A0A3Q0KJG9_SCHMA Loading...

C-CAP/cofactor C-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KJG9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 371 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	40.8	Very low	39.8	Very low	247 Å²	247	164.3 Å²	164.3	100%	1.217	86%	0.862	S	S	*	*				0	130.6	0	-76.5	174.9	167.9	0	0	107.4
2	N	40.8	Very low	39.9	Very low	161 Å²	161	160 Å²	160	86%	0.861	86%	0.856	S	S	*	*			trans	-55.6	140.7	-156	-82.1	-17.5	0	0	0	116.7	N4	N2-N4 PolarHBondContact O-N 3.22Å
3	S	40.4	Very low	40.3	Very low	113 Å²	113	162.1 Å²	162.1	79%	0.79	85%	0.853	S	S	*	*			trans	-45.3	123.4	159.8	-47.5	0	0	0	0	112
4	N	41.9	Very low	40.7	Very low	164 Å²	164	156 Å²	156	88%	0.877	83%	0.828	S	S	*	*			trans	-130.8	74.7	163.3	-100.5	-19.6	0	0	0	107.7	N2 K6	N2-N4 PolarHBondContact O-N 3.22Å; N4-K6 PolarHBondContact O-N 3.33Å
5	Q	42.2	Very low	41.7	Very low	193 Å²	193	151.3 Å²	151.3	90%	0.902	81%	0.813	S	S	*	*			trans	-79.2	99.6	161.5	-91.6	177.1	-24.8	0	0	107.2	S7	Q5-S7 PolarHBondContact O-N 3.01Å
6	K	40.1	Very low	42.5	Very low	204 Å²	204	149.8 Å²	149.8	89%	0.887	80%	0.804	S	S	*	*			trans	-83.3	96	172.9	-136.6	175	-173.8	-179.8	0	107.1	N4 S8	N4-K6 PolarHBondContact O-N 3.33Å; K6-S8 PolarHBondContact O-N 3.28Å
7	S	38.3	Very low	43.3	Very low	108 Å²	108	147.6 Å²	147.6	76%	0.755	79%	0.791	S	S	*	*			trans	-66.7	115.1	170.5	21	0	0	0	0	109.2	Q5 E9	Q5-S7 PolarHBondContact O-N 3.01Å; S7-E9 PolarHBondContact O-N 2.87Å; S7-E9 VanDerWaalsContact O-N 3.13Å
8	S	37.3	Very low	44.7	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	78%	0.779	S	S	*	*			trans	-70.8	98.2	174.6	-45.2	0	0	0	0	109.3	K6 N10	K6-S8 PolarHBondContact O-N 3.28Å; S8-N10 PolarHBondContact O-N 2.96Å; S8-N10 VanDerWaalsContact O-N 3.09Å
9	E	36.9	Very low	46.1	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	76%	0.764	S	S	*	*			trans	-67.8	102.3	167.1	-79	177.6	161	0	0	109.1	S7 K11	S7-E9 PolarHBondContact O-N 2.87Å; S7-E9 VanDerWaalsContact O-N 3.13Å; E9-K11 VanDerWaalsContact C-N 3.31Å; E9-K11 PolarHBondContact O-N 2.92Å
10	N	36.9	Very low	47.5	Very low	157 Å²	157	139.7 Å²	139.7	84%	0.84	76%	0.755	S	S	*	*			trans	-63	94.9	163.7	-84.5	-16.6	0	0	0	108.1	S8 S12	S8-N10 PolarHBondContact O-N 2.96Å; S8-N10 VanDerWaalsContact O-N 3.09Å; N10-S12 VanDerWaalsContact C-N 3.3Å; N10-S12 PolarHBondContact O-N 3.13Å
11	K	42.7	Very low	48.8	Very low	177 Å²	177	137 Å²	137	77%	0.77	75%	0.746	S	S	*	*			trans	-63.8	94.2	166.6	-75.6	-177.3	177.1	179.7	0	108.3	E9 F13	E9-K11 VanDerWaalsContact C-N 3.31Å; E9-K11 PolarHBondContact O-N 2.92Å; K11-F13 PolarHBondContact O-N 2.81Å; K11-F13 VanDerWaalsContact O-N 3.12Å
12	S	41	Very low	50.7	Low	113 Å²	113	130 Å²	130	79%	0.79	71%	0.71	S	S	*	*			trans	-58.6	110.5	165.9	50.1	0	0	0	0	108.4	N10	N10-S12 VanDerWaalsContact C-N 3.3Å; N10-S12 PolarHBondContact O-N 3.13Å
13	F	44.1	Very low	52.6	Low	187 Å²	187	125.1 Å²	125.1	82%	0.82	69%	0.686	S	S	*	*			trans	-60.1	140	171	-86.2	-93.7	0	0	0	109.4	K11 S15	K11-F13 PolarHBondContact O-N 2.81Å; K11-F13 VanDerWaalsContact O-N 3.12Å; F13-S15 PolarHBondContact O-N 3.48Å; F13-S15 VanDerWaalsContact O-N 3.09Å
14	P	46.8	Very low	54.3	Low	77 Å²	77	123.2 Å²	123.2	50%	0.5	67%	0.67	S	S	.	*			trans	-63.8	116	-178	25	-31.5	0	0	0	109.4	N16 I17	P14-N16 PolarHBondContact O-N 2.82Å; P14-I17 HydrophobicContact CG-CD1 4.21Å; P14-I17 PolarHBondContact O-N 3.08Å
15	S	55.4	Low	56	Low	86 Å²	86	120.1 Å²	120.1	60%	0.601	65%	0.653	S	S	*	*	H	α-helix	trans	-47.3	-28.1	176.7	41.6	0	0	0	0	113.5	F13 I17 S18 D19	F13-S15 PolarHBondContact O-N 3.48Å; F13-S15 VanDerWaalsContact O-N 3.09Å; S15-I17 VanDerWaalsContact C-N 3.3Å; S15-I17 PolarHBondContact O-N 3.09Å; S15-S18 WeakPolarHBondContact O-CB 3.27Å; S15-S18 PolarHBondContact O-N 3.39Å; S15-S18 VanDerWaalsContact O-N 3.12Å; S15-D19 PolarHBondContact O-N 3.39Å; S15-D19 VanDerWaalsContact O-N 3.1Å
16	N	54.7	Low	58.1	Low	126 Å²	126	115 Å²	115	67%	0.674	63%	0.632	S	S	*	*	H	α-helix	trans	-56.8	-33.3	-178.9	-129.1	-28.7	0	0	0	114.9	P14 N20	P14-N16 PolarHBondContact O-N 2.82Å; N16-N20 PolarHBondContact O-N 2.93Å
17	I	55.6	Low	60	Low	113 Å²	113	112.8 Å²	112.8	58%	0.579	62%	0.618	S	S	*	*	H	α-helix	trans	-75.3	-39.2	178.7	-61.7	174.6	0	0	0	110.6	P14 S15 N20 C21	P14-I17 HydrophobicContact CG-CD1 4.21Å; P14-I17 PolarHBondContact O-N 3.08Å; S15-I17 VanDerWaalsContact C-N 3.3Å; S15-I17 PolarHBondContact O-N 3.09Å; I17-N20 PolarHBondContact O-N 2.79Å; I17-C21 PolarHBondContact O-N 2.76Å
18	S	68.4	Low	61.6	Low	81 Å²	81	111.7 Å²	111.7	57%	0.566	60%	0.603	S	S	*	*	H	α-helix	trans	-63	-44.2	178	-173.7	0	0	0	0	110.9	S15 N20 C21 Q22	S15-S18 WeakPolarHBondContact O-CB 3.27Å; S15-S18 PolarHBondContact O-N 3.39Å; S15-S18 VanDerWaalsContact O-N 3.12Å; S18-N20 VanDerWaalsContact C-N 3.33Å; S18-N20 PolarHBondContact O-N 3.31Å; S18-C21 PolarHBondContact O-N 2.93Å; S18-Q22 WeakPolarHBondContact O-CB 3.47Å; S18-Q22 PolarHBondContact O-N 3.29Å
19	D	72.2	Confident	63.7	Low	95 Å²	95	110.1 Å²	110.1	51%	0.508	59%	0.589	S	S	.	*	H	α-helix	trans	-63.8	-38.7	179.2	-66.2	-22	0	0	0	111.6	S15 Q22 T23	S15-D19 PolarHBondContact O-N 3.39Å; S15-D19 VanDerWaalsContact O-N 3.1Å; D19-Q22 PolarHBondContact O-N 2.73Å; D19-T23 WeakPolarHBondContact O-CB 3.47Å; D19-T23 PolarHBondContact O-N 3.49Å; D19-T23 PolarHBondContact O-OG1 3.27Å
20	N	73.8	Confident	65.9	Low	109 Å²	109	107.3 Å²	107.3	58%	0.583	58%	0.576	S	S	*	*	H	α-helix	trans	-69.4	-43	178.1	-159.4	20.4	0	0	0	112.1	N16 I17 S18 Q22 T23 V24	N16-N20 PolarHBondContact O-N 2.93Å; I17-N20 PolarHBondContact O-N 2.79Å; S18-N20 VanDerWaalsContact C-N 3.33Å; S18-N20 PolarHBondContact O-N 3.31Å; N20-Q22 VanDerWaalsContact C-N 3.34Å; N20-Q22 PolarHBondContact O-N 3.06Å; N20-T23 PolarHBondContact O-N 3.01Å; N20-V24 WeakPolarHBondContact O-CG2 3.38Å; N20-V24 PolarHBondContact O-N 2.97Å
21	C	74.9	Confident	67.6	Low	84 Å²	84	107.9 Å²	107.9	57%	0.568	57%	0.566	S	S	*	*	H	α-helix	trans	-59.8	-44.1	173.5	-86.7	0	0	0	0	111.8	I17 S18 V24 L25	I17-C21 PolarHBondContact O-N 2.76Å; S18-C21 PolarHBondContact O-N 2.93Å; C21-V24 PolarHBondContact O-N 3.43Å; C21-L25 PolarHBondContact O-N 3.43Å
22	Q	79.7	Confident	69.2	Low	98 Å²	98	105.7 Å²	105.7	46%	0.458	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-43.3	178.1	-169.2	60.1	46.9	0	0	111.4	S18 D19 N20 V24 L25 D26	S18-Q22 WeakPolarHBondContact O-CB 3.47Å; S18-Q22 PolarHBondContact O-N 3.29Å; D19-Q22 PolarHBondContact O-N 2.73Å; N20-Q22 VanDerWaalsContact C-N 3.34Å; N20-Q22 PolarHBondContact O-N 3.06Å; Q22-V24 VanDerWaalsContact C-N 3.3Å; Q22-V24 PolarHBondContact O-N 2.92Å; Q22-L25 WeakPolarHBondContact O-CB 3.29Å; Q22-L25 PolarHBondContact O-N 3.43Å; Q22-L25 VanDerWaalsContact O-N 3.09Å; Q22-D26 PolarHBondContact NE2-OD1 3.38Å; Q22-D26 VanDerWaalsContact O-CG 3.22Å; Q22-D26 PolarHBondContact O-N 3.07Å
23	T	81.1	Confident	71.1	Confident	59 Å²	59	103.7 Å²	103.7	36%	0.362	54%	0.541	S	S	.	.	H	α-helix	trans	-60.5	-38.6	177	-53.6	0	0	0	0	112.1	D19 N20 R27	D19-T23 WeakPolarHBondContact O-CB 3.47Å; D19-T23 PolarHBondContact O-N 3.49Å; D19-T23 PolarHBondContact O-OG1 3.27Å; N20-T23 PolarHBondContact O-N 3.01Å; T23-R27 VanDerWaalsContact O-CG 3.31Å; T23-R27 WeakPolarHBondContact O-CG 3.48Å; T23-R27 PolarHBondContact O-N 2.99Å; T23-R27 VanDerWaalsContact O-N 3.12Å
