128.9	-178.5	-130	0	0	115.6
548	N	39.5	Very low	37.1	Very low	139 Å²	139	150.7 Å²	150.7	74%	0.743	78%	0.777	S	S	*	*			trans	73.8	133.4	156.4	-58.8	-40.9	0	0	0	124.1
549	D	37.1	Very low	36.9	Very low	148 Å²	148	151.5 Å²	151.5	79%	0.791	78%	0.783	S	S	*	*			trans	-83.3	171.9	172.2	-95	-60.5	0	0	0	114.3
550	H	35.9	Very low	36.7	Very low	178 Å²	178	155.3 Å²	155.3	82%	0.824	79%	0.79	S	S	*	*			trans	71.7	158.8	163.5	-74.6	-72.1	0	0	0	119.5
551	L	40.2	Very low	36.3	Very low	165 Å²	165	152.5 Å²	152.5	86%	0.864	79%	0.789	S	S	*	*			trans	75.5	70	171.8	-52.9	-178.9	0	0	0	118.9
552	R	35.6	Very low	36.2	Very low	229 Å²	229	156 Å²	156	86%	0.864	80%	0.795	S	S	*	*				-160.3	60.7	125.9	-117.9	173.3	-178.7	168.3	2.1	116.4
553	E	34.1	Very low	36.2	Very low	192 Å²	192	158.9 Å²	158.9	90%	0.897	80%	0.802	S	S	*	*			trans	-79.3	162.4	147.6	-159.9	158.9	-150.5	0	0	109.1
554	A	34.7	Very low	36	Very low	96 Å²	96	155.6 Å²	155.6	79%	0.793	80%	0.8	S	S	*	*			trans	60.4	76.8	177.4	0	0	0	0	0	118.1
555	V	38.6	Very low	36.2	Very low	104 Å²	104	158.1 Å²	158.1	63%	0.63	81%	0.805	S	S	*	*			trans	-134.4	105.8	147.2	-179.8	0	0	0	0	109.8
556	M	37	Very low	36	Very low	155 Å²	155	159 Å²	159	76%	0.764	81%	0.805	S	S	*	*			trans	39.1	107.7	154.4	-58	172.7	-175.5	0	0	116.5
557	E	32.5	Very low	36.2	Very low	192 Å²	192	161 Å²	161	90%	0.897	81%	0.81	S	S	*	*			cis	51.6	54.6	26.3	-158.4	168.3	-133	0	0	113.7
558	Q	31.4	Very low	36	Very low	160 Å²	160	160.6 Å²	160.6	75%	0.748	81%	0.813	S	S	*	*			trans	-159	147.7	153.7	-113.8	156.3	83	0	0	111
559	S	34.9	Very low	36	Very low	110 Å²	110	162 Å²	162	77%	0.769	82%	0.819	S	S	*	*	S	Bend	trans	68.1	72.9	171.9	71.7	0	0	0	0	119.4
560	R	34.3	Very low	36.1	Very low	256 Å²	256	161.6 Å²	161.6	97%	0.966	81%	0.812	S	S	*	*			trans	-159.3	48.2	136.7	-114.5	165.8	-166.6	-171.1	2.9	116.1
561	S	31	Very low	35.9	Very low	114 Å²	114	162.2 Å²	162.2	80%	0.797	82%	0.815	S	S	*	*			trans	-98.3	89	172.6	43.1	0	0	0	0	112.8
562	R	39.3	Very low	35.6	Very low	218 Å²	218	160.2 Å²	160.2	82%	0.823	80%	0.802	S	S	*	*			trans	-170.8	136.8	158.2	-118.7	170.8	178.4	166.9	0	112.9
563	F	38.2	Very low	35.6	Very low	193 Å²	193	154.7 Å²	154.7	85%	0.846	80%	0.795	S	S	*	*			trans	60.5	106.5	-179.1	-50.8	-77.5	0	0	0	114.2
564	G	32.2	Very low	35.7	Very low	68 Å²	68	150.3 Å²	150.3	70%	0.701	78%	0.782	S	S	*	*			cis	91.1	85.1	-1.9	0	0	0	0	0	114.2
565	L	40.4	Very low	36.4	Very low	169 Å²	169	150.7 Å²	150.7	89%	0.885	77%	0.771	S	S	*	*			trans	-159.8	141.7	138	-108.4	171.8	0	0	0	108
566	D	34.4	Very low	37	Very low	144 Å²	144	150 Å²	150	77%	0.77	77%	0.767	S	S	*	*			trans	-97.9	148.1	-166.9	-41.3	-94.6	0	0	0	111.6
567	E	38.5	Very low	38	Very low	191 Å²	191	149.9 Å²	149.9	89%	0.893	76%	0.762	S	S	*	*			trans	-167.1	136.8	144.3	-113.3	169.3	-156.4	0	0	110.7
568	D	36.8	Very low	39.2	Very low	152 Å²	152	143.3 Å²	143.3	81%	0.813	74%	0.735	S	S	*	*			trans	-60.5	135.1	-159.4	-55.4	-70.2	0	0	0	116.8	E570	D568-E570 PolarHBondContact O-N 3.43Å
569	I	39.6	Very low	40.9	Very low	168 Å²	168	141.1 Å²	141.1	86%	0.862	73%	0.727	S	S	*	*			trans	-87.7	92.1	160.5	-61.9	165.4	0	0	0	107.9
570	E	37.8	Very low	42.6	Very low	140 Å²	140	140.3 Å²	140.3	65%	0.654	71%	0.711	S	S	*	*			trans	-67.6	131.2	165.5	-77.6	-157.3	157	0	0	110.8	D568 H572	D568-E570 PolarHBondContact O-N 3.43Å; E570-H572 PolarHBondContact O-N 2.63Å; E570-H572 IonicContact OE2-CE1 3.27Å; E570-H572 PolarHBondContact OE2-CE1 2.82Å; E570-H572 IonicContact OE2-ND1 3.51Å
571	E	31.9	Very low	44.4	Very low	190 Å²	190	132.9 Å²	132.9	89%	0.888	69%	0.691	S	S	*	*			trans	-71.8	73.9	172.7	-65.5	-168.5	137.6	0	0	111.5	P573	E571-P573 VanDerWaalsContact O-CD 3.3Å; E571-P573 WeakPolarHBondContact O-CD 3.43Å
572	H	35	Very low	46.4	Very low	124 Å²	124	134 Å²	134	57%	0.574	68%	0.681	S	S	*	*			trans	-64.6	119	178.1	-79.3	-6.8	0	0	0	112.1	E570 T574	E570-H572 PolarHBondContact O-N 2.63Å; E570-H572 IonicContact OE2-CE1 3.27Å; E570-H572 PolarHBondContact OE2-CE1 2.82Å; E570-H572 IonicContact OE2-ND1 3.51Å; H572-T574 VanDerWaalsContact C-N 3.3Å; H572-T574 HydrophobicContact CB-CG2 4.25Å; H572-T574 PolarHBondContact O-N 2.81Å; H572-T574 PolarHBondContact O-OG1 2.96Å
573	P	35.8	Very low	48.2	Very low	113 Å²	113	126.6 Å²	126.6	73%	0.734	66%	0.663	S	S	*	*			trans	-84	64.5	-173.6	34.3	-36.5	0	0	0	112.2	E571	E571-P573 VanDerWaalsContact O-CD 3.3Å; E571-P573 WeakPolarHBondContact O-CD 3.43Å
574	T	35	Very low	50.3	Low	99 Å²	99	122 Å²	122	61%	0.607	64%	0.643	S	S	*	*			trans	-120.3	14.9	-161.1	53.2	0	0	0	0	117.8	H572	H572-T574 VanDerWaalsContact C-N 3.3Å; H572-T574 HydrophobicContact CB-CG2 4.25Å; H572-T574 PolarHBondContact O-N 2.81Å; H572-T574 PolarHBondContact O-OG1 2.96Å
575	D	50.1	Low	52.5	Low	105 Å²	105	125.2 Å²	125.2	56%	0.561	64%	0.639	S	S	*	*	S	Bend	trans	-125.1	-2.4	174.3	-104.1	-35.7	0	0	0	116.4	K577 T578 I579	D575-K577 PolarHBondContact O-N 3.1Å; D575-T578 PolarHBondContact O-OG1 3.06Å; D575-T578 WeakPolarHBondContact OD1-CB 3.32Å; D575-T578 WeakPolarHBondContact OD1-CG2 3.39Å; D575-T578 PolarHBondContact OD1-OG1 3.31Å; D575-I579 WeakPolarHBondContact O-CD1 3.48Å; D575-I579 VanDerWaalsContact O-CG1 3.31Å; D575-I579 WeakPolarHBondContact O-CG1 3.33Å; D575-I579 PolarHBondContact O-N 3.33Å
576	T	51.1	Low	54.4	Low	90 Å²	90	122.7 Å²	122.7	55%	0.552	63%	0.626	S	S	*	*	H	α-helix	trans	-63.6	-42.9	171.4	51	0	0	0	0	111.6	T578 I579 E580	T576-T578 PolarHBondContact O-N 3.31Å; T576-I579 PolarHBondContact O-N 3.13Å; T576-E580 WeakPolarHBondContact O-CB 3.49Å; T576-E580 PolarHBondContact O-N 3.43Å
577	K	58	Low	56.8	Low	151 Å²	151	118.6 Å²	118.6	66%	0.657	61%	0.613	S	S	*	*	H	α-helix	trans	-67.4	-32.9	-179.2	-67.1	172.3	-177.3	166.9	0	113.1	D575 N581	D575-K577 PolarHBondContact O-N 3.1Å; K577-N581 VanDerWaalsContact O-CB 3.32Å; K577-N581 WeakPolarHBondContact O-CB 3.48Å; K577-N581 PolarHBondContact O-N 3Å; K577-N581 PolarHBondContact O-ND2 3.03Å
578	T	57.4	Low	58.9	Low	54 Å²	54	118.9 Å²	118.9	33%	0.331	61%	0.605	S	S	.	*	H	α-helix	trans	-74	-41	178.4	61.1	0	0	0	0	110.8	D575 T576 N581 K582	D575-T578 PolarHBondContact O-OG1 3.06Å; D575-T578 WeakPolarHBondContact OD1-CB 3.32Å; D575-T578 WeakPolarHBondContact OD1-CG2 3.39Å; D575-T578 PolarHBondContact OD1-OG1 3.31Å; T576-T578 PolarHBondContact O-N 3.31Å; T578-N581 PolarHBondContact O-N 3.48Å; T578-K582 WeakPolarHBondContact O-CG 3.33Å; T578-K582 PolarHBondContact O-N 3.21Å
579	I	67.7	Low	61	Low	114 Å²	114	114 Å²	114	59%	0.585	58%	0.584	S	S	*	*	H	α-helix	trans	-65.3	-45.3	174.1	-66	169.4	0	0	0	110.4	D575 T576 N581 K582 S583	D575-I579 WeakPolarHBondContact O-CD1 3.48Å; D575-I579 VanDerWaalsContact O-CG1 3.31Å; D575-I579 WeakPolarHBondContact O-CG1 3.33Å; D575-I579 PolarHBondContact O-N 3.33Å; T576-I579 PolarHBondContact O-N 3.13Å; I579-N581 VanDerWaalsContact C-N 3.33Å; I579-N581 PolarHBondContact O-N 3.39Å; I579-K582 PolarHBondContact O-N 2.91Å; I579-S583 PolarHBondContact O-N 3.38Å; I579-S583 PolarHBondContact O-OG 3.27Å
580	E	69.9	Low	63	Low	93 Å²	93	112.6 Å²	112.6	44%	0.435	57%	0.573	S	S	.	*	H	α-helix	trans	-59.6	-39.8	173	-88.5	-169	-134.2	0	0	113	T576 S583 K584	T576-E580 WeakPolarHBondContact O-CB 3.49Å; T576-E580 PolarHBondContact O-N 3.43Å; E580-S583 PolarHBondContact O-N 3.15Å; E580-S583 PolarHBondContact O-OG 3.36Å; E580-K584 WeakPolarHBondContact O-CB 3.17Å; E580-K584 VanDerWaalsContact O-CD 3.26Å; E580-K584 WeakPolarHBondContact O-CD 2.9Å; E580-K584 WeakPolarHBondContact O-CG 3.41Å; E580-K584 PolarHBondContact O-N 2.93Å; E580-K584 WeakPolarHBondContact OE2-CE 3.27Å; E580-K584 IonicContact OE2-NZ 3.67Å; E580-K584 PolarHBondContact OE2-NZ 2.7Å
581	N	72.4	Confident	65.2	Low	100 Å²	100	108.2 Å²	108.2	54%	0.535	56%	0.561	S	S	.	*	H	α-helix	trans	-68.9	-41.1	178.5	-74.8	-15.9	0	0	0	111.3	K577 T578 I579 S583 K584 E585	K577-N581 VanDerWaalsContact O-CB 3.32Å; K577-N581 WeakPolarHBondContact O-CB 3.48Å; K577-N581 PolarHBondContact O-N 3Å; K577-N581 PolarHBondContact O-ND2 3.03Å; T578-N581 PolarHBondContact O-N 3.48Å; I579-N581 VanDerWaalsContact C-N 3.33Å; I579-N581 PolarHBondContact O-N 3.39Å; N581-S583 PolarHBondContact O-N 3.3Å; N581-K584 PolarHBondContact O-N 3.29Å; N581-E585 VanDerWaalsContact O-CB 3.3Å; N581-E585 WeakPolarHBondContact O-CB 3.25Å; N581-E585 PolarHBondContact O-N 3.01Å