24	V	77	Confident	72.7	Confident	73 Å²	73	99.9 Å²	99.9	44%	0.442	53%	0.526	S	S	.	.	H	α-helix	trans	-66.8	-41.7	175	172.7	0	0	0	0	111	N20 C21 Q22 R27 L28	N20-V24 WeakPolarHBondContact O-CG2 3.38Å; N20-V24 PolarHBondContact O-N 2.97Å; C21-V24 PolarHBondContact O-N 3.43Å; Q22-V24 VanDerWaalsContact C-N 3.3Å; Q22-V24 PolarHBondContact O-N 2.92Å; V24-R27 PolarHBondContact O-N 3.33Å; V24-L28 HydrophobicContact CG1-CD1 3.99Å; V24-L28 WeakPolarHBondContact O-CG 3.47Å; V24-L28 PolarHBondContact O-N 2.94Å
25	L	77.3	Confident	74	Confident	100 Å²	100	98.7 Å²	98.7	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-43.1	177.1	-133.3	90.2	0	0	0	111.9	C21 Q22 L28 T29	C21-L25 PolarHBondContact O-N 3.43Å; Q22-L25 WeakPolarHBondContact O-CB 3.29Å; Q22-L25 PolarHBondContact O-N 3.43Å; Q22-L25 VanDerWaalsContact O-N 3.09Å; L25-L28 WeakPolarHBondContact O-CB 3.39Å; L25-L28 PolarHBondContact O-N 2.72Å; L25-T29 PolarHBondContact O-N 3.13Å; L25-T29 PolarHBondContact O-OG1 2.71Å
26	D	85.2	Confident	75	Confident	85 Å²	85	100.8 Å²	100.8	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-43.5	180	-65.6	-15.7	0	0	0	110.7	Q22 L28 T29 E30	Q22-D26 PolarHBondContact NE2-OD1 3.38Å; Q22-D26 VanDerWaalsContact O-CG 3.22Å; Q22-D26 PolarHBondContact O-N 3.07Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.3Å; D26-T29 PolarHBondContact O-N 3.33Å; D26-E30 WeakPolarHBondContact O-CB 3.4Å; D26-E30 PolarHBondContact O-N 2.94Å
27	R	79.9	Confident	76.2	Confident	157 Å²	157	98.4 Å²	98.4	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-61.6	-38.2	173.8	-74.6	176.7	177.5	-179.5	1.5	112.8	T23 V24 R31	T23-R27 VanDerWaalsContact O-CG 3.31Å; T23-R27 WeakPolarHBondContact O-CG 3.48Å; T23-R27 PolarHBondContact O-N 2.99Å; T23-R27 VanDerWaalsContact O-N 3.12Å; V24-R27 PolarHBondContact O-N 3.33Å; R27-R31 WeakPolarHBondContact O-CG 3.23Å; R27-R31 PolarHBondContact O-N 2.87Å; R27-R31 VanDerWaalsContact O-N 3.1Å
28	L	72.5	Confident	76.9	Confident	86 Å²	86	97 Å²	97	45%	0.45	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-42.3	174.9	-81.2	160.9	0	0	0	111.1	V24 L25 D26 R31 H32	V24-L28 HydrophobicContact CG1-CD1 3.99Å; V24-L28 WeakPolarHBondContact O-CG 3.47Å; V24-L28 PolarHBondContact O-N 2.94Å; L25-L28 WeakPolarHBondContact O-CB 3.39Å; L25-L28 PolarHBondContact O-N 2.72Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.3Å; L28-R31 PolarHBondContact O-N 2.86Å; L28-H32 PolarHBondContact O-N 3.16Å
29	T	81.4	Confident	77	Confident	79 Å²	79	96.4 Å²	96.4	49%	0.485	50%	0.497	S	S	.	.	H	α-helix	trans	-66.8	-43	179.7	-49.7	0	0	0	0	111.2	L25 D26 H32 T33	L25-T29 PolarHBondContact O-N 3.13Å; L25-T29 PolarHBondContact O-OG1 2.71Å; D26-T29 PolarHBondContact O-N 3.33Å; T29-H32 WeakPolarHBondContact O-CB 3.17Å; T29-H32 PolarHBondContact O-N 2.77Å; T29-H32 VanDerWaalsContact O-N 3.14Å; T29-T33 PolarHBondContact O-N 3.49Å; T29-T33 PolarHBondContact O-OG1 3.24Å
30	E	82.7	Confident	77.1	Confident	111 Å²	111	94.6 Å²	94.6	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-42	176.1	-169.3	-177.9	-176.4	0	0	112.2	D26 H32 T33 Q34	D26-E30 WeakPolarHBondContact O-CB 3.4Å; D26-E30 PolarHBondContact O-N 2.94Å; E30-H32 VanDerWaalsContact C-N 3.3Å; E30-H32 PolarHBondContact O-N 2.97Å; E30-T33 WeakPolarHBondContact CA-OG1 3.44Å; E30-T33 PolarHBondContact O-N 3.09Å; E30-T33 PolarHBondContact O-OG1 3.11Å; E30-Q34 WeakPolarHBondContact O-CB 3.22Å; E30-Q34 WeakPolarHBondContact O-CG 3.31Å; E30-Q34 PolarHBondContact O-N 3.47Å; E30-Q34 PolarHBondContact OE1-NE2 3.46Å
31	R	74.1	Confident	77	Confident	169 Å²	169	94.9 Å²	94.9	64%	0.638	49%	0.489	S	S	*	.	H	α-helix	trans	-61.9	-40.4	172	-77.1	-173.1	-154.1	152.2	5.1	112	R27 L28 S35	R27-R31 WeakPolarHBondContact O-CG 3.23Å; R27-R31 PolarHBondContact O-N 2.87Å; R27-R31 VanDerWaalsContact O-N 3.1Å; L28-R31 PolarHBondContact O-N 2.86Å; R31-S35 VanDerWaalsContact O-CB 3.28Å; R31-S35 WeakPolarHBondContact O-CB 3.43Å; R31-S35 PolarHBondContact O-N 3.39Å
32	H	76.3	Confident	76.7	Confident	131 Å²	131	92.6 Å²	92.6	61%	0.606	47%	0.469	S	S	*	.	H	α-helix	trans	-63.4	-42.8	179	-111.7	-59.2	0	0	0	112	L28 T29 E30 S35 Q36	L28-H32 PolarHBondContact O-N 3.16Å; T29-H32 WeakPolarHBondContact O-CB 3.17Å; T29-H32 PolarHBondContact O-N 2.77Å; T29-H32 VanDerWaalsContact O-N 3.14Å; E30-H32 VanDerWaalsContact C-N 3.3Å; E30-H32 PolarHBondContact O-N 2.97Å; H32-S35 PolarHBondContact O-N 3.35Å; H32-Q36 WeakPolarHBondContact O-CG 3.37Å; H32-Q36 PolarHBondContact O-N 2.7Å
33	T	80	Confident	76.1	Confident	71 Å²	71	94.2 Å²	94.2	44%	0.436	47%	0.474	S	S	.	.	H	α-helix	trans	-69.2	-43.1	177.8	53.6	0	0	0	0	111.8	T29 E30 S35 Q36 V37	T29-T33 PolarHBondContact O-N 3.49Å; T29-T33 PolarHBondContact O-OG1 3.24Å; E30-T33 WeakPolarHBondContact CA-OG1 3.44Å; E30-T33 PolarHBondContact O-N 3.09Å; E30-T33 PolarHBondContact O-OG1 3.11Å; T33-S35 VanDerWaalsContact C-N 3.32Å; T33-S35 PolarHBondContact O-N 2.7Å; T33-Q36 PolarHBondContact O-N 3.4Å; T33-V37 WeakPolarHBondContact O-CG2 3.48Å; T33-V37 PolarHBondContact O-N 2.98Å
34	Q	78	Confident	75.5	Confident	108 Å²	108	98.1 Å²	98.1	51%	0.505	49%	0.486	S	S	.	.	H	α-helix	trans	-58.3	-44.9	173.8	-73.5	177.6	10.1	0	0	111.5	E30 Q36 V37 V38	E30-Q34 WeakPolarHBondContact O-CB 3.22Å; E30-Q34 WeakPolarHBondContact O-CG 3.31Å; E30-Q34 PolarHBondContact O-N 3.47Å; E30-Q34 PolarHBondContact OE1-NE2 3.46Å; Q34-Q36 VanDerWaalsContact C-N 3.33Å; Q34-Q36 PolarHBondContact O-N 2.95Å; Q34-V37 PolarHBondContact O-N 3.25Å; Q34-V38 WeakPolarHBondContact O-CG2 3.48Å; Q34-V38 PolarHBondContact O-N 3.47Å
35	S	73.4	Confident	75	Confident	52 Å²	52	97 Å²	97	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-63.4	-37.9	177.5	-159.6	0	0	0	0	112.1	R31 H32 T33 N39	R31-S35 VanDerWaalsContact O-CB 3.28Å; R31-S35 WeakPolarHBondContact O-CB 3.43Å; R31-S35 PolarHBondContact O-N 3.39Å; H32-S35 PolarHBondContact O-N 3.35Å; T33-S35 VanDerWaalsContact C-N 3.32Å; T33-S35 PolarHBondContact O-N 2.7Å; S35-N39 WeakPolarHBondContact O-CB 3.4Å; S35-N39 VanDerWaalsContact O-CG 3.28Å; S35-N39 PolarHBondContact O-N 3.38Å; S35-N39 PolarHBondContact O-ND2 3.31Å; S35-N39 VanDerWaalsContact O-ND2 3.14Å
36	Q	77	Confident	74	Confident	129 Å²	129	94.7 Å²	94.7	60%	0.603	47%	0.467	S	S	*	.	H	α-helix	trans	-66.6	-39.4	173.9	-76.2	-177.2	4.4	0	0	113.1	H32 T33 Q34 N39 S40	H32-Q36 WeakPolarHBondContact O-CG 3.37Å; H32-Q36 PolarHBondContact O-N 2.7Å; T33-Q36 PolarHBondContact O-N 3.4Å; Q34-Q36 VanDerWaalsContact C-N 3.33Å; Q34-Q36 PolarHBondContact O-N 2.95Å; Q36-N39 PolarHBondContact O-N 3.06Å; Q36-S40 WeakPolarHBondContact O-CB 3.39Å; Q36-S40 PolarHBondContact O-N 2.98Å
37	V	79	Confident	72.8	Confident	77 Å²	77	95 Å²	95	47%	0.467	47%	0.469	S	S	.	.	H	α-helix	trans	-63.7	-46.4	177	171.5	0	0	0	0	110.7	T33 Q34 N39 S40 Q41	T33-V37 WeakPolarHBondContact O-CG2 3.48Å; T33-V37 PolarHBondContact O-N 2.98Å; Q34-V37 PolarHBondContact O-N 3.25Å; V37-N39 PolarHBondContact O-N 3.33Å; V37-S40 PolarHBondContact O-N 2.93Å; V37-Q41 WeakPolarHBondContact O-CG 3.44Å; V37-Q41 PolarHBondContact O-N 3.43Å