582	K	73.6	Confident	67.7	Low	137 Å²	137	107.9 Å²	107.9	60%	0.596	55%	0.551	S	S	*	*	H	α-helix	trans	-61.1	-40.6	172.8	-74.4	171.9	179.3	170.1	0	112.4	T578 I579 E585 L586	T578-K582 WeakPolarHBondContact O-CG 3.33Å; T578-K582 PolarHBondContact O-N 3.21Å; I579-K582 PolarHBondContact O-N 2.91Å; K582-E585 PolarHBondContact O-N 2.75Å; K582-L586 WeakPolarHBondContact O-CB 3.32Å; K582-L586 WeakPolarHBondContact O-CG 3.28Å; K582-L586 PolarHBondContact O-N 3.43Å
583	S	77.4	Confident	69.8	Low	64 Å²	64	110.1 Å²	110.1	45%	0.448	56%	0.555	S	S	.	*	H	α-helix	trans	-71	-38.8	178.1	69.8	0	0	0	0	112.5	I579 E580 N581 E585 L586 A587	I579-S583 PolarHBondContact O-N 3.38Å; I579-S583 PolarHBondContact O-OG 3.27Å; E580-S583 PolarHBondContact O-N 3.15Å; E580-S583 PolarHBondContact O-OG 3.36Å; N581-S583 PolarHBondContact O-N 3.3Å; S583-E585 VanDerWaalsContact C-N 3.33Å; S583-E585 PolarHBondContact O-N 3.15Å; S583-L586 PolarHBondContact O-N 2.95Å; S583-A587 WeakPolarHBondContact O-CB 3.47Å; S583-A587 PolarHBondContact O-N 3.19Å
584	K	81.3	Confident	72.1	Confident	96 Å²	96	108.9 Å²	108.9	42%	0.417	54%	0.539	S	S	.	.	H	α-helix	trans	-63.7	-36.7	171.8	-69.2	161.8	-163.5	170.3	0	112.1	E580 N581 R588	E580-K584 WeakPolarHBondContact O-CB 3.17Å; E580-K584 VanDerWaalsContact O-CD 3.26Å; E580-K584 WeakPolarHBondContact O-CD 2.9Å; E580-K584 WeakPolarHBondContact O-CG 3.41Å; E580-K584 PolarHBondContact O-N 2.93Å; E580-K584 WeakPolarHBondContact OE2-CE 3.27Å; E580-K584 IonicContact OE2-NZ 3.67Å; E580-K584 PolarHBondContact OE2-NZ 2.7Å; N581-K584 PolarHBondContact O-N 3.29Å; K584-R588 VanDerWaalsContact O-CG 3.27Å; K584-R588 WeakPolarHBondContact O-CG 3.37Å; K584-R588 PolarHBondContact O-N 2.96Å
585	E	78.2	Confident	74.4	Confident	135 Å²	135	112.9 Å²	112.9	63%	0.631	54%	0.543	S	S	*	.	H	α-helix	trans	-70	-43.2	176	-174.3	171.8	-141.9	0	0	112.3	N581 K582 S583 A587 R588 S589	N581-E585 VanDerWaalsContact O-CB 3.3Å; N581-E585 WeakPolarHBondContact O-CB 3.25Å; N581-E585 PolarHBondContact O-N 3.01Å; K582-E585 PolarHBondContact O-N 2.75Å; S583-E585 VanDerWaalsContact C-N 3.33Å; S583-E585 PolarHBondContact O-N 3.15Å; E585-A587 PolarHBondContact O-N 3.25Å; E585-R588 WeakPolarHBondContact O-CB 3.29Å; E585-R588 PolarHBondContact O-N 2.87Å; E585-S589 WeakPolarHBondContact O-CB 3.23Å; E585-S589 PolarHBondContact O-N 2.92Å
586	L	81.2	Confident	76	Confident	117 Å²	117	111 Å²	111	61%	0.613	53%	0.532	S	S	*	.	H	α-helix	trans	-58.8	-46.3	171.2	-77.6	167.4	0	0	0	111.5	K582 S583 R588 S589 E590	K582-L586 WeakPolarHBondContact O-CB 3.32Å; K582-L586 WeakPolarHBondContact O-CG 3.28Å; K582-L586 PolarHBondContact O-N 3.43Å; S583-L586 PolarHBondContact O-N 2.95Å; L586-R588 VanDerWaalsContact C-N 3.33Å; L586-R588 PolarHBondContact O-N 3.36Å; L586-S589 WeakPolarHBondContact O-CA 3.45Å; L586-S589 WeakPolarHBondContact O-CB 3.49Å; L586-S589 PolarHBondContact O-N 3.24Å; L586-S589 VanDerWaalsContact O-N 3.09Å; L586-E590 PolarHBondContact O-N 3.18Å
587	A	83.5	Confident	77.5	Confident	58 Å²	58	114.8 Å²	114.8	48%	0.479	54%	0.536	S	S	.	.	H	α-helix	trans	-61	-38.8	176.5	0	0	0	0	0	112.7	S583 E585 A591	S583-A587 WeakPolarHBondContact O-CB 3.47Å; S583-A587 PolarHBondContact O-N 3.19Å; E585-A587 PolarHBondContact O-N 3.25Å; A587-A591 VanDerWaalsContact O-CB 3.28Å; A587-A591 WeakPolarHBondContact O-CB 3.29Å; A587-A591 PolarHBondContact O-N 3.17Å
588	R	84.1	Confident	78.8	Confident	196 Å²	196	112.2 Å²	112.2	74%	0.74	53%	0.529	S	S	*	.	H	α-helix	trans	-64	-41.7	171.9	-74.2	168.7	178.2	-174.1	-0.9	111.9	K584 E585 L586 A591 R592	K584-R588 VanDerWaalsContact O-CG 3.27Å; K584-R588 WeakPolarHBondContact O-CG 3.37Å; K584-R588 PolarHBondContact O-N 2.96Å; E585-R588 WeakPolarHBondContact O-CB 3.29Å; E585-R588 PolarHBondContact O-N 2.87Å; L586-R588 VanDerWaalsContact C-N 3.33Å; L586-R588 PolarHBondContact O-N 3.36Å; R588-A591 PolarHBondContact O-N 3.32Å; R588-R592 WeakPolarHBondContact O-CB 3.14Å; R588-R592 PolarHBondContact O-N 3.05Å
589	S	79.3	Confident	80.1	Confident	51 Å²	51	115.9 Å²	115.9	36%	0.357	54%	0.542	S	S	.	.	H	α-helix	trans	-61.9	-46.4	176.9	-173.7	0	0	0	0	111.9	E585 L586 R592 R593	E585-S589 WeakPolarHBondContact O-CB 3.23Å; E585-S589 PolarHBondContact O-N 2.92Å; L586-S589 WeakPolarHBondContact O-CA 3.45Å; L586-S589 WeakPolarHBondContact O-CB 3.49Å; L586-S589 PolarHBondContact O-N 3.24Å; L586-S589 VanDerWaalsContact O-N 3.09Å; S589-R592 PolarHBondContact O-N 3.27Å; S589-R593 VanDerWaalsContact O-CG 3.31Å; S589-R593 WeakPolarHBondContact O-CG 3.25Å; S589-R593 PolarHBondContact O-N 3.01Å
590	E	81.5	Confident	80.9	Confident	138 Å²	138	119.2 Å²	119.2	65%	0.645	55%	0.547	S	S	*	.	H	α-helix	trans	-66.3	-43.7	175.9	-67.4	-156.2	122.4	0	0	112.5	L586 R592 R593 E594	L586-E590 PolarHBondContact O-N 3.18Å; E590-R592 VanDerWaalsContact C-N 3.27Å; E590-R592 PolarHBondContact O-N 3.28Å; E590-R593 WeakPolarHBondContact O-CB 3.47Å; E590-R593 PolarHBondContact O-N 2.97Å; E590-R593 VanDerWaalsContact O-N 3.11Å; E590-E594 PolarHBondContact O-N 3.27Å
591	A	84.6	Confident	81.6	Confident	47 Å²	47	117.5 Å²	117.5	39%	0.388	55%	0.549	S	S	.	.	H	α-helix	trans	-58.8	-38.3	174.5	0	0	0	0	0	112.1	A587 R588 R595	A587-A591 VanDerWaalsContact O-CB 3.28Å; A587-A591 WeakPolarHBondContact O-CB 3.29Å; A587-A591 PolarHBondContact O-N 3.17Å; R588-A591 PolarHBondContact O-N 3.32Å; A591-R595 WeakPolarHBondContact O-CB 3.24Å; A591-R595 VanDerWaalsContact O-CG 3.3Å; A591-R595 WeakPolarHBondContact O-CG 3.03Å; A591-R595 PolarHBondContact O-N 3.43Å
592	R	84.6	Confident	82.2	Confident	183 Å²	183	116.2 Å²	116.2	69%	0.691	54%	0.543	S	S	*	.	H	α-helix	trans	-66.1	-43.7	173.8	-164.3	179.4	-170.7	-146.3	5.1	111.5	R588 S589 E590 R595 I596	R588-R592 WeakPolarHBondContact O-CB 3.14Å; R588-R592 PolarHBondContact O-N 3.05Å; S589-R592 PolarHBondContact O-N 3.27Å; E590-R592 VanDerWaalsContact C-N 3.27Å; E590-R592 PolarHBondContact O-N 3.28Å; R592-R595 PolarHBondContact O-N 3.12Å; R592-I596 HydrophobicContact CG-CD1 4.25Å; R592-I596 WeakPolarHBondContact O-CD1 3.28Å; R592-I596 VanDerWaalsContact O-CG1 3.29Å; R592-I596 WeakPolarHBondContact O-CG1 3.05Å; R592-I596 PolarHBondContact O-N 3.44Å
593	R	79.6	Confident	82.7	Confident	171 Å²	171	115.2 Å²	115.2	65%	0.645	54%	0.538	S	S	*	.	H	α-helix	trans	-61.5	-42.5	176.6	-71.4	170.4	-177.4	-148.5	-2.3	112.4	S589 E590 I596 R597	S589-R593 VanDerWaalsContact O-CG 3.31Å; S589-R593 WeakPolarHBondContact O-CG 3.25Å; S589-R593 PolarHBondContact O-N 3.01Å; E590-R593 WeakPolarHBondContact O-CB 3.47Å; E590-R593 PolarHBondContact O-N 2.97Å; E590-R593 VanDerWaalsContact O-N 3.11Å; R593-I596 PolarHBondContact O-N 3.02Å; R593-R597 PolarHBondContact O-N 2.61Å
594	E	82.5	Confident	83.1	Confident	87 Å²	87	120.1 Å²	120.1	41%	0.407	55%	0.551	S	S	.	*	H	α-helix	trans	-74.4	-36	-179.8	-162.3	63.5	-162.3	0	0	112	E590 I596 R597 I598	E590-E594 PolarHBondContact O-N 3.27Å; E594-I596 VanDerWaalsContact C-N 3.32Å; E594-I596 PolarHBondContact O-N 3.07Å; E594-R597 WeakPolarHBondContact O-CB 3.43Å; E594-R597 PolarHBondContact O-N 3.32Å; E594-R597 VanDerWaalsContact O-N 3.17Å; E594-R597 WeakPolarHBondContact OE2-CD 3.45Å; E594-R597 IonicContact OE2-CZ 3.1Å; E594-R597 IonicContact OE2-NE 3.83Å; E594-R597 IonicContact OE2-NH1 3.51Å; E594-R597 PolarHBondContact OE2-NH1 3.46Å; E594-I598 HydrophobicContact CG-CD1 4.46Å; E594-I598 WeakPolarHBondContact O-CG1 3.36Å; E594-I598 PolarHBondContact O-N 2.97Å
595	R	84.4	Confident	83.2	Confident	183 Å²	183	121.7 Å²	121.7	69%	0.691	56%	0.558	S	S	*	*	H	α-helix	trans	-56.6	-44.8	167.9	-74.9	-179.8	-165.1	-155.7	6.3	111.6	A591 R592 R597 I598 Q599	A591-R595 WeakPolarHBondContact O-CB 3.24Å; A591-R595 VanDerWaalsContact O-CG 3.3Å; A591-R595 WeakPolarHBondContact O-CG 3.03Å; A591-R595 PolarHBondContact O-N 3.43Å; R592-R595 PolarHBondContact O-N 3.12Å; R595-R597 VanDerWaalsContact C-N 3.35Å; R595-R597 PolarHBondContact O-N 3.31Å; R595-I598 PolarHBondContact O-N 3.27Å; R595-Q599 WeakPolarHBondContact O-CB 3.13Å; R595-Q599 WeakPolarHBondContact O-CG 3.06Å; R595-Q599 PolarHBondContact O-N 3.33Å
596	I	83	Confident	83.5	Confident	65 Å²	65	122.9 Å²	122.9	33%	0.333	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-37.7	176.8	-69.2	164.7	0	0	0	111.5	R592 R593 E594 R600	R592-I596 HydrophobicContact CG-CD1 4.25Å; R592-I596 WeakPolarHBondContact O-CD1 3.28Å; R592-I596 VanDerWaalsContact O-CG1 3.29Å; R592-I596 WeakPolarHBondContact O-CG1 3.05Å; R592-I596 PolarHBondContact O-N 3.44Å; R593-I596 PolarHBondContact O-N 3.02Å; E594-I596 VanDerWaalsContact C-N 3.32Å; E594-I596 PolarHBondContact O-N 3.07Å; I596-R600 HydrophobicContact CG2-CG 4.45Å; I596-R600 VanDerWaalsContact O-CB 3.29Å; I596-R600 WeakPolarHBondContact O-CB 3.46Å; I596-R600 VanDerWaalsContact O-CG 3.23Å; I596-R600 WeakPolarHBondContact O-CG 3.38Å; I596-R600 PolarHBondContact O-N 3.31Å
597	R	82.8	Confident	83.4	Confident	171 Å²	171	126.4 Å²	126.4	65%	0.645	57%	0.566	S	S	*	*	H	α-helix	trans	-62.2	-46.6	172	-85.3	169.4	168.7	169	1.1	112.2	R593 E594 R595 R600 A601	R593-R597 PolarHBondContact O-N 2.61Å; E594-R597 WeakPolarHBondContact O-CB 3.43Å; E594-R597 PolarHBondContact O-N 3.32Å; E594-R597 VanDerWaalsContact O-N 3.17Å; E594-R597 WeakPolarHBondContact OE2-CD 3.45Å; E594-R597 IonicContact OE2-CZ 3.1Å; E594-R597 IonicContact OE2-NE 3.83Å; E594-R597 IonicContact OE2-NH1 3.51Å; E594-R597 PolarHBondContact OE2-NH1 3.46Å; R595-R597 VanDerWaalsContact C-N 3.35Å; R595-R597 PolarHBondContact O-N 3.31Å; R597-R600 PolarHBondContact O-N 2.99Å; R597-A601 WeakPolarHBondContact O-CB 3.42Å; R597-A601 PolarHBondContact O-N 3Å
598	I	86.5	Confident	83.2	Confident	96 Å²	96	130 Å²	130	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-62.9	-49.4	179.5	-66.2	165.7	0	0	0	110.3	E594 R595 R600 A601 D602	E594-I598 HydrophobicContact CG-CD1 4.46Å; E594-I598 WeakPolarHBondContact O-CG1 3.36Å; E594-I598 PolarHBondContact O-N 2.97Å; R595-I598 PolarHBondContact O-N 3.27Å; I598-R600 VanDerWaalsContact C-N 3.34Å; I598-R600 PolarHBondContact O-N 2.67Å; I598-A601 WeakPolarHBondContact O-CB 3.49Å; I598-A601 PolarHBondContact O-N 3.28Å; I598-A601 VanDerWaalsContact O-N 3.08Å; I598-D602 PolarHBondContact O-N 2.86Å
599	Q	84.1	Confident	83.1	Confident	131 Å²	131	124.4 Å²	124.4	61%	0.612	56%	0.556	S	S	*	*	H	α-helix	trans	-56.4	-45.4	174.7	-74.3	177.1	-18.9	0	0	112.2	R595 A601 D602 K603	R595-Q599 WeakPolarHBondContact O-CB 3.13Å; R595-Q599 WeakPolarHBondContact O-CG 3.06Å; R595-Q599 PolarHBondContact O-N 3.33Å; Q599-A601 VanDerWaalsContact C-N 3.33Å; Q599-A601 PolarHBondContact O-N 3.45Å; Q599-D602 PolarHBondContact O-N 2.6Å; Q599-K603 WeakPolarHBondContact O-CB 3.26Å; Q599-K603 PolarHBondContact O-N 3.4Å
600	R	84.1	Confident	83	Confident	184 Å²	184	128.4 Å²	128.4	69%	0.694	57%	0.569	S	S	*	*	H	α-helix	trans	-63.3	-37.1	175.8	-76.2	175.6	175.7	-167.9	-1.9	112.2	I596 R597 I598 K604	I596-R600 HydrophobicContact CG2-CG 4.45Å; I596-R600 VanDerWaalsContact O-CB 3.29Å; I596-R600 WeakPolarHBondContact O-CB 3.46Å; I596-R600 VanDerWaalsContact O-CG 3.23Å; I596-R600 WeakPolarHBondContact O-CG 3.38Å; I596-R600 PolarHBondContact O-N 3.31Å; R597-R600 PolarHBondContact O-N 2.99Å; I598-R600 VanDerWaalsContact C-N 3.34Å; I598-R600 PolarHBondContact O-N 2.67Å; R600-K604 VanDerWaalsContact O-CB 3.25Å; R600-K604 WeakPolarHBondContact O-CB 3.38Å; R600-K604 PolarHBondContact O-N 2.93Å; R600-K604 VanDerWaalsContact O-N 3.09Å
601	A	85.4	Confident	82.7	Confident	58 Å²	58	127.4 Å²	127.4	48%	0.479	57%	0.567	S	S	.	*	H	α-helix	trans	-65.2	-45.4	175.4	0	0	0	0	0	111.7	R597 I598 Q599 K604 K605	R597-A601 WeakPolarHBondContact O-CB 3.42Å; R597-A601 PolarHBondContact O-N 3Å; I598-A601 WeakPolarHBondContact O-CB 3.49Å; I598-A601 PolarHBondContact O-N 3.28Å; I598-A601 VanDerWaalsContact O-N 3.08Å; Q599-A601 VanDerWaalsContact C-N 3.33Å; Q599-A601 PolarHBondContact O-N 3.45Å; A601-K604 CarbonylContact O-C 3.54Å; A601-K604 WeakPolarHBondContact O-CB 3.4Å; A601-K604 PolarHBondContact O-N 3.46Å; A601-K605 WeakPolarHBondContact O-CB 3.06Å; A601-K605 PolarHBondContact O-N 2.84Å
602	D	84.6	Confident	82.3	Confident	73 Å²	73	131.4 Å²	131.4	39%	0.39	58%	0.576	S	S	.	*	H	α-helix	trans	-72.3	-38	178.6	-83.6	-35.8	0	0	0	113.4	I598 Q599 K604 K605 K606	I598-D602 PolarHBondContact O-N 2.86Å; Q599-D602 PolarHBondContact O-N 2.6Å; D602-K604 PolarHBondContact O-N 3.12Å; D602-K605 PolarHBondContact O-N 3.27Å; D602-K606 WeakPolarHBondContact O-CB 3.29Å; D602-K606 WeakPolarHBondContact O-CG 3.48Å; D602-K606 PolarHBondContact O-N 2.86Å
603	K	84.8	Confident	81.7	Confident	116 Å²	116	130.2 Å²	130.2	50%	0.504	58%	0.575	S	S	.	*	H	α-helix	trans	-60	-36.2	171.7	-145.1	167.8	-175.6	177.7	0	109.6	D242 Q599 R607	D242-K603 VanDerWaalsContact CG-NZ 3.27Å; D242-K603 IonicContact OD1-NZ 2.71Å; D242-K603 PolarHBondContact OD1-NZ 3.2Å; D242-K603 IonicContact OD2-NZ 3.23Å; D242-K603 PolarHBondContact OD2-NZ 3.15Å; Q599-K603 WeakPolarHBondContact O-CB 3.26Å; Q599-K603 PolarHBondContact O-N 3.4Å; K603-R607 WeakPolarHBondContact O-CG 3.45Å; K603-R607 PolarHBondContact O-N 3.38Å
604	K	84.4	Confident	81.1	Confident	167 Å²	167	125.1 Å²	125.1	73%	0.726	57%	0.566	S	S	*	*	H	α-helix	trans	-72.5	-36.9	174.2	-157.1	171.2	-167.7	174.6	0	113.4	R600 A601 D602 K608	R600-K604 VanDerWaalsContact O-CB 3.25Å; R600-K604 WeakPolarHBondContact O-CB 3.38Å; R600-K604 PolarHBondContact O-N 2.93Å; R600-K604 VanDerWaalsContact O-N 3.09Å; A601-K604 CarbonylContact O-C 3.54Å; A601-K604 WeakPolarHBondContact O-CB 3.4Å; A601-K604 PolarHBondContact O-N 3.46Å; D602-K604 PolarHBondContact O-N 3.12Å; K604-K608 PolarHBondContact O-N 3.05Å
605	K	84.7	Confident	80.2	Confident	128 Å²	128	123.9 Å²	123.9	56%	0.557	57%	0.567	S	S	*	*	H	α-helix	trans	-65.5	-51.3	174.2	-174	179.7	174.4	-171.8	0	111.3	A601 D602 R607 K608 D609	A601-K605 WeakPolarHBondContact O-CB 3.06Å; A601-K605 PolarHBondContact O-N 2.84Å; D602-K605 PolarHBondContact O-N 3.27Å; K605-R607 VanDerWaalsContact C-N 3.33Å; K605-R607 PolarHBondContact O-N 2.73Å; K605-K608 WeakPolarHBondContact O-CA 3.13Å; K605-K608 WeakPolarHBondContact O-CB 3.47Å; K605-K608 PolarHBondContact O-N 3.21Å; K605-D609 PolarHBondContact O-N 3.34Å
606	K	83.9	Confident	79	Confident	160 Å²	160	122.9 Å²	122.9	70%	0.696	57%	0.568	S	S	*	*	H	α-helix	trans	-54	-44.9	175	-73	-177.7	179.5	-177.8	0	112	D602 K608 D609 H610	D602-K606 WeakPolarHBondContact O-CB 3.29Å; D602-K606 WeakPolarHBondContact O-CG 3.48Å; D602-K606 PolarHBondContact O-N 2.86Å; K606-K608 PolarHBondContact O-N 3.3Å; K606-D609 PolarHBondContact O-N 3.41Å; K606-H610 WeakPolarHBondContact O-CB 3.45Å; K606-H610 PolarHBondContact O-N 2.99Å
607	R	79.1	Confident	77.7	Confident	191 Å²	191	124.8 Å²	124.8	72%	0.721	58%	0.579	S	S	*	*	H	α-helix	trans	-59.6	-42.1	173.4	-73.9	-178.2	84	175.1	8.6	112.6	K603 K605 H610 L611	K603-R607 WeakPolarHBondContact O-CG 3.45Å; K603-R607 PolarHBondContact O-N 3.38Å; K605-R607 VanDerWaalsContact C-N 3.33Å; K605-R607 PolarHBondContact O-N 2.73Å; R607-H610 PolarHBondContact O-N 3.38Å; R607-L611 WeakPolarHBondContact O-CD1 3.36Å; R607-L611 PolarHBondContact O-N 2.67Å
608	K	80.4	Confident	76.3	Confident	135 Å²	135	124.7 Å²	124.7	59%	0.587	58%	0.583	S	S	*	*	H	α-helix	trans	-66.1	-37.9	-179.9	-143.2	175.7	-170.9	-178.5	0	112.2	K604 K605 K606 K612	K604-K608 PolarHBondContact O-N 3.05Å; K605-K608 WeakPolarHBondContact O-CA 3.13Å; K605-K608 WeakPolarHBondContact O-CB 3.47Å; K605-K608 PolarHBondContact O-N 3.21Å; K606-K608 PolarHBondContact O-N 3.3Å; K608-K612 PolarHBondContact O-N 3.13Å