38	V	71.7	Confident	71.8	Confident	84 Å²	84	91.4 Å²	91.4	51%	0.509	47%	0.468	S	S	.	.	H	α-helix	trans	-61	-45.5	176.5	174	0	0	0	0	110.6	Q34 S40 Q41 R42	Q34-V38 WeakPolarHBondContact O-CG2 3.48Å; Q34-V38 PolarHBondContact O-N 3.47Å; V38-S40 VanDerWaalsContact C-N 3.32Å; V38-S40 PolarHBondContact O-N 3.25Å; V38-Q41 PolarHBondContact O-N 3.18Å; V38-R42 VanDerWaalsContact O-CB 3.25Å; V38-R42 WeakPolarHBondContact O-CB 3.44Å; V38-R42 PolarHBondContact O-N 3.09Å
39	N	69.3	Low	70.8	Confident	67 Å²	67	92 Å²	92	36%	0.358	47%	0.469	S	S	.	.	H	α-helix	trans	-64.8	-33.7	176.7	-75.6	-31.8	0	0	0	112.8	S35 Q36 V37 R42 K43	S35-N39 WeakPolarHBondContact O-CB 3.4Å; S35-N39 VanDerWaalsContact O-CG 3.28Å; S35-N39 PolarHBondContact O-N 3.38Å; S35-N39 PolarHBondContact O-ND2 3.31Å; S35-N39 VanDerWaalsContact O-ND2 3.14Å; Q36-N39 PolarHBondContact O-N 3.06Å; V37-N39 PolarHBondContact O-N 3.33Å; N39-R42 WeakPolarHBondContact O-CB 3.38Å; N39-K43 WeakPolarHBondContact O-CB 3.37Å; N39-K43 PolarHBondContact O-N 2.93Å
40	S	74.4	Confident	69.1	Low	57 Å²	57	93.4 Å²	93.4	40%	0.399	47%	0.473	S	S	.	.	H	α-helix	trans	-71.5	-44.3	175.9	-176.1	0	0	0	0	112.1	Q36 V37 V38 R42 K43 K44	Q36-S40 WeakPolarHBondContact O-CB 3.39Å; Q36-S40 PolarHBondContact O-N 2.98Å; V37-S40 PolarHBondContact O-N 2.93Å; V38-S40 VanDerWaalsContact C-N 3.32Å; V38-S40 PolarHBondContact O-N 3.25Å; S40-R42 VanDerWaalsContact C-N 3.28Å; S40-R42 PolarHBondContact O-N 3.07Å; S40-K43 PolarHBondContact O-N 3.39Å; S40-K44 WeakPolarHBondContact O-CG 3.49Å; S40-K44 PolarHBondContact O-N 3.3Å
41	Q	72.7	Confident	67.5	Low	115 Å²	115	94 Å²	94	54%	0.537	48%	0.484	S	S	.	.	H	α-helix	trans	-59.1	-44.3	173.6	-75.5	171.9	-13.3	0	0	110.7	V37 V38 K43 K44 V45	V37-Q41 WeakPolarHBondContact O-CG 3.44Å; V37-Q41 PolarHBondContact O-N 3.43Å; V38-Q41 PolarHBondContact O-N 3.18Å; Q41-K43 VanDerWaalsContact C-N 3.35Å; Q41-K43 PolarHBondContact O-N 3.35Å; Q41-K44 WeakPolarHBondContact O-CB 3.34Å; Q41-K44 PolarHBondContact O-N 3.01Å; Q41-V45 WeakPolarHBondContact O-CG2 3.25Å; Q41-V45 PolarHBondContact O-N 3.41Å
42	R	67.6	Low	66	Low	36 Å²	36	92.2 Å²	92.2	14%	0.136	49%	0.487	C	S	.	.	H	α-helix	trans	-56.7	-48.3	173.4	-169.8	-173.5	-157.1	133.6	23.3	111.8	V38 N39 S40 K44 V45 L46 S117 M118 Y119 L120	V38-R42 VanDerWaalsContact O-CB 3.25Å; V38-R42 WeakPolarHBondContact O-CB 3.44Å; V38-R42 PolarHBondContact O-N 3.09Å; N39-R42 WeakPolarHBondContact O-CB 3.38Å; S40-R42 VanDerWaalsContact C-N 3.28Å; S40-R42 PolarHBondContact O-N 3.07Å; R42-K44 VanDerWaalsContact C-N 3.3Å; R42-K44 PolarHBondContact O-N 2.89Å; R42-V45 PolarHBondContact O-N 3.48Å; R42-L46 HydrophobicContact CG-CD1 4.09Å; R42-L46 HydrophobicContact CG-CG 4.43Å; R42-L46 WeakPolarHBondContact O-CB 3.22Å; R42-L46 WeakPolarHBondContact O-CG 3.39Å; R42-L46 PolarHBondContact O-N 3.28Å; R42-S117 PolarHBondContact NH2-O 2.92Å; R42-M118 VanDerWaalsContact CZ-O 3.27Å; R42-M118 PolarHBondContact NE-O 2.92Å; R42-M118 PolarHBondContact NH2-O 2.79Å; R42-Y119 VanDerWaalsContact NH2-N 3.17Å; R42-L120 VanDerWaalsContact CZ-C 3.44Å; R42-L120 PolarHBondContact NH1-O 3.48Å; R42-L120 PolarHBondContact NH2-O 2.91Å
43	K	67.1	Low	64.4	Low	132 Å²	132	90.7 Å²	90.7	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-61.3	-37.8	177.4	-166.3	166.2	-177.1	170.6	0	112.4	N39 S40 Q41 L46 D47	N39-K43 WeakPolarHBondContact O-CB 3.37Å; N39-K43 PolarHBondContact O-N 2.93Å; S40-K43 PolarHBondContact O-N 3.39Å; Q41-K43 VanDerWaalsContact C-N 3.35Å; Q41-K43 PolarHBondContact O-N 3.35Å; K43-L46 WeakPolarHBondContact O-CB 3.27Å; K43-L46 PolarHBondContact O-N 2.92Å; K43-D47 WeakPolarHBondContact O-CB 3.37Å; K43-D47 PolarHBondContact O-N 2.94Å
44	K	69.6	Low	62.6	Low	141 Å²	141	93.6 Å²	93.6	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-65	-41.4	174.7	-70	175	-176.1	-178.8	0	112.6	S40 Q41 R42 D47 S48	S40-K44 WeakPolarHBondContact O-CG 3.49Å; S40-K44 PolarHBondContact O-N 3.3Å; Q41-K44 WeakPolarHBondContact O-CB 3.34Å; Q41-K44 PolarHBondContact O-N 3.01Å; R42-K44 VanDerWaalsContact C-N 3.3Å; R42-K44 PolarHBondContact O-N 2.89Å; K44-D47 PolarHBondContact O-N 2.97Å; K44-S48 WeakPolarHBondContact O-CB 3.28Å; K44-S48 PolarHBondContact O-N 2.73Å; K44-S48 PolarHBondContact O-OG 2.67Å
45	V	65	Low	61.3	Low	49 Å²	49	89.9 Å²	89.9	30%	0.297	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-44.2	174.4	176.1	0	0	0	0	110.4	Q41 R42 D47 S48 E49 M118	Q41-V45 WeakPolarHBondContact O-CG2 3.25Å; Q41-V45 PolarHBondContact O-N 3.41Å; R42-V45 PolarHBondContact O-N 3.48Å; V45-D47 VanDerWaalsContact C-N 3.29Å; V45-D47 PolarHBondContact O-N 3.35Å; V45-S48 VanDerWaalsContact CA-OG 3.28Å; V45-S48 WeakPolarHBondContact CA-OG 3.43Å; V45-S48 PolarHBondContact O-N 2.97Å; V45-S48 PolarHBondContact O-OG 3.34Å; V45-E49 PolarHBondContact O-N 3.49Å; V45-E49 VanDerWaalsContact O-N 3.09Å; V45-M118 HydrophobicContact CG1-CE 4.07Å; V45-M118 HydrophobicContact CG1-SD 4.49Å
46	L	57.3	Low	60.3	Low	52 Å²	52	89.2 Å²	89.2	27%	0.272	50%	0.496	S	S	.	.	H	α-helix	trans	-58.7	-38.8	174.5	-68.9	169.9	0	0	0	112.2	R42 K43 N50 N56	R42-L46 HydrophobicContact CG-CD1 4.09Å; R42-L46 HydrophobicContact CG-CG 4.43Å; R42-L46 WeakPolarHBondContact O-CB 3.22Å; R42-L46 WeakPolarHBondContact O-CG 3.39Å; R42-L46 PolarHBondContact O-N 3.28Å; K43-L46 WeakPolarHBondContact O-CB 3.27Å; K43-L46 PolarHBondContact O-N 2.92Å; L46-N50 WeakPolarHBondContact O-CB 3.41Å; L46-N50 PolarHBondContact O-N 2.68Å; L46-N50 PolarHBondContact O-ND2 3.04Å; L46-N56 WeakPolarHBondContact CD2-ND2 3.32Å
47	D	60.6	Low	59.3	Low	93 Å²	93	85.3 Å²	85.3	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-78	-34.5	178.7	-68.5	-20.7	0	0	0	111.8	K43 K44 V45 N50	K43-D47 WeakPolarHBondContact O-CB 3.37Å; K43-D47 PolarHBondContact O-N 2.94Å; K44-D47 PolarHBondContact O-N 2.97Å; V45-D47 VanDerWaalsContact C-N 3.29Å; V45-D47 PolarHBondContact O-N 3.35Å; D47-N50 PolarHBondContact O-N 2.95Å
48	S	58.4	Low	59	Low	81 Å²	81	86.5 Å²	86.5	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-71.5	-30	178.8	53.2	0	0	0	0	113.7	K44 V45	K44-S48 WeakPolarHBondContact O-CB 3.28Å; K44-S48 PolarHBondContact O-N 2.73Å; K44-S48 PolarHBondContact O-OG 2.67Å; V45-S48 VanDerWaalsContact CA-OG 3.28Å; V45-S48 WeakPolarHBondContact CA-OG 3.43Å; V45-S48 PolarHBondContact O-N 2.97Å; V45-S48 PolarHBondContact O-OG 3.34Å
49	E	51	Low	59.2	Low	99 Å²	99	86.4 Å²	86.4	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-87.5	-12.4	175.9	-66.6	-176.5	161.5	0	0	112.7	V45 V51 D52	V45-E49 PolarHBondContact O-N 3.49Å; V45-E49 VanDerWaalsContact O-N 3.09Å; E49-V51 PolarHBondContact O-N 2.98Å; E49-V51 VanDerWaalsContact O-N 3.09Å; E49-D52 PolarHBondContact O-N 3.31Å
50	N	46.2	Very low	59.7	Low	107 Å²	107	87.6 Å²	87.6	57%	0.572	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	2	-178.8	-112.5	-33.1	0	0	0	114.7	L46 D47 D52	L46-N50 WeakPolarHBondContact O-CB 3.41Å; L46-N50 PolarHBondContact O-N 2.68Å; L46-N50 PolarHBondContact O-ND2 3.04Å; D47-N50 PolarHBondContact O-N 2.95Å; N50-D52 PolarHBondContact O-N 3.49Å
51	V	49.3	Very low	59.8	Low	123 Å²	123	90.3 Å²	90.3	75%	0.745	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-23	171.4	-178.7	0	0	0	0	111	E49	E49-V51 PolarHBondContact O-N 2.98Å; E49-V51 VanDerWaalsContact O-N 3.09Å