609	D	80.1	Confident	74.5	Confident	77 Å²	77	127.3 Å²	127.3	41%	0.412	59%	0.593	S	S	.	*	H	α-helix	trans	-76.6	-31.6	176.5	-66.8	-35.2	0	0	0	112.7	K605 K606 K612 K613	K605-D609 PolarHBondContact O-N 3.34Å; K606-D609 PolarHBondContact O-N 3.41Å; D609-K612 PolarHBondContact O-N 3.03Å; D609-K613 PolarHBondContact O-N 3.26Å
610	H	79	Confident	72.9	Confident	136 Å²	136	129.3 Å²	129.3	63%	0.63	60%	0.599	S	S	*	*	H	α-helix	trans	-64.9	-42	171.9	-159.2	-112.9	0	0	0	111.8	K606 R607 K612 K613 S614	K606-H610 WeakPolarHBondContact O-CB 3.45Å; K606-H610 PolarHBondContact O-N 2.99Å; R607-H610 PolarHBondContact O-N 3.38Å; H610-K612 VanDerWaalsContact C-N 3.32Å; H610-K612 PolarHBondContact O-N 2.77Å; H610-K613 PolarHBondContact O-N 2.97Å; H610-S614 PolarHBondContact O-N 3.44Å
611	L	75.2	Confident	71.1	Confident	116 Å²	116	131.3 Å²	131.3	61%	0.607	61%	0.607	S	S	*	*	H	α-helix	trans	-60.5	-37.8	171.6	-98.6	70.6	0	0	0	112.6	R607 S614 S615	R607-L611 WeakPolarHBondContact O-CD1 3.36Å; R607-L611 PolarHBondContact O-N 2.67Å; L611-S614 PolarHBondContact O-OG 3.07Å; L611-S614 VanDerWaalsContact O-OG 3.13Å; L611-S615 PolarHBondContact O-N 3.44Å; L611-S615 PolarHBondContact O-OG 3.39Å
612	K	75	Confident	69.1	Low	132 Å²	132	137.6 Å²	137.6	57%	0.574	62%	0.623	S	S	*	*	H	α-helix	trans	-68.6	-34.6	174.6	-76.7	179.6	173.5	-179.1	0	113.1	K608 D609 H610 S615 K616	K608-K612 PolarHBondContact O-N 3.13Å; D609-K612 PolarHBondContact O-N 3.03Å; H610-K612 VanDerWaalsContact C-N 3.32Å; H610-K612 PolarHBondContact O-N 2.77Å; K612-S615 PolarHBondContact O-OG 3.48Å; K612-K616 PolarHBondContact O-N 2.83Å
613	K	73.2	Confident	66.8	Low	157 Å²	157	144.9 Å²	144.9	68%	0.683	65%	0.645	S	S	*	*	H	α-helix	trans	-69.7	-43.4	173.1	-88.2	-173.9	172.1	-178.1	0	111.6	D609 H610 K616 N617	D609-K613 PolarHBondContact O-N 3.26Å; H610-K613 PolarHBondContact O-N 2.97Å; K613-K616 PolarHBondContact O-N 3.3Å; K613-N617 PolarHBondContact O-N 3.5Å
614	S	66.1	Low	64.3	Low	65 Å²	65	145.2 Å²	145.2	46%	0.455	65%	0.653	S	S	.	*	H	α-helix	trans	-66.6	-39.2	179.9	71.2	0	0	0	0	112.4	H610 L611 N617 K618	H610-S614 PolarHBondContact O-N 3.44Å; L611-S614 PolarHBondContact O-OG 3.07Å; L611-S614 VanDerWaalsContact O-OG 3.13Å; S614-N617 PolarHBondContact O-N 3.34Å; S614-K618 WeakPolarHBondContact O-CB 3.35Å; S614-K618 PolarHBondContact O-N 2.92Å
615	S	63	Low	61.8	Low	60 Å²	60	146.4 Å²	146.4	42%	0.42	66%	0.661	S	S	.	*	H	α-helix	trans	-65.9	-42.3	175.1	68.5	0	0	0	0	112.8	L611 K612 N617 K618 H619	L611-S615 PolarHBondContact O-N 3.44Å; L611-S615 PolarHBondContact O-OG 3.39Å; K612-S615 PolarHBondContact O-OG 3.48Å; S615-N617 PolarHBondContact O-N 3.3Å; S615-K618 PolarHBondContact O-N 3.34Å; S615-H619 PolarHBondContact O-N 2.69Å
616	K	59.6	Low	59.2	Low	162 Å²	162	146.1 Å²	146.1	70%	0.704	68%	0.675	S	S	*	*	H	α-helix	trans	-60.7	-42.8	173.1	-85.6	-168.7	170.9	-173.1	0	112.4	K612 K613 H619 K620	K612-K616 PolarHBondContact O-N 2.83Å; K613-K616 PolarHBondContact O-N 3.3Å; K616-H619 PolarHBondContact O-N 2.95Å; K616-K620 PolarHBondContact O-N 3.1Å
617	N	56.2	Low	56.6	Low	106 Å²	106	143.9 Å²	143.9	57%	0.567	68%	0.679	S	S	*	*	H	α-helix	trans	-67.8	-33.8	176	-80.8	-0.4	0	0	0	112.7	K613 S614 S615 H619 K620 R621	K613-N617 PolarHBondContact O-N 3.5Å; S614-N617 PolarHBondContact O-N 3.34Å; S615-N617 PolarHBondContact O-N 3.3Å; N617-H619 VanDerWaalsContact C-N 3.34Å; N617-K620 PolarHBondContact O-N 3.16Å; N617-R621 PolarHBondContact O-N 2.97Å
618	K	52.5	Low	54.2	Low	168 Å²	168	140.6 Å²	140.6	73%	0.73	69%	0.685	S	S	*	*	H	α-helix	trans	-66.6	-33.9	175.3	-158.5	171.6	-173.5	179	0	112.2	S614 S615	S614-K618 WeakPolarHBondContact O-CB 3.35Å; S614-K618 PolarHBondContact O-N 2.92Å; S615-K618 PolarHBondContact O-N 3.34Å
619	H	49.2	Very low	51.8	Low	151 Å²	151	139.4 Å²	139.4	70%	0.699	69%	0.694	S	S	*	*	H	α-helix	trans	-71.1	-42.8	168.2	-86.1	-77.6	0	0	0	112.8	S615 K616 N617 R621 K622	S615-H619 PolarHBondContact O-N 2.69Å; K616-H619 PolarHBondContact O-N 2.95Å; N617-H619 VanDerWaalsContact C-N 3.34Å; H619-R621 VanDerWaalsContact C-N 3.28Å; H619-R621 PolarHBondContact O-N 2.65Å; H619-K622 PolarHBondContact O-N 2.83Å
620	K	49.8	Very low	49.3	Very low	173 Å²	173	140.5 Å²	140.5	75%	0.752	71%	0.708	S	S	*	*	H	α-helix	trans	-66.8	-26.6	-178	-138.4	-176.9	-174.8	-169.7	0	113.3	K616 N617	K616-K620 PolarHBondContact O-N 3.1Å; N617-K620 PolarHBondContact O-N 3.16Å
621	R	46.9	Very low	47	Very low	226 Å²	226	139.5 Å²	139.5	85%	0.853	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-9.7	174.2	-82.9	-173.7	166.3	-176.9	-4.9	115.3	N617 H619	N617-R621 PolarHBondContact O-N 2.97Å; H619-R621 VanDerWaalsContact C-N 3.28Å; H619-R621 PolarHBondContact O-N 2.65Å
622	K	42.9	Very low	44.9	Very low	190 Å²	190	137.7 Å²	137.7	83%	0.826	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	18.8	178.6	-94	-158.8	172	-163.4	0	114.1	H619	H619-K622 PolarHBondContact O-N 2.83Å
623	R	36.5	Very low	42.9	Very low	226 Å²	226	140.7 Å²	140.7	85%	0.853	74%	0.742	S	S	*	*	S	Bend	trans	-127.6	12.2	-170.8	-141.6	176.8	-178.1	175.6	-0.1	115.7
624	N	32.3	Very low	41.1	Very low	123 Å²	123	137.5 Å²	137.5	66%	0.658	74%	0.739	S	S	*	*			trans	-118.8	158.7	170.1	-64.6	18.9	0	0	0	108.2
625	H	32.3	Very low	39.9	Very low	192 Å²	192	141.7 Å²	141.7	89%	0.889	76%	0.762	S	S	*	*			trans	67.7	131.9	-162.4	-37.4	-73.9	0	0	0	111.6
626	S	31.4	Very low	39.1	Very low	122 Å²	122	142.7 Å²	142.7	85%	0.853	76%	0.76	S	S	*	*			cis	-140.3	165.3	6.1	50	0	0	0	0	111.8
627	S	28.6	Very low	38.7	Very low	114 Å²	114	136.8 Å²	136.8	80%	0.797	75%	0.745	S	S	*	*			trans	-146.1	124.4	-171.9	55.6	0	0	0	0	113.5
628	S	28.9	Very low	39.2	Very low	121 Å²	121	138.4 Å²	138.4	85%	0.846	75%	0.752	S	S	*	*			trans	-177.1	147.4	156.7	46.2	0	0	0	0	112.3
629	S	28.4	Very low	40.1	Very low	111 Å²	111	138 Å²	138	78%	0.776	75%	0.753	S	S	*	*			trans	58.2	121.2	166.7	-140.6	0	0	0	0	117.6
630	S	28.9	Very low	41.3	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	74%	0.743	S	S	*	*			cis	63	126.7	49.4	-149.3	0	0	0	0	112.4
631	S	29.5	Very low	42.6	Very low	115 Å²	115	130.7 Å²	130.7	80%	0.804	73%	0.726	S	S	*	*			cis	-171.1	154.4	-3	30.3	0	0	0	0	110
632	G	32.8	Very low	44.1	Very low	79 Å²	79	124.7 Å²	124.7	81%	0.814	71%	0.708	S	S	*	*			trans	167.1	131.5	169.9	0	0	0	0	0	113.1
633	E	32.4	Very low	46.1	Very low	195 Å²	195	119.5 Å²	119.5	91%	0.911	69%	0.686	S	S	*	*			trans	-97.2	145.2	-178.8	-68.6	163.1	91.6	0	0	112.4
634	S	35.7	Very low	48.4	Very low	89 Å²	89	114.1 Å²	114.1	62%	0.622	67%	0.666	S	S	*	*			trans	-152.3	138.1	140.8	52.3	0	0	0	0	109	E636	S634-E636 PolarHBondContact O-N 2.97Å
635	V	40.8	Very low	51.1	Low	153 Å²	153	111.6 Å²	111.6	93%	0.927	65%	0.652	S	S	*	*			trans	-87	88	-177.5	-178	0	0	0	0	108.8
636	E	46	Very low	53.8	Low	82 Å²	82	102.8 Å²	102.8	38%	0.383	61%	0.611	S	S	.	*			trans	-107.9	143.8	176.4	-60	-174	102.2	0	0	110.1	S634 R644	S634-E636 PolarHBondContact O-N 2.97Å; E636-R644 IonicContact OE1-CZ 2.62Å; E636-R644 IonicContact OE1-NH1 3.44Å; E636-R644 PolarHBondContact OE1-NH1 3.29Å; E636-R644 IonicContact OE1-NH2 2.68Å; E636-R644 PolarHBondContact OE1-NH2 3.19Å; E636-R644 IonicContact OE2-CZ 2.65Å; E636-R644 IonicContact OE2-NH1 2.68Å; E636-R644 PolarHBondContact OE2-NH1 2.61Å; E636-R644 IonicContact OE2-NH2 3.24Å; E636-R644 PolarHBondContact OE2-NH2 3.46Å
637	G	52	Low	56.5	Low	38 Å²	38	102.5 Å²	102.5	39%	0.392	60%	0.597	S	S	.	*			trans	-63.4	145.6	-172	0	0	0	0	0	112.5	E639 Q640 V641	G637-E639 PolarHBondContact O-N 3.48Å; G637-E639 VanDerWaalsContact O-N 3.11Å; G637-Q640 WeakPolarHBondContact O-CA 3.21Å; G637-Q640 WeakPolarHBondContact O-CB 3.42Å; G637-Q640 PolarHBondContact O-N 3.45Å; G637-V641 PolarHBondContact O-N 3.27Å; G637-V641 VanDerWaalsContact O-N 3.09Å
638	I	64.8	Low	59.4	Low	140 Å²	140	102.2 Å²	102.2	72%	0.718	58%	0.583	S	S	*	*	H	α-helix	trans	-52.1	-39.9	-179	-58.4	171.9	0	0	0	111	V641 Q642	I638-V641 PolarHBondContact O-N 3.24Å; I638-Q642 WeakPolarHBondContact O-CG 3.44Å; I638-Q642 PolarHBondContact O-N 3.27Å