52	D	42.1	Very low	60.4	Low	132 Å²	132	89 Å²	89	71%	0.706	49%	0.492	S	S	*	.	S	Bend	trans	-127.7	117.7	175.1	-76.7	-42.9	0	0	0	112	E49 N50	E49-D52 PolarHBondContact O-N 3.31Å; N50-D52 PolarHBondContact O-N 3.49Å
53	S	43.4	Very low	61.3	Low	99 Å²	99	87.4 Å²	87.4	69%	0.692	49%	0.486	S	S	*	.			trans	77	136.3	155.1	-61.3	0	0	0	0	119.4	G55	S53-G55 PolarHBondContact O-N 3.03Å
54	C	41.8	Very low	62.1	Low	133 Å²	133	81.3 Å²	81.3	90%	0.899	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.3	23.4	154.1	-160	0	0	0	0	116.3
55	G	50	Low	62.8	Low	29 Å²	29	78.8 Å²	78.8	30%	0.299	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-29.3	-171.1	0	0	0	0	0	115.1	S53 N58 I59	S53-G55 PolarHBondContact O-N 3.03Å; G55-N58 CarbonylContact O-C 3.5Å; G55-N58 WeakPolarHBondContact O-CA 3.41Å; G55-N58 WeakPolarHBondContact O-CB 3.35Å; G55-N58 PolarHBondContact O-N 3.37Å; G55-N58 VanDerWaalsContact O-N 3.12Å; G55-I59 WeakPolarHBondContact O-CG1 3.45Å; G55-I59 PolarHBondContact O-N 3.5Å
56	N	51.9	Low	63.9	Low	39 Å²	39	80.1 Å²	80.1	21%	0.209	45%	0.453	C	S	.	.	H	α-helix	trans	-79.8	-35.6	-167.5	-153.4	4.9	0	0	0	114.3	L46 N58 I59 R60	L46-N56 WeakPolarHBondContact CD2-ND2 3.32Å; N56-N58 PolarHBondContact O-N 3.39Å; N56-I59 PolarHBondContact O-N 3.16Å; N56-R60 PolarHBondContact O-N 2.91Å; N56-R60 VanDerWaalsContact O-N 3.08Å
57	G	56.6	Low	65.5	Low	46 Å²	46	77.8 Å²	77.8	47%	0.474	44%	0.44	S	S	.	.	H	α-helix	trans	-54.2	-38	165.7	0	0	0	0	0	110.8	E61	G57-E61 VanDerWaalsContact O-CB 3.27Å; G57-E61 WeakPolarHBondContact O-CB 3.19Å; G57-E61 WeakPolarHBondContact O-CG 3.36Å; G57-E61 PolarHBondContact O-N 2.92Å
58	N	72.9	Confident	66.7	Low	103 Å²	103	74.2 Å²	74.2	55%	0.551	42%	0.422	S	S	*	.	H	α-helix	trans	-68.9	-42.9	177.4	-149.6	-6.5	0	0	0	112.4	G55 N56 E61 N62	G55-N58 CarbonylContact O-C 3.5Å; G55-N58 WeakPolarHBondContact O-CA 3.41Å; G55-N58 WeakPolarHBondContact O-CB 3.35Å; G55-N58 PolarHBondContact O-N 3.37Å; G55-N58 VanDerWaalsContact O-N 3.12Å; N56-N58 PolarHBondContact O-N 3.39Å; N58-E61 PolarHBondContact O-N 2.97Å; N58-N62 WeakPolarHBondContact O-CA 3.42Å; N58-N62 WeakPolarHBondContact O-CB 3.4Å; N58-N62 PolarHBondContact O-N 3.49Å
59	I	77	Confident	68.2	Low	82 Å²	82	75.4 Å²	75.4	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-63	-48.7	178.2	-63.9	164.4	0	0	0	111.1	G55 N56 N62 F63	G55-I59 WeakPolarHBondContact O-CG1 3.45Å; G55-I59 PolarHBondContact O-N 3.5Å; N56-I59 PolarHBondContact O-N 3.16Å; I59-N62 PolarHBondContact O-N 3.01Å; I59-F63 WeakPolarHBondContact O-CB 3.45Å; I59-F63 PolarHBondContact O-N 3.42Å
60	R	78.2	Confident	70	Confident	91 Å²	91	73 Å²	73	34%	0.343	41%	0.406	S	S	.	.	H	α-helix	trans	-59.6	-52.2	177.8	172.3	173.4	176.1	-141.3	-1.6	110.3	N56 N62 L64 L120 D124	N56-R60 PolarHBondContact O-N 2.91Å; N56-R60 VanDerWaalsContact O-N 3.08Å; R60-N62 PolarHBondContact O-N 3.22Å; R60-L64 HydrophobicContact CG-CD1 3.65Å; R60-L64 WeakPolarHBondContact O-CB 3.47Å; R60-L64 VanDerWaalsContact O-CD1 3.3Å; R60-L64 WeakPolarHBondContact O-CD1 3.41Å; R60-L64 WeakPolarHBondContact O-CG 3.44Å; R60-L64 PolarHBondContact O-N 3.34Å; R60-L64 VanDerWaalsContact O-N 3.07Å; R60-L120 HydrophobicContact CG-CD2 4.11Å; R60-D124 IonicContact CZ-OD2 3.55Å; R60-D124 IonicContact NE-OD2 3.53Å; R60-D124 PolarHBondContact NE-OD2 3.15Å; R60-D124 IonicContact NH2-OD1 3.47Å; R60-D124 IonicContact NH2-OD2 2.73Å; R60-D124 PolarHBondContact NH2-OD2 2.58Å
61	E	77.5	Confident	72.2	Confident	115 Å²	115	70.8 Å²	70.8	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-41.1	-179.1	-71.8	170.8	-170.7	0	0	112.3	G57 N58 L64 Q65	G57-E61 VanDerWaalsContact O-CB 3.27Å; G57-E61 WeakPolarHBondContact O-CB 3.19Å; G57-E61 WeakPolarHBondContact O-CG 3.36Å; G57-E61 PolarHBondContact O-N 2.92Å; N58-E61 PolarHBondContact O-N 2.97Å; E61-L64 PolarHBondContact O-N 2.89Å; E61-Q65 VanDerWaalsContact O-CB 3.3Å; E61-Q65 WeakPolarHBondContact O-CB 3.48Å; E61-Q65 PolarHBondContact O-N 3.24Å
62	N	84.3	Confident	74.1	Confident	87 Å²	87	70.7 Å²	70.7	47%	0.465	39%	0.386	S	S	.	.	H	α-helix	trans	-63.5	-48.9	178.3	-175.8	-83.6	0	0	0	112	N58 I59 R60 L64 Q65 H66	N58-N62 WeakPolarHBondContact O-CA 3.42Å; N58-N62 WeakPolarHBondContact O-CB 3.4Å; N58-N62 PolarHBondContact O-N 3.49Å; I59-N62 PolarHBondContact O-N 3.01Å; R60-N62 PolarHBondContact O-N 3.22Å; N62-L64 VanDerWaalsContact C-N 3.34Å; N62-L64 PolarHBondContact O-N 3.47Å; N62-Q65 PolarHBondContact O-N 2.89Å; N62-H66 WeakPolarHBondContact O-CB 3.39Å; N62-H66 PolarHBondContact O-N 3.11Å
63	F	87.2	Confident	76.5	Confident	3 Å²	3	66.5 Å²	66.5	1%	0.013	37%	0.369	C	S	.	.	H	α-helix	trans	-57.8	-49.8	176	170.6	-91.3	0	0	0	110.4	I59 Q65 H66 F67 W112 L113 T116 L120	I59-F63 WeakPolarHBondContact O-CB 3.45Å; I59-F63 PolarHBondContact O-N 3.42Å; F63-Q65 VanDerWaalsContact C-N 3.3Å; F63-Q65 PolarHBondContact O-N 2.9Å; F63-H66 PolarHBondContact O-N 2.91Å; F63-F67 HydrophobicContact CD1-CB 4.46Å; F63-F67 HydrophobicContact CE1-CB 4.04Å; F63-F67 HydrophobicContact CE1-CD2 4.09Å; F63-F67 HydrophobicContact CE1-CG 4.19Å; F63-F67 HydrophobicContact CE2-CD2 4.31Å; F63-F67 HydrophobicContact CZ-CB 4.11Å; F63-F67 AromaticContact CZ-CD2 3.59Å; F63-F67 HydrophobicContact CZ-CD2 3.59Å; F63-F67 HydrophobicContact CZ-CE2 4.36Å; F63-F67 HydrophobicContact CZ-CG 4.12Å; F63-F67 WeakPolarHBondContact O-CB 3.45Å; F63-F67 PolarHBondContact O-N 3.45Å; F63-W112 HydrophobicContact CB-CZ2 4.33Å; F63-W112 AromaticContact CD2-CD2 3.67Å; F63-W112 HydrophobicContact CD2-CD2 3.67Å; F63-W112 AromaticContact CD2-CE2 3.43Å; F63-W112 VanDerWaalsContact CD2-CE2 3.43Å; F63-W112 AromaticContact CD2-CE3 3.98Å; F63-W112 HydrophobicContact CD2-CE3 3.98Å; F63-W112 HydrophobicContact CD2-CG 4.23Å; F63-W112 AromaticContact CD2-CH2 3.64Å; F63-W112 HydrophobicContact CD2-CH2 3.64Å; F63-W112 AromaticContact CD2-CZ2 3.47Å; F63-W112 HydrophobicContact CD2-CZ2 3.47Å; F63-W112 VanDerWaalsContact CD2-CZ2 3.47Å; F63-W112 AromaticContact CD2-CZ3 3.94Å; F63-W112 HydrophobicContact CD2-CZ3 3.94Å; F63-W112 AromaticContact CD2-NE1 3.87Å; F63-W112 HydrophobicContact CE2-CB 4.48Å; F63-W112 AromaticContact CE2-CD2 3.56Å; F63-W112 HydrophobicContact CE2-CD2 3.56Å; F63-W112 AromaticContact CE2-CE2 3.85Å; F63-W112 AromaticContact CE2-CE3 3.7Å; F63-W112 HydrophobicContact CE2-CE3 3.7Å; F63-W112 AromaticContact CE2-CG 3.9Å; F63-W112 HydrophobicContact CE2-CG 3.9Å; F63-W112 HydrophobicContact CE2-CH2 4.18Å; F63-W112 HydrophobicContact CE2-CZ2 4.21Å; F63-W112 AromaticContact CE2-CZ3 3.99Å; F63-W112 HydrophobicContact CE2-CZ3 3.99Å; F63-W112 HydrophobicContact CG-CH2 4.35Å; F63-W112 HydrophobicContact CG-CZ2 4.31Å; F63-L113 HydrophobicContact CE1-CD1 4.06Å; F63-L113 HydrophobicContact CZ-CB 4.15Å; F63-L113 HydrophobicContact CZ-CD1 3.78Å; F63-T116 HydrophobicContact CB-CG2 4.32Å; F63-T116 HydrophobicContact CD2-CG2 3.44Å; F63-T116 VanDerWaalsContact CD2-CG2 3.44Å; F63-T116 VanDerWaalsContact CD2-OG1 3.23Å; F63-T116 WeakPolarHBondContact CD2-OG1 2.95Å; F63-T116 HydrophobicContact CE2-CG2 4Å; F63-T116 WeakPolarHBondContact CE2-OG1 3.46Å; F63-T116 HydrophobicContact CG-CG2 3.98Å; F63-T116 WeakPolarHBondContact CZ-OG1 3.4Å; F63-L120 HydrophobicContact CD1-CD1 3.58Å; F63-L120 HydrophobicContact CD1-CD2 3.66Å; F63-L120 HydrophobicContact CD1-CG 4.13Å; F63-L120 HydrophobicContact CE1-CD1 3.33Å; F63-L120 HydrophobicContact CE1-CD2 4.28Å; F63-L120 HydrophobicContact CE1-CG 4.35Å; F63-L120 HydrophobicContact CG-CD2 4.4Å; F63-L120 HydrophobicContact CZ-CD1 4.09Å
64	L	84.9	Confident	78.8	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-65.8	-35.5	-175.3	-65.5	168.1	0	0	0	112	R60 E61 N62 T68 L120 D124 R347	R60-L64 HydrophobicContact CG-CD1 3.65Å; R60-L64 WeakPolarHBondContact O-CB 3.47Å; R60-L64 VanDerWaalsContact O-CD1 3.3Å; R60-L64 WeakPolarHBondContact O-CD1 3.41Å; R60-L64 WeakPolarHBondContact O-CG 3.44Å; R60-L64 PolarHBondContact O-N 3.34Å; R60-L64 VanDerWaalsContact O-N 3.07Å; E61-L64 PolarHBondContact O-N 2.89Å; N62-L64 VanDerWaalsContact C-N 3.34Å; N62-L64 PolarHBondContact O-N 3.47Å; L64-T68 PolarHBondContact O-N 3.36Å; L64-T68 PolarHBondContact O-OG1 3.45Å; L64-T68 VanDerWaalsContact O-OG1 3.07Å; L64-L120 HydrophobicContact CD1-CD2 4.33Å; L64-L120 HydrophobicContact CD2-CD1 4.5Å; L64-L120 HydrophobicContact CD2-CD2 3.77Å; L64-L120 HydrophobicContact CG-CD2 3.94Å; L64-D124 HydrophobicContact CD2-CB 4.49Å; L64-R347 VanDerWaalsContact CD1-CD 3.46Å
65	Q	84.3	Confident	81.2	Confident	88 Å²	88	57.2 Å²	57.2	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-65.8	-50.2	174.6	-173.9	174.7	18.4	0	0	111.5	E61 N62 F63 T68 Q69 L348	E61-Q65 VanDerWaalsContact O-CB 3.3Å; E61-Q65 WeakPolarHBondContact O-CB 3.48Å; E61-Q65 PolarHBondContact O-N 3.24Å; N62-Q65 PolarHBondContact O-N 2.89Å; F63-Q65 VanDerWaalsContact C-N 3.3Å; F63-Q65 PolarHBondContact O-N 2.9Å; Q65-T68 PolarHBondContact O-N 3.3Å; Q65-Q69 WeakPolarHBondContact O-CG 3.39Å; Q65-Q69 PolarHBondContact O-N 2.92Å; Q65-L348 HydrophobicContact CB-CD1 3.79Å; Q65-L348 HydrophobicContact CB-CD2 4.42Å; Q65-L348 HydrophobicContact CG-CD1 4.1Å
66	H	87.4	Confident	83.1	Confident	78 Å²	78	59.2 Å²	59.2	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-74.5	-31.1	-176.4	176.9	-94.9	0	0	0	111.9	N62 F63 T68 Q69 Y70 W112	N62-H66 WeakPolarHBondContact O-CB 3.39Å; N62-H66 PolarHBondContact O-N 3.11Å; F63-H66 PolarHBondContact O-N 2.91Å; H66-T68 VanDerWaalsContact C-N 3.34Å; H66-T68 PolarHBondContact O-N 3.3Å; H66-Q69 PolarHBondContact O-N 2.91Å; H66-Y70 WeakPolarHBondContact O-CB 3.08Å; H66-Y70 PolarHBondContact O-N 2.91Å; H66-W112 HydrophobicContact CB-CH2 3.65Å; H66-W112 HydrophobicContact CB-CZ3 4.21Å; H66-W112 AromaticContact CE1-CZ3 3.89Å; H66-W112 AromaticContact CG-CH2 3.6Å; H66-W112 AromaticContact CG-CZ3 3.9Å; H66-W112 AromaticContact ND1-CE3 3.97Å; H66-W112 AromaticContact ND1-CH2 2.91Å; H66-W112 WeakPolarHBondContact ND1-CH2 3.49Å; H66-W112 AromaticContact ND1-CZ2 3.84Å; H66-W112 AromaticContact ND1-CZ3 2.96Å; H66-W112 WeakPolarHBondContact ND1-CZ3 3.32Å
67	F	90.3	Very high	85.1	Confident	2 Å²	2	60 Å²	60	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-56.1	-47.8	168.2	-176.9	-89.8	0	0	0	111.2	F63 Y70 K71 M109 W112 A128 E131 L132	F63-F67 HydrophobicContact CD1-CB 4.46Å; F63-F67 HydrophobicContact CE1-CB 4.04Å; F63-F67 HydrophobicContact CE1-CD2 4.09Å; F63-F67 HydrophobicContact CE1-CG 4.19Å; F63-F67 HydrophobicContact CE2-CD2 4.31Å; F63-F67 HydrophobicContact CZ-CB 4.11Å; F63-F67 AromaticContact CZ-CD2 3.59Å; F63-F67 HydrophobicContact CZ-CD2 3.59Å; F63-F67 HydrophobicContact CZ-CE2 4.36Å; F63-F67 HydrophobicContact CZ-CG 4.12Å; F63-F67 WeakPolarHBondContact O-CB 3.45Å; F63-F67 PolarHBondContact O-N 3.45Å; F67-Y70 PolarHBondContact O-N 3.45Å; F67-K71 WeakPolarHBondContact O-CB 3.34Å; F67-K71 PolarHBondContact O-N 2.98Å; F67-M109 HydrophobicContact CD2-CG 3.79Å; F67-M109 HydrophobicContact CD2-SD 3.94Å; F67-M109 HydrophobicContact CE2-CE 4.2Å; F67-M109 HydrophobicContact CE2-CG 3.56Å; F67-M109 HydrophobicContact CE2-SD 3.8Å; F67-M109 HydrophobicContact CZ-CE 4.22Å; F67-M109 HydrophobicContact CZ-CG 4.47Å; F67-M109 HydrophobicContact CZ-SD 4.27Å; F67-W112 HydrophobicContact CB-CZ3 4.47Å; F67-A128 HydrophobicContact CE1-CB 4.1Å; F67-A128 HydrophobicContact CE2-CB 4.32Å; F67-A128 HydrophobicContact CZ-CB 3.92Å; F67-A128 WeakPolarHBondContact CZ-O 3.47Å; F67-E131 HydrophobicContact CE1-CB 4.3Å; F67-L132 HydrophobicContact CZ-CB 4.37Å
68	T	87.1	Confident	86.7	Confident	19 Å²	19	58 Å²	58	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-69.6	-38.2	179.9	-57.8	0	0	0	0	112.9	L64 Q65 H66 Y70 K71 L72 N345	L64-T68 PolarHBondContact O-N 3.36Å; L64-T68 PolarHBondContact O-OG1 3.45Å; L64-T68 VanDerWaalsContact O-OG1 3.07Å; Q65-T68 PolarHBondContact O-N 3.3Å; H66-T68 VanDerWaalsContact C-N 3.34Å; H66-T68 PolarHBondContact O-N 3.3Å; T68-Y70 VanDerWaalsContact C-N 3.34Å; T68-K71 PolarHBondContact O-N 3.1Å; T68-L72 WeakPolarHBondContact O-CB 3.31Å; T68-L72 PolarHBondContact O-N 2.98Å; T68-N345 VanDerWaalsContact CB-OD1 3.23Å; T68-N345 WeakPolarHBondContact CB-OD1 3.46Å; T68-N345 WeakPolarHBondContact CG2-ND2 3.42Å; T68-N345 WeakPolarHBondContact CG2-OD1 3.44Å; T68-N345 PolarHBondContact OG1-OD1 3.04Å
69	Q	88.1	Confident	87.5	Confident	105 Å²	105	57.8 Å²	57.8	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-43.7	173.7	-72.1	174.6	9.9	0	0	111.5	Q65 H66 L72 A73	Q65-Q69 WeakPolarHBondContact O-CG 3.39Å; Q65-Q69 PolarHBondContact O-N 2.92Å; H66-Q69 PolarHBondContact O-N 2.91Å; Q69-L72 PolarHBondContact O-N 3.49Å; Q69-A73 WeakPolarHBondContact O-CB 3.47Å; Q69-A73 PolarHBondContact O-N 3.44Å
70	Y	90.5	Very high	88	Confident	49 Å²	49	57.2 Å²	57.2	19%	0.192	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-43.3	179.9	-157	-96.1	0	0	0	111.7	H66 F67 T68 A73 I74 R105 H108 M109	H66-Y70 WeakPolarHBondContact O-CB 3.08Å; H66-Y70 PolarHBondContact O-N 2.91Å; F67-Y70 PolarHBondContact O-N 3.45Å; T68-Y70 VanDerWaalsContact C-N 3.34Å; Y70-A73 PolarHBondContact O-N 3.49Å; Y70-I74 HydrophobicContact CD1-CD1 3.75Å; Y70-I74 HydrophobicContact CD1-CG1 4.44Å; Y70-I74 HydrophobicContact CE1-CD1 3.8Å; Y70-I74 WeakPolarHBondContact O-CG1 3.41Å; Y70-I74 PolarHBondContact O-N 2.91Å; Y70-R105 HydrophobicContact CE1-CB 3.8Å; Y70-R105 HydrophobicContact CE1-CG 4.32Å; Y70-R105 WeakPolarHBondContact CE1-O 3.19Å; Y70-R105 WeakPolarHBondContact OH-CA 3.45Å; Y70-R105 WeakPolarHBondContact OH-CB 3.4Å; Y70-R105 WeakPolarHBondContact OH-CG 3.41Å; Y70-H108 AromaticContact CZ-ND1 3.96Å; Y70-M109 HydrophobicContact CD1-CB 4.17Å; Y70-M109 HydrophobicContact CD1-CG 4.3Å; Y70-M109 HydrophobicContact CD1-SD 3.6Å; Y70-M109 HydrophobicContact CE1-CB 4.15Å; Y70-M109 HydrophobicContact CE1-SD 4.46Å; Y70-M109 HydrophobicContact CG-SD 4.37Å
71	K	90.7	Very high	88.4	Confident	61 Å²	61	53.9 Å²	53.9	27%	0.265	28%	0.275	S	S	.	.	H	α-helix	trans	-57.3	-50.4	171.5	167.4	177.1	154.7	179.8	0	111.7	F67 T68 A73 I74 V75 E131 L135	F67-K71 WeakPolarHBondContact O-CB 3.34Å; F67-K71 PolarHBondContact O-N 2.98Å; T68-K71 PolarHBondContact O-N 3.1Å; K71-A73 VanDerWaalsContact C-N 3.28Å; K71-A73 PolarHBondContact O-N 3.35Å; K71-I74 PolarHBondContact O-N 3.45Å; K71-V75 WeakPolarHBondContact O-CG2 3.38Å; K71-V75 PolarHBondContact O-N 3.36Å; K71-E131 HydrophobicContact CD-CB 4.47Å; K71-E131 IonicContact NZ-OE2 2.7Å; K71-E131 PolarHBondContact NZ-OE2 2.74Å; K71-L135 HydrophobicContact CB-CD2 4.45Å; K71-L135 HydrophobicContact CG-CD2 4.31Å