639	E	72	Confident	62.3	Low	159 Å²	159	96.9 Å²	96.9	74%	0.743	55%	0.546	S	S	*	.	H	α-helix	trans	-63.7	-40.4	175.6	-60	173.3	153.8	0	0	112.8	G637 V641 Q642 E643	G637-E639 PolarHBondContact O-N 3.48Å; G637-E639 VanDerWaalsContact O-N 3.11Å; E639-V641 VanDerWaalsContact C-N 3.3Å; E639-V641 PolarHBondContact O-N 3.16Å; E639-Q642 PolarHBondContact O-N 3.44Å; E639-E643 WeakPolarHBondContact O-CB 3.29Å; E639-E643 PolarHBondContact O-N 3.39Å
640	Q	74.3	Confident	65.2	Low	106 Å²	106	93.2 Å²	93.2	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-69	-28.4	177.6	-63.8	177.9	-18.8	0	0	112.6	G637 R644	G637-Q640 WeakPolarHBondContact O-CA 3.21Å; G637-Q640 WeakPolarHBondContact O-CB 3.42Å; G637-Q640 PolarHBondContact O-N 3.45Å; Q640-R644 PolarHBondContact O-N 3.29Å; Q640-R644 PolarHBondContact O-NE 3.5Å
641	V	76.4	Confident	68.1	Low	65 Å²	65	96.5 Å²	96.5	39%	0.394	52%	0.515	S	S	.	.	H	α-helix	trans	-73.2	-45.4	172.7	179.6	0	0	0	0	110	G637 I638 E639 R644 L645	G637-V641 PolarHBondContact O-N 3.27Å; G637-V641 VanDerWaalsContact O-N 3.09Å; I638-V641 PolarHBondContact O-N 3.24Å; E639-V641 VanDerWaalsContact C-N 3.3Å; E639-V641 PolarHBondContact O-N 3.16Å; V641-R644 WeakPolarHBondContact O-CB 3.38Å; V641-R644 PolarHBondContact O-N 3.16Å; V641-L645 HydrophobicContact CG1-CD1 4.12Å; V641-L645 WeakPolarHBondContact O-CG 3.5Å; V641-L645 PolarHBondContact O-N 3.05Å
642	Q	79.5	Confident	70.8	Confident	99 Å²	99	96.5 Å²	96.5	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-60.7	-47.6	174.7	-71.9	-177.9	-64.8	0	0	112.1	I638 E639 R644 L645 I646	I638-Q642 WeakPolarHBondContact O-CG 3.44Å; I638-Q642 PolarHBondContact O-N 3.27Å; E639-Q642 PolarHBondContact O-N 3.44Å; Q642-R644 VanDerWaalsContact C-N 3.27Å; Q642-R644 PolarHBondContact O-N 2.95Å; Q642-L645 PolarHBondContact O-N 3.3Å; Q642-L645 VanDerWaalsContact O-N 3.1Å; Q642-I646 WeakPolarHBondContact O-CD1 3.22Å; Q642-I646 VanDerWaalsContact O-CG1 3.26Å; Q642-I646 WeakPolarHBondContact O-CG1 3.34Å; Q642-I646 PolarHBondContact O-N 3.1Å
643	E	84	Confident	73.2	Confident	81 Å²	81	95.8 Å²	95.8	38%	0.379	48%	0.476	S	S	.	.	H	α-helix	trans	-56.9	-39.9	177.1	-171.9	102	-95.2	0	0	111.8	E639 I646 Q647 R692	E639-E643 WeakPolarHBondContact O-CB 3.29Å; E639-E643 PolarHBondContact O-N 3.39Å; E643-I646 PolarHBondContact O-N 2.74Å; E643-Q647 WeakPolarHBondContact O-CG 3.28Å; E643-Q647 PolarHBondContact O-N 3.09Å; E643-R692 IonicContact OE1-CZ 3.67Å; E643-R692 IonicContact OE1-NH1 3.78Å; E643-R692 PolarHBondContact OE1-NH1 2.93Å; E643-R692 IonicContact OE1-NH2 2.76Å; E643-R692 PolarHBondContact OE1-NH2 3.48Å
644	R	86.4	Confident	75.9	Confident	114 Å²	114	92.9 Å²	92.9	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-43.9	174.9	-119.3	171.5	-72.2	-172.4	-12.3	112.6	E636 Q640 V641 Q642 I646 Q647 E648	E636-R644 IonicContact OE1-CZ 2.62Å; E636-R644 IonicContact OE1-NH1 3.44Å; E636-R644 PolarHBondContact OE1-NH1 3.29Å; E636-R644 IonicContact OE1-NH2 2.68Å; E636-R644 PolarHBondContact OE1-NH2 3.19Å; E636-R644 IonicContact OE2-CZ 2.65Å; E636-R644 IonicContact OE2-NH1 2.68Å; E636-R644 PolarHBondContact OE2-NH1 2.61Å; E636-R644 IonicContact OE2-NH2 3.24Å; E636-R644 PolarHBondContact OE2-NH2 3.46Å; Q640-R644 PolarHBondContact O-N 3.29Å; Q640-R644 PolarHBondContact O-NE 3.5Å; V641-R644 WeakPolarHBondContact O-CB 3.38Å; V641-R644 PolarHBondContact O-N 3.16Å; Q642-R644 VanDerWaalsContact C-N 3.27Å; Q642-R644 PolarHBondContact O-N 2.95Å; R644-I646 VanDerWaalsContact C-N 3.35Å; R644-Q647 PolarHBondContact O-N 2.82Å; R644-E648 PolarHBondContact O-N 2.66Å
645	L	88	Confident	78.3	Confident	70 Å²	70	93.5 Å²	93.5	37%	0.366	45%	0.453	S	S	.	.	H	α-helix	trans	-65.8	-37.9	177.7	-68.8	165.5	0	0	0	111.6	V641 Q642 E648 A649 E685	V641-L645 HydrophobicContact CG1-CD1 4.12Å; V641-L645 WeakPolarHBondContact O-CG 3.5Å; V641-L645 PolarHBondContact O-N 3.05Å; Q642-L645 PolarHBondContact O-N 3.3Å; Q642-L645 VanDerWaalsContact O-N 3.1Å; L645-E648 PolarHBondContact O-N 3.48Å; L645-A649 WeakPolarHBondContact O-CB 3.4Å; L645-A649 PolarHBondContact O-N 2.87Å; L645-E685 HydrophobicContact CB-CB 4.31Å; L645-E685 HydrophobicContact CB-CG 3.79Å
646	I	88.2	Confident	80.4	Confident	6 Å²	6	93 Å²	93	3%	0.031	44%	0.435	C	S	.	.	H	α-helix	trans	-64.8	-41.4	173.1	-63.5	160.5	0	0	0	110.6	Q642 E643 R644 A649 I650 E685 E688	Q642-I646 WeakPolarHBondContact O-CD1 3.22Å; Q642-I646 VanDerWaalsContact O-CG1 3.26Å; Q642-I646 WeakPolarHBondContact O-CG1 3.34Å; Q642-I646 PolarHBondContact O-N 3.1Å; E643-I646 PolarHBondContact O-N 2.74Å; R644-I646 VanDerWaalsContact C-N 3.35Å; I646-A649 PolarHBondContact O-N 3.18Å; I646-I650 HydrophobicContact CG2-CD1 4.05Å; I646-I650 VanDerWaalsContact O-CG1 3.3Å; I646-I650 WeakPolarHBondContact O-CG1 3.46Å; I646-I650 PolarHBondContact O-N 3.45Å; I646-E685 HydrophobicContact CG1-CB 3.98Å; I646-E685 HydrophobicContact CG1-CG 4.43Å; I646-E688 HydrophobicContact CD1-CB 4.4Å; I646-E688 VanDerWaalsContact CD1-OE2 3.28Å; I646-E688 WeakPolarHBondContact CD1-OE2 3.46Å; I646-E688 HydrophobicContact CG1-CB 4.39Å
647	Q	88.5	Confident	82.2	Confident	116 Å²	116	93.2 Å²	93.2	54%	0.542	44%	0.438	S	S	.	.	H	α-helix	trans	-65.4	-39.6	174.6	-73.2	-178.4	19.7	0	0	112.6	E643 R644 I650 R651	E643-Q647 WeakPolarHBondContact O-CG 3.28Å; E643-Q647 PolarHBondContact O-N 3.09Å; R644-Q647 PolarHBondContact O-N 2.82Å; Q647-I650 PolarHBondContact O-N 2.92Å; Q647-R651 WeakPolarHBondContact O-CB 3.29Å; Q647-R651 PolarHBondContact O-N 3.34Å
648	E	90.3	Very high	83.9	Confident	108 Å²	108	99 Å²	99	51%	0.505	45%	0.452	S	S	.	.	H	α-helix	trans	-61	-42	170.6	-92.8	-144.2	151.9	0	0	112.4	R644 L645 R651 K652	R644-E648 PolarHBondContact O-N 2.66Å; L645-E648 PolarHBondContact O-N 3.48Å; E648-R651 PolarHBondContact O-N 2.91Å; E648-K652 WeakPolarHBondContact O-CB 3.45Å; E648-K652 PolarHBondContact O-N 2.94Å; E648-K652 IonicContact OE2-NZ 2.62Å; E648-K652 PolarHBondContact OE2-NZ 3.13Å
649	A	88.7	Confident	84.8	Confident	10 Å²	10	94 Å²	94	8%	0.083	43%	0.432	C	S	.	.	H	α-helix	trans	-64.8	-44.7	178	0	0	0	0	0	111.7	L645 I646 R651 K652 E653 E686 A689	L645-A649 WeakPolarHBondContact O-CB 3.4Å; L645-A649 PolarHBondContact O-N 2.87Å; I646-A649 PolarHBondContact O-N 3.18Å; A649-R651 VanDerWaalsContact C-N 3.27Å; A649-R651 PolarHBondContact O-N 2.86Å; A649-K652 PolarHBondContact O-N 2.97Å; A649-E653 PolarHBondContact O-N 3.37Å; A649-E686 HydrophobicContact CB-CG 4.21Å; A649-A689 HydrophobicContact CB-CB 3.73Å
650	I	89.3	Confident	85.2	Confident	33 Å²	33	88.2 Å²	88.2	17%	0.169	41%	0.407	C	S	.	.	H	α-helix	trans	-58.5	-40.1	173.3	-69.2	168	0	0	0	111	I646 Q647 K654 A689 R692 T693	I646-I650 HydrophobicContact CG2-CD1 4.05Å; I646-I650 VanDerWaalsContact O-CG1 3.3Å; I646-I650 WeakPolarHBondContact O-CG1 3.46Å; I646-I650 PolarHBondContact O-N 3.45Å; Q647-I650 PolarHBondContact O-N 2.92Å; I650-K654 HydrophobicContact CG2-CD 4.41Å; I650-K654 WeakPolarHBondContact O-CG 3.5Å; I650-K654 PolarHBondContact O-N 2.84Å; I650-K654 VanDerWaalsContact O-N 3.14Å; I650-A689 HydrophobicContact CG1-CB 3.62Å; I650-R692 HydrophobicContact CD1-CB 4.38Å; I650-T693 HydrophobicContact CG1-CG2 4.24Å; I650-T693 HydrophobicContact CG2-CG2 4.25Å
651	R	89.6	Confident	85.7	Confident	169 Å²	169	88 Å²	88	64%	0.638	41%	0.409	S	S	*	.	H	α-helix	trans	-68.4	-46.2	177.7	-178.1	176.8	167.8	175	-3.7	112	Q647 E648 A649 E653 K654 E655	Q647-R651 WeakPolarHBondContact O-CB 3.29Å; Q647-R651 PolarHBondContact O-N 3.34Å; E648-R651 PolarHBondContact O-N 2.91Å; A649-R651 VanDerWaalsContact C-N 3.27Å; A649-R651 PolarHBondContact O-N 2.86Å; R651-E653 VanDerWaalsContact C-N 3.34Å; R651-E653 PolarHBondContact O-N 3.08Å; R651-K654 PolarHBondContact O-N 3.3Å; R651-E655 IonicContact CZ-OE1 3.26Å; R651-E655 IonicContact NE-OE1 2.76Å; R651-E655 PolarHBondContact NE-OE1 2.85Å; R651-E655 IonicContact NH2-OE1 2.69Å; R651-E655 PolarHBondContact NH2-OE1 2.98Å; R651-E655 PolarHBondContact O-N 2.83Å