72	L	89.4	Confident	88.7	Confident	120 Å²	120	49.3 Å²	49.3	63%	0.628	26%	0.256	S	S	*	.	H	α-helix	trans	-61.7	-37.9	-179.4	-171.4	124.5	0	0	0	111.7	T68 Q69 V75 T76	T68-L72 WeakPolarHBondContact O-CB 3.31Å; T68-L72 PolarHBondContact O-N 2.98Å; Q69-L72 PolarHBondContact O-N 3.49Å; L72-V75 PolarHBondContact O-N 3.27Å; L72-T76 WeakPolarHBondContact O-CB 3.37Å; L72-T76 PolarHBondContact O-N 2.94Å; L72-T76 PolarHBondContact O-OG1 3.01Å
73	A	92.4	Very high	88.8	Confident	44 Å²	44	51 Å²	51	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-63.8	-43.3	175.1	0	0	0	0	0	112.2	Q69 Y70 K71 T76 N77	Q69-A73 WeakPolarHBondContact O-CB 3.47Å; Q69-A73 PolarHBondContact O-N 3.44Å; Y70-A73 PolarHBondContact O-N 3.49Å; K71-A73 VanDerWaalsContact C-N 3.28Å; K71-A73 PolarHBondContact O-N 3.35Å; A73-T76 PolarHBondContact O-N 3.46Å; A73-N77 VanDerWaalsContact O-CB 3.32Å; A73-N77 WeakPolarHBondContact O-CB 3.42Å; A73-N77 PolarHBondContact O-N 3.47Å; A73-N77 PolarHBondContact O-ND2 3.5Å; A73-N77 PolarHBondContact O-OD1 2.93Å
74	I	92.5	Very high	88.7	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-48.6	176.2	-68.6	169.3	0	0	0	110.7	Y70 K71 T76 N77 L78 I102 R105 L106 M109 L135	Y70-I74 HydrophobicContact CD1-CD1 3.75Å; Y70-I74 HydrophobicContact CD1-CG1 4.44Å; Y70-I74 HydrophobicContact CE1-CD1 3.8Å; Y70-I74 WeakPolarHBondContact O-CG1 3.41Å; Y70-I74 PolarHBondContact O-N 2.91Å; K71-I74 PolarHBondContact O-N 3.45Å; I74-T76 PolarHBondContact O-N 3.41Å; I74-N77 PolarHBondContact O-N 3Å; I74-L78 HydrophobicContact CG2-CD1 4.08Å; I74-L78 HydrophobicContact CG2-CG 4.39Å; I74-L78 WeakPolarHBondContact O-CG 3.43Å; I74-L78 PolarHBondContact O-N 2.9Å; I74-I102 HydrophobicContact CG2-CD1 4.03Å; I74-I102 HydrophobicContact CG2-CG2 4.06Å; I74-R105 HydrophobicContact CD1-CB 4.11Å; I74-R105 HydrophobicContact CG1-CB 4.47Å; I74-L106 HydrophobicContact CD1-CD2 4.11Å; I74-M109 HydrophobicContact CD1-CE 4.5Å; I74-L135 HydrophobicContact CB-CD1 4.47Å; I74-L135 HydrophobicContact CB-CD2 4.23Å; I74-L135 HydrophobicContact CD1-CD2 3.94Å; I74-L135 HydrophobicContact CG2-CD1 3.95Å; I74-L135 HydrophobicContact CG2-CD2 4.08Å; I74-L135 HydrophobicContact CG2-CG 4.24Å
75	V	91.4	Very high	88.5	Confident	36 Å²	36	56.1 Å²	56.1	22%	0.218	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-48.3	178.8	174.7	0	0	0	0	110.8	K71 L72 N77 L78 E79 L135 L138	K71-V75 WeakPolarHBondContact O-CG2 3.38Å; K71-V75 PolarHBondContact O-N 3.36Å; L72-V75 PolarHBondContact O-N 3.27Å; V75-N77 VanDerWaalsContact C-N 3.34Å; V75-N77 PolarHBondContact O-N 3.47Å; V75-L78 PolarHBondContact O-N 3.41Å; V75-E79 WeakPolarHBondContact O-CG 3.45Å; V75-E79 PolarHBondContact O-N 3.36Å; V75-L135 HydrophobicContact CG2-CD1 3.49Å; V75-L135 VanDerWaalsContact CG2-CD1 3.49Å; V75-L138 HydrophobicContact CG1-CD2 4.47Å; V75-L138 HydrophobicContact CG2-CD2 4.15Å
76	T	91.4	Very high	88.3	Confident	71 Å²	71	60.2 Å²	60.2	44%	0.436	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-43.3	179.1	-53.5	0	0	0	0	111.7	L72 A73 I74 E79 D80	L72-T76 WeakPolarHBondContact O-CB 3.37Å; L72-T76 PolarHBondContact O-N 2.94Å; L72-T76 PolarHBondContact O-OG1 3.01Å; A73-T76 PolarHBondContact O-N 3.46Å; I74-T76 PolarHBondContact O-N 3.41Å; T76-E79 PolarHBondContact O-N 3.2Å; T76-D80 WeakPolarHBondContact O-CB 3.22Å; T76-D80 PolarHBondContact O-N 3.38Å
77	N	92.2	Very high	88	Confident	56 Å²	56	63.9 Å²	63.9	30%	0.299	32%	0.319	S	S	.	.	H	α-helix	trans	-64.6	-40.8	177.7	-73.8	-8.1	0	0	0	111.9	A73 I74 V75 D80 M81 F98 I102	A73-N77 VanDerWaalsContact O-CB 3.32Å; A73-N77 WeakPolarHBondContact O-CB 3.42Å; A73-N77 PolarHBondContact O-N 3.47Å; A73-N77 PolarHBondContact O-ND2 3.5Å; A73-N77 PolarHBondContact O-OD1 2.93Å; I74-N77 PolarHBondContact O-N 3Å; V75-N77 VanDerWaalsContact C-N 3.34Å; V75-N77 PolarHBondContact O-N 3.47Å; N77-D80 PolarHBondContact O-N 3.3Å; N77-M81 WeakPolarHBondContact O-CB 3.29Å; N77-M81 PolarHBondContact O-N 3.33Å; N77-F98 HydrophobicContact CB-CE2 4.08Å; N77-F98 HydrophobicContact CB-CZ 4.1Å; N77-F98 VanDerWaalsContact O-CZ 3.28Å; N77-F98 WeakPolarHBondContact O-CZ 3.46Å; N77-I102 HydrophobicContact CB-CD1 4.3Å
78	L	91	Very high	87	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-61.6	-44.6	176	-74.3	175.7	0	0	0	111.3	I74 V75 T82 F98 I102 L138 F139 K142	I74-L78 HydrophobicContact CG2-CD1 4.08Å; I74-L78 HydrophobicContact CG2-CG 4.39Å; I74-L78 WeakPolarHBondContact O-CG 3.43Å; I74-L78 PolarHBondContact O-N 2.9Å; V75-L78 PolarHBondContact O-N 3.41Å; L78-T82 WeakPolarHBondContact O-CB 3.44Å; L78-T82 PolarHBondContact O-N 2.92Å; L78-T82 PolarHBondContact O-OG1 3.4Å; L78-F98 HydrophobicContact CD2-CE1 3.98Å; L78-F98 HydrophobicContact CD2-CZ 4.32Å; L78-I102 HydrophobicContact CD2-CD1 3.94Å; L78-I102 HydrophobicContact CD2-CG1 4.11Å; L78-I102 HydrophobicContact CD2-CG2 4.32Å; L78-I102 HydrophobicContact CG-CD1 4.06Å; L78-L138 HydrophobicContact CD1-CD2 4.44Å; L78-L138 HydrophobicContact CD1-CG 4.36Å; L78-F139 HydrophobicContact CD1-CB 4.45Å; L78-F139 HydrophobicContact CD2-CD2 4.35Å; L78-K142 HydrophobicContact CB-CG 4.47Å; L78-K142 HydrophobicContact CD2-CB 4.17Å
79	E	89.1	Confident	86.4	Confident	98 Å²	98	73.8 Å²	73.8	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-65.8	-44.3	177.6	-71	178.7	-178.9	0	0	112.5	V75 T76 T82 K83	V75-E79 WeakPolarHBondContact O-CG 3.45Å; V75-E79 PolarHBondContact O-N 3.36Å; T76-E79 PolarHBondContact O-N 3.2Å; E79-T82 PolarHBondContact O-N 2.93Å; E79-K83 WeakPolarHBondContact O-CG 2.96Å; E79-K83 PolarHBondContact O-N 3.33Å
80	D	88.4	Confident	85.9	Confident	70 Å²	70	69.9 Å²	69.9	37%	0.374	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-43.7	177.2	-177.9	52.1	0	0	0	111.6	T76 N77 T82 K83 K84	T76-D80 WeakPolarHBondContact O-CB 3.22Å; T76-D80 PolarHBondContact O-N 3.38Å; N77-D80 PolarHBondContact O-N 3.3Å; D80-T82 PolarHBondContact O-N 3.02Å; D80-K83 PolarHBondContact O-N 2.92Å; D80-K84 WeakPolarHBondContact O-CB 2.91Å; D80-K84 WeakPolarHBondContact O-CG 3.28Å; D80-K84 PolarHBondContact O-N 2.96Å; D80-K84 IonicContact OD1-NZ 2.97Å; D80-K84 VanDerWaalsContact OD2-CE 3.27Å; D80-K84 WeakPolarHBondContact OD2-CE 3.28Å; D80-K84 IonicContact OD2-NZ 2.7Å; D80-K84 PolarHBondContact OD2-NZ 2.86Å
81	M	85.4	Confident	85.6	Confident	21 Å²	21	71 Å²	71	10%	0.103	37%	0.372	C	S	.	.	H	α-helix	trans	-65.4	-39.6	176.2	-175.2	57.4	69.2	0	0	112.1	N77 K83 K84 V85 L90 F98 L146	N77-M81 WeakPolarHBondContact O-CB 3.29Å; N77-M81 PolarHBondContact O-N 3.33Å; M81-K83 VanDerWaalsContact C-N 3.34Å; M81-K83 PolarHBondContact O-N 3.44Å; M81-K84 PolarHBondContact O-N 3.49Å; M81-V85 WeakPolarHBondContact O-CG2 3.31Å; M81-V85 PolarHBondContact O-N 3.35Å; M81-V85 HydrophobicContact SD-CG2 4.22Å; M81-L90 HydrophobicContact CE-CD2 4.29Å; M81-L90 HydrophobicContact SD-CD2 3.74Å; M81-F98 HydrophobicContact CB-CD1 3.97Å; M81-F98 HydrophobicContact CB-CE1 3.48Å; M81-F98 VanDerWaalsContact CB-CE1 3.48Å; M81-F98 HydrophobicContact CB-CE2 4.1Å; M81-F98 HydrophobicContact CB-CG 4.45Å; M81-F98 HydrophobicContact CB-CZ 3.57Å; M81-F98 HydrophobicContact CE-CB 3.83Å; M81-F98 HydrophobicContact CE-CD1 4.12Å; M81-F98 HydrophobicContact CE-CD2 3.55Å; M81-F98 HydrophobicContact CE-CE2 4.12Å; M81-F98 HydrophobicContact CE-CG 3.54Å; M81-F98 HydrophobicContact CG-CD1 3.56Å; M81-F98 HydrophobicContact CG-CD2 4.48Å; M81-F98 HydrophobicContact CG-CE1 3.6Å; M81-F98 HydrophobicContact CG-CG 4.02Å; M81-F98 HydrophobicContact CG-CZ 4.12Å; M81-F98 HydrophobicContact SD-CG 4.5Å; M81-L146 HydrophobicContact CG-CD1 4.06Å; M81-L146 HydrophobicContact CG-CD2 3.85Å
82	T	85.5	Confident	85.3	Confident	20 Å²	20	73.9 Å²	73.9	12%	0.123	39%	0.389	C	S	.	.	H	α-helix	trans	-62.1	-43	176.8	-54.1	0	0	0	0	111	L78 E79 D80 H86 E145	L78-T82 WeakPolarHBondContact O-CB 3.44Å; L78-T82 PolarHBondContact O-N 2.92Å; L78-T82 PolarHBondContact O-OG1 3.4Å; E79-T82 PolarHBondContact O-N 2.93Å; D80-T82 PolarHBondContact O-N 3.02Å; T82-H86 PolarHBondContact O-N 3.43Å; T82-E145 VanDerWaalsContact CG2-OE1 3.22Å; T82-E145 WeakPolarHBondContact CG2-OE1 3.4Å
83	K	86.4	Confident	85.3	Confident	121 Å²	121	74.1 Å²	74.1	53%	0.526	39%	0.391	S	S	.	.	H	α-helix	trans	-62.7	-46.6	174.3	-70.8	169.7	-176	170.7	0	111.6	E79 D80 M81 V85 H86 E87	E79-K83 WeakPolarHBondContact O-CG 2.96Å; E79-K83 PolarHBondContact O-N 3.33Å; D80-K83 PolarHBondContact O-N 2.92Å; M81-K83 VanDerWaalsContact C-N 3.34Å; M81-K83 PolarHBondContact O-N 3.44Å; K83-V85 VanDerWaalsContact C-N 3.35Å; K83-V85 PolarHBondContact O-N 2.93Å; K83-H86 WeakPolarHBondContact O-CB 3.37Å; K83-H86 PolarHBondContact O-N 2.94Å; K83-E87 PolarHBondContact O-N 3.41Å
84	K	84.1	Confident	85	Confident	87 Å²	87	76.6 Å²	76.6	38%	0.378	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-41.5	178.6	-80.2	173.3	178.1	163.8	0	112.8	D80 M81 H86 E87 C88 L90	D80-K84 WeakPolarHBondContact O-CB 2.91Å; D80-K84 WeakPolarHBondContact O-CG 3.28Å; D80-K84 PolarHBondContact O-N 2.96Å; D80-K84 IonicContact OD1-NZ 2.97Å; D80-K84 VanDerWaalsContact OD2-CE 3.27Å; D80-K84 WeakPolarHBondContact OD2-CE 3.28Å; D80-K84 IonicContact OD2-NZ 2.7Å; D80-K84 PolarHBondContact OD2-NZ 2.86Å; M81-K84 PolarHBondContact O-N 3.49Å; K84-H86 VanDerWaalsContact C-N 3.26Å; K84-H86 PolarHBondContact O-N 3.23Å; K84-E87 PolarHBondContact O-N 2.97Å; K84-C88 CarbonylContact O-C 3.48Å; K84-C88 WeakPolarHBondContact O-CA 3.05Å; K84-C88 WeakPolarHBondContact O-CB 3.23Å; K84-C88 PolarHBondContact O-N 3.37Å; K84-L90 HydrophobicContact CB-CD1 3.88Å; K84-L90 WeakPolarHBondContact O-CD1 3.39Å
85	V	81.7	Confident	84.7	Confident	28 Å²	28	78.3 Å²	78.3	17%	0.17	40%	0.402	C	S	.	.	H	α-helix	trans	-66.9	-28.2	176.9	169.3	0	0	0	0	112.3	M81 K83 L90 R95 L146	M81-V85 WeakPolarHBondContact O-CG2 3.31Å; M81-V85 PolarHBondContact O-N 3.35Å; M81-V85 HydrophobicContact SD-CG2 4.22Å; K83-V85 VanDerWaalsContact C-N 3.35Å; K83-V85 PolarHBondContact O-N 2.93Å; V85-L90 HydrophobicContact CG2-CB 4.46Å; V85-R95 HydrophobicContact CG2-CG 4.12Å; V85-L146 HydrophobicContact CB-CD2 4.13Å; V85-L146 HydrophobicContact CG2-CD2 3.64Å
86	H	79.5	Confident	84.6	Confident	173 Å²	173	78.8 Å²	78.8	80%	0.801	41%	0.405	S	S	*	.	H	α-helix	trans	-76.9	-36.2	175.2	-169.1	69.9	0	0	0	112.9	T82 K83 K84	T82-H86 PolarHBondContact O-N 3.43Å; K83-H86 WeakPolarHBondContact O-CB 3.37Å; K83-H86 PolarHBondContact O-N 2.94Å; K84-H86 VanDerWaalsContact C-N 3.26Å; K84-H86 PolarHBondContact O-N 3.23Å
87	E	81.3	Confident	84.6	Confident	155 Å²	155	81.6 Å²	81.6	72%	0.724	41%	0.413	S	S	*	.	H	α-helix	trans	-88.8	-41.8	-176.4	-68.9	177.9	-179.3	0	0	113.5	K83 K84	K83-E87 PolarHBondContact O-N 3.41Å; K84-E87 PolarHBondContact O-N 2.97Å
88	C	69.6	Low	84.6	Confident	75 Å²	75	80.2 Å²	80.2	51%	0.507	40%	0.404	S	S	.	.	S	Bend	trans	-120.3	123.6	-177.2	-66.6	0	0	0	0	107.1	K84 L90	K84-C88 CarbonylContact O-C 3.48Å; K84-C88 WeakPolarHBondContact O-CA 3.05Å; K84-C88 WeakPolarHBondContact O-CB 3.23Å; K84-C88 PolarHBondContact O-N 3.37Å; C88-L90 HydrophobicContact CB-CD1 3.72Å; C88-L90 WeakPolarHBondContact O-CD1 3.34Å; C88-L90 PolarHBondContact O-N 3.32Å
89	D	73.7	Confident	84.6	Confident	154 Å²	154	80.2 Å²	80.2	82%	0.824	40%	0.404	S	S	*	.			trans	-68.8	83.6	173.9	-110.5	-38.6	0	0	0	109.8	R95	D89-R95 IonicContact OD1-NH2 3.39Å; D89-R95 PolarHBondContact OD1-NH2 3.34Å
90	L	77.8	Confident	84.8	Confident	24 Å²	24	79.9 Å²	79.9	13%	0.126	41%	0.406	C	S	.	.			trans	-65.9	140.7	-179.3	-89.4	79.6	0	0	0	109.9	M81 K84 V85 C88 R95	M81-L90 HydrophobicContact CE-CD2 4.29Å; M81-L90 HydrophobicContact SD-CD2 3.74Å; K84-L90 HydrophobicContact CB-CD1 3.88Å; K84-L90 WeakPolarHBondContact O-CD1 3.39Å; V85-L90 HydrophobicContact CG2-CB 4.46Å; C88-L90 HydrophobicContact CB-CD1 3.72Å; C88-L90 WeakPolarHBondContact O-CD1 3.34Å; C88-L90 PolarHBondContact O-N 3.32Å; L90-R95 HydrophobicContact CB-CG 4.25Å; L90-R95 PolarHBondContact O-NE 2.68Å; L90-R95 PolarHBondContact O-NH2 3.3Å
91	P	85.1	Confident	85.1	Confident	72 Å²	72	80 Å²	80	47%	0.468	41%	0.407	S	S	.	.			trans	-61.8	144.8	175.9	24.8	-31.9	0	0	0	111.6	N93 E94 R95	P91-N93 PolarHBondContact O-N 2.99Å; P91-N93 VanDerWaalsContact O-N 3.08Å; P91-E94 HydrophobicContact CG-CB 4.26Å; P91-E94 HydrophobicContact CG-CG 3.9Å; P91-E94 PolarHBondContact O-N 3.41Å; P91-R95 PolarHBondContact O-N 2.89Å
92	I	84	Confident	85.4	Confident	121 Å²	121	79 Å²	79	62%	0.621	40%	0.402	S	S	*	.	H	α-helix	trans	-54.9	-32.8	-177.2	-62.8	166.1	0	0	0	112.1	R95 T96 L147	I92-R95 PolarHBondContact O-N 3.46Å; I92-T96 WeakPolarHBondContact O-CB 3.31Å; I92-T96 PolarHBondContact O-N 2.95Å; I92-T96 PolarHBondContact O-OG1 2.92Å; I92-L147 HydrophobicContact CG2-CD2 4.26Å
93	N	88.2	Confident	85.8	Confident	125 Å²	125	80.3 Å²	80.3	67%	0.668	41%	0.407	S	S	*	.	H	α-helix	trans	-62.5	-44.5	178.7	-169.3	37.8	0	0	0	112.3	P91 T96 Q97	P91-N93 PolarHBondContact O-N 2.99Å; P91-N93 VanDerWaalsContact O-N 3.08Å; N93-T96 PolarHBondContact O-N 3.36Å; N93-Q97 WeakPolarHBondContact O-CB 3.4Å; N93-Q97 PolarHBondContact O-N 3.46Å
94	E	87	Confident	86.2	Confident	96 Å²	96	77.1 Å²	77.1	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-66.4	-40.1	177.4	-73.6	178.2	-164.2	0	0	111.4	P91 T96 Q97 F98	P91-E94 HydrophobicContact CG-CB 4.26Å; P91-E94 HydrophobicContact CG-CG 3.9Å; P91-E94 PolarHBondContact O-N 3.41Å; E94-T96 VanDerWaalsContact C-N 3.31Å; E94-T96 PolarHBondContact O-N 3.43Å; E94-Q97 PolarHBondContact O-N 3.39Å; E94-F98 WeakPolarHBondContact O-CB 3.27Å; E94-F98 PolarHBondContact O-N 2.84Å
95	R	86.8	Confident	86.7	Confident	37 Å²	37	75 Å²	75	14%	0.14	39%	0.394	C	S	.	.	H	α-helix	trans	-61	-41.9	174.9	-56.6	-177.2	-154	-175.1	-1.1	111.3	V85 D89 L90 P91 I92 V99 L147	V85-R95 HydrophobicContact CG2-CG 4.12Å; D89-R95 IonicContact OD1-NH2 3.39Å; D89-R95 PolarHBondContact OD1-NH2 3.34Å; L90-R95 HydrophobicContact CB-CG 4.25Å; L90-R95 PolarHBondContact O-NE 2.68Å; L90-R95 PolarHBondContact O-NH2 3.3Å; P91-R95 PolarHBondContact O-N 2.89Å; I92-R95 PolarHBondContact O-N 3.46Å; R95-V99 VanDerWaalsContact O-CG2 3.29Å; R95-V99 WeakPolarHBondContact O-CG2 3.39Å; R95-V99 PolarHBondContact O-N 3.02Å; R95-V99 VanDerWaalsContact O-N 3.07Å; R95-L147 HydrophobicContact CB-CD2 4.16Å