652	K	87.7	Confident	86.1	Confident	114 Å²	114	91.2 Å²	91.2	50%	0.496	42%	0.42	S	S	.	.	H	α-helix	trans	-58.6	-43	175.8	-82.9	167.2	179.2	140.4	0	112	E648 A649 E655 R656	E648-K652 WeakPolarHBondContact O-CB 3.45Å; E648-K652 PolarHBondContact O-N 2.94Å; E648-K652 IonicContact OE2-NZ 2.62Å; E648-K652 PolarHBondContact OE2-NZ 3.13Å; A649-K652 PolarHBondContact O-N 2.97Å; K652-E655 PolarHBondContact O-N 3.27Å; K652-R656 WeakPolarHBondContact O-CB 3.46Å; K652-R656 PolarHBondContact O-N 3.28Å
653	E	83.2	Confident	86.1	Confident	65 Å²	65	89.7 Å²	89.7	30%	0.304	41%	0.41	S	S	.	.	H	α-helix	trans	-70.3	-34.2	179.9	-171	56.8	-159.9	0	0	112	A649 R651 R656 L657	A649-E653 PolarHBondContact O-N 3.37Å; R651-E653 VanDerWaalsContact C-N 3.34Å; R651-E653 PolarHBondContact O-N 3.08Å; E653-R656 VanDerWaalsContact CD-NE 3.29Å; E653-R656 PolarHBondContact O-N 3.14Å; E653-R656 IonicContact OE1-CZ 3.72Å; E653-R656 VanDerWaalsContact OE1-CZ 3.27Å; E653-R656 IonicContact OE1-NE 2.65Å; E653-R656 PolarHBondContact OE1-NE 3.3Å; E653-R656 IonicContact OE1-NH2 3.76Å; E653-R656 PolarHBondContact OE1-NH2 3.36Å; E653-R656 WeakPolarHBondContact OE2-CD 3.44Å; E653-R656 IonicContact OE2-CZ 2.9Å; E653-R656 IonicContact OE2-NE 2.63Å; E653-R656 PolarHBondContact OE2-NE 2.87Å; E653-R656 IonicContact OE2-NH2 2.71Å; E653-L657 HydrophobicContact CG-CD1 4.31Å; E653-L657 WeakPolarHBondContact O-CB 3.24Å; E653-L657 VanDerWaalsContact O-CG 3.29Å; E653-L657 WeakPolarHBondContact O-CG 3.47Å; E653-L657 PolarHBondContact O-N 3.29Å
654	K	87.6	Confident	85.7	Confident	134 Å²	134	90.9 Å²	90.9	58%	0.583	42%	0.419	S	S	*	.	H	α-helix	trans	-64.4	-38.5	170.1	-76	178.7	177	-177.8	0	112.9	I650 R651 K658	I650-K654 HydrophobicContact CG2-CD 4.41Å; I650-K654 WeakPolarHBondContact O-CG 3.5Å; I650-K654 PolarHBondContact O-N 2.84Å; I650-K654 VanDerWaalsContact O-N 3.14Å; R651-K654 PolarHBondContact O-N 3.3Å; K654-K658 PolarHBondContact O-N 2.87Å; K654-K658 VanDerWaalsContact O-N 3.13Å
655	E	87.4	Confident	85.7	Confident	102 Å²	102	89.8 Å²	89.8	48%	0.477	44%	0.435	S	S	.	.	H	α-helix	trans	-68.1	-38.3	173.3	-71.6	170.8	-169.2	0	0	111.2	R651 K652 A659	R651-E655 IonicContact CZ-OE1 3.26Å; R651-E655 IonicContact NE-OE1 2.76Å; R651-E655 PolarHBondContact NE-OE1 2.85Å; R651-E655 IonicContact NH2-OE1 2.69Å; R651-E655 PolarHBondContact NH2-OE1 2.98Å; R651-E655 PolarHBondContact O-N 2.83Å; K652-E655 PolarHBondContact O-N 3.27Å; E655-A659 PolarHBondContact O-N 3.33Å; E655-A659 VanDerWaalsContact O-N 3.08Å
656	R	83.9	Confident	85.3	Confident	142 Å²	142	90.5 Å²	90.5	54%	0.536	44%	0.437	S	S	.	.	H	α-helix	trans	-65.4	-44.6	175	-164.8	-176	77.7	122	4	112.6	K652 E653 A659 V660	K652-R656 WeakPolarHBondContact O-CB 3.46Å; K652-R656 PolarHBondContact O-N 3.28Å; E653-R656 VanDerWaalsContact CD-NE 3.29Å; E653-R656 PolarHBondContact O-N 3.14Å; E653-R656 IonicContact OE1-CZ 3.72Å; E653-R656 VanDerWaalsContact OE1-CZ 3.27Å; E653-R656 IonicContact OE1-NE 2.65Å; E653-R656 PolarHBondContact OE1-NE 3.3Å; E653-R656 IonicContact OE1-NH2 3.76Å; E653-R656 PolarHBondContact OE1-NH2 3.36Å; E653-R656 WeakPolarHBondContact OE2-CD 3.44Å; E653-R656 IonicContact OE2-CZ 2.9Å; E653-R656 IonicContact OE2-NE 2.63Å; E653-R656 PolarHBondContact OE2-NE 2.87Å; E653-R656 IonicContact OE2-NH2 2.71Å; R656-A659 PolarHBondContact O-N 3.45Å; R656-V660 WeakPolarHBondContact O-CG2 3.43Å; R656-V660 PolarHBondContact O-N 2.93Å
657	L	83.8	Confident	85	Confident	87 Å²	87	94.6 Å²	94.6	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-62.5	-44.8	177	-74.2	167.9	0	0	0	111.2	E653 A659 V660 D661	E653-L657 HydrophobicContact CG-CD1 4.31Å; E653-L657 WeakPolarHBondContact O-CB 3.24Å; E653-L657 VanDerWaalsContact O-CG 3.29Å; E653-L657 WeakPolarHBondContact O-CG 3.47Å; E653-L657 PolarHBondContact O-N 3.29Å; L657-A659 VanDerWaalsContact C-N 3.32Å; L657-A659 PolarHBondContact O-N 3.01Å; L657-V660 WeakPolarHBondContact O-CB 3.26Å; L657-V660 PolarHBondContact O-N 3.09Å; L657-D661 PolarHBondContact O-N 3.18Å
658	K	87.5	Confident	84.5	Confident	160 Å²	160	97.6 Å²	97.6	70%	0.696	47%	0.473	S	S	*	.	H	α-helix	trans	-55.7	-45.1	172.2	-81.9	-172.2	171.8	-170.3	0	112.6	K654 V660 D661 E662	K654-K658 PolarHBondContact O-N 2.87Å; K654-K658 VanDerWaalsContact O-N 3.13Å; K658-V660 VanDerWaalsContact C-N 3.31Å; K658-V660 PolarHBondContact O-N 3.49Å; K658-D661 PolarHBondContact O-N 3.47Å; K658-E662 VanDerWaalsContact O-CB 3.26Å; K658-E662 WeakPolarHBondContact O-CB 3.42Å; K658-E662 PolarHBondContact O-N 2.92Å
659	A	84.7	Confident	83.9	Confident	35 Å²	35	104.4 Å²	104.4	29%	0.289	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-33.7	176.9	0	0	0	0	0	112.6	E655 R656 L657 Y663	E655-A659 PolarHBondContact O-N 3.33Å; E655-A659 VanDerWaalsContact O-N 3.08Å; R656-A659 PolarHBondContact O-N 3.45Å; L657-A659 VanDerWaalsContact C-N 3.32Å; L657-A659 PolarHBondContact O-N 3.01Å; A659-Y663 WeakPolarHBondContact O-CB 3.4Å; A659-Y663 WeakPolarHBondContact O-CD2 3.49Å; A659-Y663 PolarHBondContact O-N 2.94Å
660	V	80.8	Confident	83.5	Confident	36 Å²	36	111 Å²	111	22%	0.218	52%	0.521	C	S	.	.	H	α-helix	trans	-68.2	-42.7	174.6	168.9	0	0	0	0	111.6	R656 L657 K658 Y663 L664 L676	R656-V660 WeakPolarHBondContact O-CG2 3.43Å; R656-V660 PolarHBondContact O-N 2.93Å; L657-V660 WeakPolarHBondContact O-CB 3.26Å; L657-V660 PolarHBondContact O-N 3.09Å; K658-V660 VanDerWaalsContact C-N 3.31Å; K658-V660 PolarHBondContact O-N 3.49Å; V660-Y663 CarbonylContact O-C 3.59Å; V660-Y663 PolarHBondContact O-N 2.85Å; V660-L664 HydrophobicContact CG1-CD1 4.17Å; V660-L664 WeakPolarHBondContact O-CG 3.42Å; V660-L664 PolarHBondContact O-N 3.27Å; V660-L676 HydrophobicContact CG2-CD1 4.34Å; V660-L676 HydrophobicContact CG2-CD2 4.3Å
661	D	84.1	Confident	83.2	Confident	101 Å²	101	113.9 Å²	113.9	54%	0.54	53%	0.53	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.3	-72.6	-21.7	0	0	0	111.7	L657 K658 Y663 L664 A665	L657-D661 PolarHBondContact O-N 3.18Å; K658-D661 PolarHBondContact O-N 3.47Å; D661-Y663 VanDerWaalsContact C-N 3.32Å; D661-Y663 PolarHBondContact O-N 3.48Å; D661-L664 CarbonylContact O-C 3.58Å; D661-L664 WeakPolarHBondContact O-CA 3.24Å; D661-L664 WeakPolarHBondContact O-CB 3.36Å; D661-L664 PolarHBondContact O-N 3.28Å; D661-A665 PolarHBondContact O-N 2.91Å
662	E	85	Confident	82.5	Confident	133 Å²	133	108.8 Å²	108.8	62%	0.621	52%	0.519	S	S	*	.	H	α-helix	trans	-63.6	-38.2	175	-166.3	169.1	-126.3	0	0	111.2	K658 A665 M666	K658-E662 VanDerWaalsContact O-CB 3.26Å; K658-E662 WeakPolarHBondContact O-CB 3.42Å; K658-E662 PolarHBondContact O-N 2.92Å; E662-A665 PolarHBondContact O-N 3.37Å; E662-M666 HydrophobicContact CG-CE 4.33Å; E662-M666 WeakPolarHBondContact O-CG 3.43Å
663	Y	78.6	Confident	81.2	Confident	67 Å²	67	114.6 Å²	114.6	26%	0.263	54%	0.539	S	S	.	.	H	α-helix	trans	-68.1	-30.2	168.2	-82.1	-53.1	0	0	0	113.5	A659 V660 D661 R671 P672	A659-Y663 WeakPolarHBondContact O-CB 3.4Å; A659-Y663 WeakPolarHBondContact O-CD2 3.49Å; A659-Y663 PolarHBondContact O-N 2.94Å; V660-Y663 CarbonylContact O-C 3.59Å; V660-Y663 PolarHBondContact O-N 2.85Å; D661-Y663 VanDerWaalsContact C-N 3.32Å; D661-Y663 PolarHBondContact O-N 3.48Å; Y663-R671 PolarHBondContact O-NE 3.46Å; Y663-R671 PolarHBondContact O-NH2 3.3Å; Y663-P672 HydrophobicContact CD1-CG 4.42Å; Y663-P672 HydrophobicContact CE1-CG 3.6Å
664	L	77.4	Confident	80.4	Confident	106 Å²	106	118.1 Å²	118.1	56%	0.555	56%	0.56	S	S	*	*	H	α-helix	trans	-74	-29.9	176	-80.9	166	0	0	0	112.2	V660 D661 M666 R671	V660-L664 HydrophobicContact CG1-CD1 4.17Å; V660-L664 WeakPolarHBondContact O-CG 3.42Å; V660-L664 PolarHBondContact O-N 3.27Å; D661-L664 CarbonylContact O-C 3.58Å; D661-L664 WeakPolarHBondContact O-CA 3.24Å; D661-L664 WeakPolarHBondContact O-CB 3.36Å; D661-L664 PolarHBondContact O-N 3.28Å; L664-M666 VanDerWaalsContact C-N 3.3Å; L664-R671 VanDerWaalsContact CG-NH2 3.31Å
665	A	84.9	Confident	79	Confident	92 Å²	92	114.2 Å²	114.2	76%	0.76	55%	0.55	S	S	*	.	S	Bend	trans	-76.2	-13.2	176.6	0	0	0	0	0	113.9	D661 E662	D661-A665 PolarHBondContact O-N 2.91Å; E662-A665 PolarHBondContact O-N 3.37Å
666	M	80.5	Confident	77.8	Confident	85 Å²	85	114.3 Å²	114.3	42%	0.419	55%	0.553	S	S	.	*	S	Bend	trans	-86.3	140.2	175.5	-67.6	-175.1	-162.7	0	0	112.4	E662 L664 E668	E662-M666 HydrophobicContact CG-CE 4.33Å; E662-M666 WeakPolarHBondContact O-CG 3.43Å; L664-M666 VanDerWaalsContact C-N 3.3Å; M666-E668 PolarHBondContact O-N 2.9Å
667	D	81.7	Confident	76.4	Confident	92 Å²	92	110 Å²	110	49%	0.492	55%	0.548	S	S	.	.			trans	-45	136.9	171.3	-64.2	-59.3	0	0	0	112.1	R669 K670 R671	D667-R669 PolarHBondContact O-N 2.92Å; D667-K670 HydrophobicContact CB-CB 4.39Å; D667-K670 HydrophobicContact CB-CD 4.17Å; D667-K670 HydrophobicContact CB-CG 4.23Å; D667-K670 PolarHBondContact O-N 2.72Å; D667-K670 WeakPolarHBondContact OD2-CD 3.3Å; D667-K670 VanDerWaalsContact OD2-CE 3.24Å; D667-K670 WeakPolarHBondContact OD2-CE 3.25Å; D667-K670 IonicContact OD2-NZ 2.92Å; D667-K670 PolarHBondContact OD2-NZ 3.08Å; D667-R671 PolarHBondContact O-N 2.88Å; D667-R671 VanDerWaalsContact O-N 3.12Å
668	E	77.2	Confident	75.2	Confident	179 Å²	179	112.7 Å²	112.7	84%	0.836	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.2	-30.2	176.8	-61.4	-170.7	132.6	0	0	113.2	M666	M666-E668 PolarHBondContact O-N 2.9Å
669	R	78.4	Confident	74	Confident	250 Å²	250	111.8 Å²	111.8	94%	0.943	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-21.3	177.9	-67.2	-176.5	176.2	-173.3	-0.6	114.7	D667	D667-R669 PolarHBondContact O-N 2.92Å
670	K	80.2	Confident	73.3	Confident	150 Å²	150	118 Å²	118	65%	0.652	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-19	177.5	-67.1	172.7	-175.1	153.3	0	112	D667 P672	D667-K670 HydrophobicContact CB-CB 4.39Å; D667-K670 HydrophobicContact CB-CD 4.17Å; D667-K670 HydrophobicContact CB-CG 4.23Å; D667-K670 PolarHBondContact O-N 2.72Å; D667-K670 WeakPolarHBondContact OD2-CD 3.3Å; D667-K670 VanDerWaalsContact OD2-CE 3.24Å; D667-K670 WeakPolarHBondContact OD2-CE 3.25Å; D667-K670 IonicContact OD2-NZ 2.92Å; D667-K670 PolarHBondContact OD2-NZ 3.08Å; K670-P672 WeakPolarHBondContact O-CD 3.49Å
671	R	82.6	Confident	73.1	Confident	92 Å²	92	120.6 Å²	120.6	35%	0.347	62%	0.615	S	S	.	*	S	Bend	trans	-60.8	117.5	-179	-139.4	174.5	-166.8	-163.8	-2.8	110.6	Y663 L664 D667 Y673	Y663-R671 PolarHBondContact O-NE 3.46Å; Y663-R671 PolarHBondContact O-NH2 3.3Å; L664-R671 VanDerWaalsContact CG-NH2 3.31Å; D667-R671 PolarHBondContact O-N 2.88Å; D667-R671 VanDerWaalsContact O-N 3.12Å; R671-Y673 PolarHBondContact O-N 3.21Å
672	P	75.8	Confident	72.7	Confident	63 Å²	63	119.9 Å²	119.9	41%	0.409	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-68.1	123.4	-178.1	26	-33.2	0	0	0	110.7	Y663 K670 N674	Y663-P672 HydrophobicContact CD1-CG 4.42Å; Y663-P672 HydrophobicContact CE1-CG 3.6Å; K670-P672 WeakPolarHBondContact O-CD 3.49Å; P672-N674 PolarHBondContact O-N 3.34Å
673	Y	60.9	Low	72.6	Confident	236 Å²	236	116.5 Å²	116.5	93%	0.925	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	128.9	170.3	-95.2	-111.2	0	0	0	109.7	R671	R671-Y673 PolarHBondContact O-N 3.21Å
674	N	64.8	Low	72.9	Confident	138 Å²	138	116.7 Å²	116.7	74%	0.738	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.9	23.7	171.3	-154.1	74.8	0	0	0	117.9	P672 L676 A677	P672-N674 PolarHBondContact O-N 3.34Å; N674-L676 VanDerWaalsContact C-N 3.35Å; N674-L676 PolarHBondContact O-N 3.31Å; N674-A677 WeakPolarHBondContact ND2-CB 3.32Å
675	S	59.1	Low	73.3	Confident	53 Å²	53	114.2 Å²	114.2	37%	0.371	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-17.9	177.6	58.6	0	0	0	0	116.3
676	L	62.9	Low	73.3	Confident	103 Å²	103	114 Å²	114	54%	0.539	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.5	24	-173.4	-64.1	174.5	0	0	0	114.2	V660 N674 D678	V660-L676 HydrophobicContact CG2-CD1 4.34Å; V660-L676 HydrophobicContact CG2-CD2 4.3Å; N674-L676 VanDerWaalsContact C-N 3.35Å; N674-L676 PolarHBondContact O-N 3.31Å; L676-D678 PolarHBondContact O-N 2.76Å
677	A	53.5	Low	73.4	Confident	52 Å²	52	113.9 Å²	113.9	43%	0.43	59%	0.589	S	S	.	*			trans	-80.3	-10.2	-166.6	0	0	0	0	0	116.6	N674 V679	N674-A677 WeakPolarHBondContact ND2-CB 3.32Å; A677-V679 VanDerWaalsContact C-N 3.34Å; A677-V679 PolarHBondContact O-N 2.96Å
678	D	58.7	Low	73.4	Confident	143 Å²	143	114 Å²	114	77%	0.765	59%	0.586	S	S	*	*			trans	-86.1	66.6	-166.6	-122.4	35.1	0	0	0	113.1	L676 K680	L676-D678 PolarHBondContact O-N 2.76Å; D678-K680 PolarHBondContact O-N 2.69Å
679	V	61.7	Low	73.9	Confident	141 Å²	141	105.6 Å²	105.6	86%	0.855	55%	0.548	S	S	*	.			trans	-71.7	95.5	179	-174.7	0	0	0	0	111.1	A677	A677-V679 VanDerWaalsContact C-N 3.34Å; A677-V679 PolarHBondContact O-N 2.96Å
680	K	70	Confident	74.1	Confident	167 Å²	167	99.9 Å²	99.9	73%	0.726	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-86.4	155.9	162.5	-67.1	173.8	-173.3	164.8	0	110.1	D678	D678-K680 PolarHBondContact O-N 2.69Å
681	A	77.3	Confident	74.2	Confident	89 Å²	89	100 Å²	100	74%	0.736	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-76.8	133.6	166.4	0	0	0	0	0	108.8
682	P	74.7	Confident	74.1	Confident	86 Å²	86	102 Å²	102	56%	0.558	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-58.6	146.3	-178	-27.2	35.5	0	0	0	113.9	E686 M687	P682-E686 VanDerWaalsContact CA-OE2 3.25Å; P682-E686 WeakPolarHBondContact CA-OE2 3.26Å; P682-E686 HydrophobicContact CB-CB 4.18Å; P682-M687 HydrophobicContact CB-CG 4.14Å; P682-M687 HydrophobicContact CB-SD 4.43Å
683	T	84.3	Confident	74.2	Confident	62 Å²	62	102.3 Å²	102.3	38%	0.38	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-76	172.9	168.2	77	0	0	0	0	111.8	E685 E686 M687	T683-E685 VanDerWaalsContact C-N 3.33Å; T683-E685 WeakPolarHBondContact CB-OE2 3.18Å; T683-E685 PolarHBondContact OG1-N 2.89Å; T683-E685 PolarHBondContact OG1-OE2 3.1Å; T683-E686 PolarHBondContact N-OE2 3.28Å; T683-E686 PolarHBondContact O-N 3.44Å; T683-E686 WeakPolarHBondContact OG1-CG 3.49Å; T683-E686 PolarHBondContact OG1-N 3.05Å; T683-E686 VanDerWaalsContact OG1-N 3.16Å; T683-M687 VanDerWaalsContact O-CG 3.28Å; T683-M687 WeakPolarHBondContact O-CG 3.28Å; T683-M687 PolarHBondContact O-N 3.28Å
684	A	85.3	Confident	75.1	Confident	71 Å²	71	96.2 Å²	96.2	59%	0.587	51%	0.511	S	S	*	.	H	α-helix	trans	-64	-40.2	174.2	0	0	0	0	0	111.4	M687 E688	A684-M687 WeakPolarHBondContact O-CB 3.36Å; A684-M687 PolarHBondContact O-N 3.31Å; A684-E688 PolarHBondContact O-N 3.1Å
685	E	84.4	Confident	75.5	Confident	54 Å²	54	94.7 Å²	94.7	25%	0.252	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-33.3	178.9	-44.7	92.2	166.6	0	0	111.7	L645 I646 T683 E688 A689	L645-E685 HydrophobicContact CB-CB 4.31Å; L645-E685 HydrophobicContact CB-CG 3.79Å; I646-E685 HydrophobicContact CG1-CB 3.98Å; I646-E685 HydrophobicContact CG1-CG 4.43Å; T683-E685 VanDerWaalsContact C-N 3.33Å; T683-E685 WeakPolarHBondContact CB-OE2 3.18Å; T683-E685 PolarHBondContact OG1-N 2.89Å; T683-E685 PolarHBondContact OG1-OE2 3.1Å; E685-E688 PolarHBondContact O-N 2.91Å; E685-A689 WeakPolarHBondContact O-CB 3.41Å; E685-A689 PolarHBondContact O-N 2.67Å
686	E	85.5	Confident	76.1	Confident	88 Å²	88	96.3 Å²	96.3	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-36.6	172.4	-70.4	171.6	164.4	0	0	112	A649 P682 T683 Y690	A649-E686 HydrophobicContact CB-CG 4.21Å; P682-E686 VanDerWaalsContact CA-OE2 3.25Å; P682-E686 WeakPolarHBondContact CA-OE2 3.26Å; P682-E686 HydrophobicContact CB-CB 4.18Å; T683-E686 PolarHBondContact N-OE2 3.28Å; T683-E686 PolarHBondContact O-N 3.44Å; T683-E686 WeakPolarHBondContact OG1-CG 3.49Å; T683-E686 PolarHBondContact OG1-N 3.05Å; T683-E686 VanDerWaalsContact OG1-N 3.16Å; E686-Y690 WeakPolarHBondContact O-CB 3.47Å; E686-Y690 PolarHBondContact O-N 3.05Å
687	M	81.6	Confident	76.3	Confident	83 Å²	83	102.6 Å²	102.6	41%	0.409	53%	0.527	S	S	.	.	H	α-helix	trans	-65.4	-44.5	172.2	-73.3	-80.4	-68.1	0	0	111.8	P682 T683 A684 Y690 Y691	P682-M687 HydrophobicContact CB-CG 4.14Å; P682-M687 HydrophobicContact CB-SD 4.43Å; T683-M687 VanDerWaalsContact O-CG 3.28Å; T683-M687 WeakPolarHBondContact O-CG 3.28Å; T683-M687 PolarHBondContact O-N 3.28Å; A684-M687 WeakPolarHBondContact O-CB 3.36Å; A684-M687 PolarHBondContact O-N 3.31Å; M687-Y690 WeakPolarHBondContact O-CB 3.07Å; M687-Y690 PolarHBondContact O-N 2.85Å; M687-Y691 HydrophobicContact CB-CE2 4.43Å; M687-Y691 HydrophobicContact CE-CE2 4.02Å; M687-Y691 WeakPolarHBondContact O-CD2 3.4Å; M687-Y691 PolarHBondContact O-N 3.03Å
688	E	83.7	Confident	77.2	Confident	93 Å²	93	107.6 Å²	107.6	44%	0.435	55%	0.547	S	S	.	.	H	α-helix	trans	-69.4	-35.6	176.4	-71.4	-172.2	138.5	0	0	112.6	I646 A684 E685 Y690 Y691 R692	I646-E688 HydrophobicContact CD1-CB 4.4Å; I646-E688 VanDerWaalsContact CD1-OE2 3.28Å; I646-E688 WeakPolarHBondContact CD1-OE2 3.46Å; I646-E688 HydrophobicContact CG1-CB 4.39Å; A684-E688 PolarHBondContact O-N 3.1Å; E685-E688 PolarHBondContact O-N 2.91Å; E688-Y690 VanDerWaalsContact C-N 3.33Å; E688-Y690 PolarHBondContact O-N 3.31Å; E688-Y691 PolarHBondContact O-N 3.33Å; E688-R692 WeakPolarHBondContact O-CB 3.49Å; E688-R692 WeakPolarHBondContact O-CG 3.41Å; E688-R692 PolarHBondContact O-N 2.86Å
689	A	86.1	Confident	77.7	Confident	4 Å²	4	104.4 Å²	104.4	3%	0.033	53%	0.53	C	S	.	.	H	α-helix	trans	-60.4	-41.9	170	0	0	0	0	0	111.8	A649 I650 E685 R692 T693	A649-A689 HydrophobicContact CB-CB 3.73Å; I650-A689 HydrophobicContact CG1-CB 3.62Å; E685-A689 WeakPolarHBondContact O-CB 3.41Å; E685-A689 PolarHBondContact O-N 2.67Å; A689-R692 PolarHBondContact O-N 3.12Å; A689-T693 WeakPolarHBondContact O-CB 3.48Å; A689-T693 WeakPolarHBondContact O-CG2 3.36Å; A689-T693 PolarHBondContact O-N 3.22Å; A689-T693 VanDerWaalsContact O-N 3.16Å; A689-T693 PolarHBondContact O-OG1 3.11Å
690	Y	83.4	Confident	78.2	Confident	130 Å²	130	102.8 Å²	102.8	51%	0.51	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-49.5	172.2	174.4	-100.6	0	0	0	111.4	E686 M687 E688 R692 T693 K694	E686-Y690 WeakPolarHBondContact O-CB 3.47Å; E686-Y690 PolarHBondContact O-N 3.05Å; M687-Y690 WeakPolarHBondContact O-CB 3.07Å; M687-Y690 PolarHBondContact O-N 2.85Å; E688-Y690 VanDerWaalsContact C-N 3.33Å; E688-Y690 PolarHBondContact O-N 3.31Å; Y690-R692 VanDerWaalsContact C-N 3.34Å; Y690-R692 PolarHBondContact O-N 3.11Å; Y690-T693 CarbonylContact O-C 3.55Å; Y690-T693 PolarHBondContact O-N 3.43Å; Y690-T693 VanDerWaalsContact O-N 3.1Å; Y690-T693 PolarHBondContact O-OG1 3.48Å; Y690-K694 HydrophobicContact CE1-CD 4.25Å; Y690-K694 WeakPolarHBondContact O-CB 3.5Å; Y690-K694 PolarHBondContact O-N 2.75Å
691	Y	82.2	Confident	78.4	Confident	151 Å²	151	100.7 Å²	100.7	59%	0.592	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-38.1	177.7	-67.3	-55.2	0	0	0	113.1	M687 E688 T693	M687-Y691 HydrophobicContact CB-CE2 4.43Å; M687-Y691 HydrophobicContact CE-CE2 4.02Å; M687-Y691 WeakPolarHBondContact O-CD2 3.4Å; M687-Y691 PolarHBondContact O-N 3.03Å; E688-Y691 PolarHBondContact O-N 3.33Å; Y691-T693 PolarHBondContact O-N 3.09Å
692	R	80.2	Confident	78	Confident	136 Å²	136	98 Å²	98	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-70	-13.2	175	-74.9	-178.6	176.6	-160.3	-1.3	114.4	E643 I650 E688 A689 Y690	E643-R692 IonicContact OE1-CZ 3.67Å; E643-R692 IonicContact OE1-NH1 3.78Å; E643-R692 PolarHBondContact OE1-NH1 2.93Å; E643-R692 IonicContact OE1-NH2 2.76Å; E643-R692 PolarHBondContact OE1-NH2 3.48Å; I650-R692 HydrophobicContact CD1-CB 4.38Å; E688-R692 WeakPolarHBondContact O-CB 3.49Å; E688-R692 WeakPolarHBondContact O-CG 3.41Å; E688-R692 PolarHBondContact O-N 2.86Å; A689-R692 PolarHBondContact O-N 3.12Å; Y690-R692 VanDerWaalsContact C-N 3.34Å; Y690-R692 PolarHBondContact O-N 3.11Å
693	T	78.2	Confident	77.6	Confident	68 Å²	68	102 Å²	102	42%	0.417	50%	0.503	S	S	.	.	H	α-helix	trans	-120.9	-2.5	-177.3	55.9	0	0	0	0	114.3	I650 A689 Y690 Y691 V695	I650-T693 HydrophobicContact CG1-CG2 4.24Å; I650-T693 HydrophobicContact CG2-CG2 4.25Å; A689-T693 WeakPolarHBondContact O-CB 3.48Å; A689-T693 WeakPolarHBondContact O-CG2 3.36Å; A689-T693 PolarHBondContact O-N 3.22Å; A689-T693 VanDerWaalsContact O-N 3.16Å; A689-T693 PolarHBondContact O-OG1 3.11Å; Y690-T693 CarbonylContact O-C 3.55Å; Y690-T693 PolarHBondContact O-N 3.43Å; Y690-T693 VanDerWaalsContact O-N 3.1Å; Y690-T693 PolarHBondContact O-OG1 3.48Å; Y691-T693 PolarHBondContact O-N 3.09Å; T693-V695 PolarHBondContact O-N 2.97Å; T693-V695 VanDerWaalsContact O-N 3.13Å
694	K	80.1	Confident	76.7	Confident	108 Å²	108	107.4 Å²	107.4	47%	0.47	52%	0.522	S	S	.	.			trans	-73.4	101.9	-178.8	-173.4	-162	176	-132.1	0	111.7	Y690 N696	Y690-K694 HydrophobicContact CE1-CD 4.25Å; Y690-K694 WeakPolarHBondContact O-CB 3.5Å; Y690-K694 PolarHBondContact O-N 2.75Å; K694-N696 PolarHBondContact NZ-OD1 2.71Å; K694-N696 PolarHBondContact O-N 3.34Å
695	V	72.5	Confident	75.2	Confident	107 Å²	107	112.9 Å²	112.9	65%	0.648	55%	0.548	S	S	*	.			trans	-68	124.6	166.8	-177.2	0	0	0	0	109.8	T693 R697	T693-V695 PolarHBondContact O-N 2.97Å; T693-V695 VanDerWaalsContact O-N 3.13Å; V695-R697 PolarHBondContact O-N 3.23Å
696	N	72.7	Confident	74.7	Confident	87 Å²	87	115.8 Å²	115.8	47%	0.465	56%	0.562	S	S	.	*			trans	-77.3	113.5	170.2	-87.4	-11.5	0	0	0	109.4	K694 D698 D699	K694-N696 PolarHBondContact NZ-OD1 2.71Å; K694-N696 PolarHBondContact O-N 3.34Å; N696-D698 PolarHBondContact O-N 3.38Å; N696-D699 HydrophobicContact CB-CB 4.29Å; N696-D699 PolarHBondContact O-N 3.26Å
697	R	67.1	Low	74.2	Confident	234 Å²	234	117.3 Å²	117.3	88%	0.883	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-14.7	176.5	-79.4	-178.5	162.2	156.4	-3.6	114.3	V695 D699	V695-R697 PolarHBondContact O-N 3.23Å; R697-D699 VanDerWaalsContact C-N 3.33Å
698	D	70.6	Confident	73.7	Confident	157 Å²	157	119.2 Å²	119.2	84%	0.84	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-1.7	177.6	-48.2	-65.5	0	0	0	112.5	N696	N696-D698 PolarHBondContact O-N 3.38Å
699	D	71.1	Confident	73.2	Confident	76 Å²	76	120.7 Å²	120.7	41%	0.406	59%	0.588	S	S	.	*			trans	-88.9	115.8	174.1	-177.8	-7.2	0	0	0	110.4	N696 R697 M701 S702	N696-D699 HydrophobicContact CB-CB 4.29Å; N696-D699 PolarHBondContact O-N 3.26Å; R697-D699 VanDerWaalsContact C-N 3.33Å; D699-M701 PolarHBondContact O-N 2.69Å; D699-M701 WeakPolarHBondContact OD1-CB 3.45Å; D699-M701 PolarHBondContact OD1-N 3.06Å; D699-S702 VanDerWaalsContact O-CB 3.26Å; D699-S702 WeakPolarHBondContact O-CB 3.38Å; D699-S702 PolarHBondContact O-N 3.19Å; D699-S702 PolarHBondContact O-OG 2.9Å
700	P	71.6	Confident	72.3	Confident	108 Å²	108	128 Å²	128	70%	0.701	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-15.3	178.8	28.7	-35.4	0	0	0	113.8
701	M	73.4	Confident	71.6	Confident	123 Å²	123	127.9 Å²	127.9	61%	0.606	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-9.6	172.1	-71.8	-169	61.5	0	0	113.8	D699 H703 F704	D699-M701 PolarHBondContact O-N 2.69Å; D699-M701 WeakPolarHBondContact OD1-CB 3.45Å; D699-M701 PolarHBondContact OD1-N 3.06Å; M701-H703 PolarHBondContact O-N 2.94Å; M701-F704 PolarHBondContact O-N 2.89Å
702	S	69.2	Low	70.9	Confident	33 Å²	33	126.2 Å²	126.2	23%	0.231	63%	0.633	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.8	-5	-178.2	64.6	0	0	0	0	115.6	D699	D699-S702 VanDerWaalsContact O-CB 3.26Å; D699-S702 WeakPolarHBondContact O-CB 3.38Å; D699-S702 PolarHBondContact O-N 3.19Å; D699-S702 PolarHBondContact O-OG 2.9Å
703	H	66.9	Low	70.1	Confident	168 Å²	168	125.5 Å²	125.5	78%	0.778	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	3.1	174.9	-73.8	-66.9	0	0	0	114.3	M701	M701-H703 PolarHBondContact O-N 2.94Å
704	F	65	Low	69.5	Low	176 Å²	176	130.3 Å²	130.3	77%	0.772	66%	0.661	S	S	*	*			trans	-115.4	12	-174.3	-70.8	-84.9	0	0	0	114.2	M701	M701-F704 PolarHBondContact O-N 2.89Å
705	V	53.5	Low	68.5	Low	186 Å²	186	132.3 Å²	132.3	100%	1.127	68%	0.678	S	S	*	*			trans	-134.2	0	178.1	-172.9	0	0	0	0	109.6

Retrieved 705 of 705 residues in 142 ms (Link to these results)

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