96	T	89.1	Confident	87.2	Confident	47 Å²	47	74.1 Å²	74.1	29%	0.288	39%	0.388	S	S	.	.	H	α-helix	trans	-67	-47.7	179	-51.8	0	0	0	0	111.1	I92 N93 E94 F98 V99 D100	I92-T96 WeakPolarHBondContact O-CB 3.31Å; I92-T96 PolarHBondContact O-N 2.95Å; I92-T96 PolarHBondContact O-OG1 2.92Å; N93-T96 PolarHBondContact O-N 3.36Å; E94-T96 VanDerWaalsContact C-N 3.31Å; E94-T96 PolarHBondContact O-N 3.43Å; T96-F98 VanDerWaalsContact C-N 3.29Å; T96-F98 PolarHBondContact O-N 3.46Å; T96-V99 PolarHBondContact O-N 2.68Å; T96-V99 VanDerWaalsContact O-N 3.13Å; T96-D100 PolarHBondContact O-N 3.34Å
97	Q	91.6	Very high	87.9	Confident	130 Å²	130	72 Å²	72	61%	0.607	38%	0.378	S	S	*	.	H	α-helix	trans	-58.9	-40.3	177.2	-174.9	178.7	16.1	0	0	112.2	N93 E94 D100 D101	N93-Q97 WeakPolarHBondContact O-CB 3.4Å; N93-Q97 PolarHBondContact O-N 3.46Å; E94-Q97 PolarHBondContact O-N 3.39Å; Q97-D100 PolarHBondContact O-N 3.12Å; Q97-D101 WeakPolarHBondContact O-CB 3.49Å; Q97-D101 PolarHBondContact O-N 3.02Å
98	F	91	Very high	88.5	Confident	26 Å²	26	69.2 Å²	69.2	11%	0.114	37%	0.365	C	S	.	.	H	α-helix	trans	-65.2	-42.3	176	175	-96.8	0	0	0	112.6	N77 L78 M81 E94 T96 D100 D101 I102 L146	N77-F98 HydrophobicContact CB-CE2 4.08Å; N77-F98 HydrophobicContact CB-CZ 4.1Å; N77-F98 VanDerWaalsContact O-CZ 3.28Å; N77-F98 WeakPolarHBondContact O-CZ 3.46Å; L78-F98 HydrophobicContact CD2-CE1 3.98Å; L78-F98 HydrophobicContact CD2-CZ 4.32Å; M81-F98 HydrophobicContact CB-CD1 3.97Å; M81-F98 HydrophobicContact CB-CE1 3.48Å; M81-F98 VanDerWaalsContact CB-CE1 3.48Å; M81-F98 HydrophobicContact CB-CE2 4.1Å; M81-F98 HydrophobicContact CB-CG 4.45Å; M81-F98 HydrophobicContact CB-CZ 3.57Å; M81-F98 HydrophobicContact CE-CB 3.83Å; M81-F98 HydrophobicContact CE-CD1 4.12Å; M81-F98 HydrophobicContact CE-CD2 3.55Å; M81-F98 HydrophobicContact CE-CE2 4.12Å; M81-F98 HydrophobicContact CE-CG 3.54Å; M81-F98 HydrophobicContact CG-CD1 3.56Å; M81-F98 HydrophobicContact CG-CD2 4.48Å; M81-F98 HydrophobicContact CG-CE1 3.6Å; M81-F98 HydrophobicContact CG-CG 4.02Å; M81-F98 HydrophobicContact CG-CZ 4.12Å; M81-F98 HydrophobicContact SD-CG 4.5Å; E94-F98 WeakPolarHBondContact O-CB 3.27Å; E94-F98 PolarHBondContact O-N 2.84Å; T96-F98 VanDerWaalsContact C-N 3.29Å; T96-F98 PolarHBondContact O-N 3.46Å; F98-D100 VanDerWaalsContact C-N 3.33Å; F98-D101 PolarHBondContact O-N 3.33Å; F98-I102 HydrophobicContact CD1-CG1 4.26Å; F98-I102 HydrophobicContact CE1-CD1 4.22Å; F98-I102 HydrophobicContact CE1-CG1 3.8Å; F98-I102 HydrophobicContact CE2-CD1 4.17Å; F98-I102 HydrophobicContact CE2-CG1 4.15Å; F98-I102 HydrophobicContact CZ-CD1 3.7Å; F98-I102 HydrophobicContact CZ-CG1 3.72Å; F98-I102 VanDerWaalsContact O-CG1 3.31Å; F98-I102 WeakPolarHBondContact O-CG1 3.4Å; F98-I102 PolarHBondContact O-N 3.34Å; F98-L146 HydrophobicContact CD1-CD1 4.15Å; F98-L146 HydrophobicContact CE1-CD1 4.12Å
99	V	91.2	Very high	89.5	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-43.4	175.6	168.1	0	0	0	0	110.6	R95 T96 I102 L103 F139 K143 L146 L147	R95-V99 VanDerWaalsContact O-CG2 3.29Å; R95-V99 WeakPolarHBondContact O-CG2 3.39Å; R95-V99 PolarHBondContact O-N 3.02Å; R95-V99 VanDerWaalsContact O-N 3.07Å; T96-V99 PolarHBondContact O-N 2.68Å; T96-V99 VanDerWaalsContact O-N 3.13Å; V99-I102 PolarHBondContact O-N 3.47Å; V99-L103 HydrophobicContact CG1-CD1 4.25Å; V99-L103 WeakPolarHBondContact O-CG 3.44Å; V99-L103 PolarHBondContact O-N 3.04Å; V99-F139 HydrophobicContact CG1-CE2 4.04Å; V99-F139 HydrophobicContact CG1-CZ 3.84Å; V99-K143 HydrophobicContact CG1-CD 4.27Å; V99-K143 HydrophobicContact CG1-CG 4.12Å; V99-L146 HydrophobicContact CG2-CD1 4.24Å; V99-L147 HydrophobicContact CB-CD1 4.37Å; V99-L147 HydrophobicContact CG1-CD1 4.5Å; V99-L147 HydrophobicContact CG2-CD1 4.06Å
100	D	93	Very high	90.4	Very high	92 Å²	92	61.3 Å²	61.3	49%	0.492	32%	0.316	S	S	.	.	H	α-helix	trans	-65.1	-39.5	177.2	-67.5	-23.1	0	0	0	112.3	T96 Q97 F98 L103 A104	T96-D100 PolarHBondContact O-N 3.34Å; Q97-D100 PolarHBondContact O-N 3.12Å; F98-D100 VanDerWaalsContact C-N 3.33Å; D100-L103 WeakPolarHBondContact O-CB 3.44Å; D100-L103 PolarHBondContact O-N 3.47Å; D100-A104 PolarHBondContact O-N 3.1Å
101	D	94.2	Very high	91.1	Very high	73 Å²	73	64.4 Å²	64.4	39%	0.39	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-45	174	173	58.5	0	0	0	111.8	Q97 F98 L103 A104 R105	Q97-D101 WeakPolarHBondContact O-CB 3.49Å; Q97-D101 PolarHBondContact O-N 3.02Å; F98-D101 PolarHBondContact O-N 3.33Å; D101-L103 VanDerWaalsContact C-N 3.35Å; D101-L103 PolarHBondContact O-N 3.24Å; D101-A104 PolarHBondContact O-N 2.96Å; D101-R105 WeakPolarHBondContact O-CG 3.47Å; D101-R105 PolarHBondContact O-N 3.44Å; D101-R105 IonicContact OD1-NH1 2.84Å; D101-R105 IonicContact OD2-CZ 2.69Å; D101-R105 IonicContact OD2-NH1 2.67Å; D101-R105 PolarHBondContact OD2-NH1 3.04Å; D101-R105 IonicContact OD2-NH2 3.12Å; D101-R105 PolarHBondContact OD2-NH2 2.96Å
102	I	93	Very high	91.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.4	-42.1	174.8	-62.2	-87.6	0	0	0	111.2	I74 N77 L78 F98 V99 R105 L106 F139	I74-I102 HydrophobicContact CG2-CD1 4.03Å; I74-I102 HydrophobicContact CG2-CG2 4.06Å; N77-I102 HydrophobicContact CB-CD1 4.3Å; L78-I102 HydrophobicContact CD2-CD1 3.94Å; L78-I102 HydrophobicContact CD2-CG1 4.11Å; L78-I102 HydrophobicContact CD2-CG2 4.32Å; L78-I102 HydrophobicContact CG-CD1 4.06Å; F98-I102 HydrophobicContact CD1-CG1 4.26Å; F98-I102 HydrophobicContact CE1-CD1 4.22Å; F98-I102 HydrophobicContact CE1-CG1 3.8Å; F98-I102 HydrophobicContact CE2-CD1 4.17Å; F98-I102 HydrophobicContact CE2-CG1 4.15Å; F98-I102 HydrophobicContact CZ-CD1 3.7Å; F98-I102 HydrophobicContact CZ-CG1 3.72Å; F98-I102 VanDerWaalsContact O-CG1 3.31Å; F98-I102 WeakPolarHBondContact O-CG1 3.4Å; F98-I102 PolarHBondContact O-N 3.34Å; V99-I102 PolarHBondContact O-N 3.47Å; I102-R105 WeakPolarHBondContact O-CB 3.32Å; I102-R105 PolarHBondContact O-N 2.91Å; I102-L106 HydrophobicContact CG2-CD1 4.18Å; I102-L106 HydrophobicContact CG2-CG 4.38Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 3.4Å; I102-F139 HydrophobicContact CB-CD2 4.06Å; I102-F139 HydrophobicContact CB-CE2 3.97Å; I102-F139 HydrophobicContact CG2-CD2 3.33Å; I102-F139 HydrophobicContact CG2-CE2 3.74Å; I102-F139 HydrophobicContact CG2-CG 4.17Å
103	L	93.6	Very high	91.7	Very high	46 Å²	46	57.4 Å²	57.4	24%	0.241	29%	0.289	C	S	.	.	H	α-helix	trans	-57.9	-49.5	176.6	-79.4	169.5	0	0	0	111.7	V99 D100 D101 R105 L106 E107 F139	V99-L103 HydrophobicContact CG1-CD1 4.25Å; V99-L103 WeakPolarHBondContact O-CG 3.44Å; V99-L103 PolarHBondContact O-N 3.04Å; D100-L103 WeakPolarHBondContact O-CB 3.44Å; D100-L103 PolarHBondContact O-N 3.47Å; D101-L103 VanDerWaalsContact C-N 3.35Å; D101-L103 PolarHBondContact O-N 3.24Å; L103-R105 VanDerWaalsContact C-N 3.27Å; L103-R105 PolarHBondContact O-N 3.43Å; L103-L106 PolarHBondContact O-N 2.74Å; L103-L106 VanDerWaalsContact O-N 3.09Å; L103-E107 PolarHBondContact O-N 3.28Å; L103-F139 HydrophobicContact CD1-CE1 4.5Å; L103-F139 HydrophobicContact CD1-CZ 3.96Å; L103-F139 HydrophobicContact CD2-CD1 4.12Å; L103-F139 HydrophobicContact CD2-CE1 3.21Å; L103-F139 HydrophobicContact CD2-CE2 4.36Å; L103-F139 HydrophobicContact CD2-CZ 3.36Å; L103-F139 HydrophobicContact CG-CE1 3.81Å; L103-F139 HydrophobicContact CG-CE2 4.11Å; L103-F139 HydrophobicContact CG-CZ 3.34Å
104	A	94.3	Very high	91.8	Very high	55 Å²	55	55.1 Å²	55.1	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-39.3	178.3	0	0	0	0	0	111.9	D100 D101 E107 H108	D100-A104 PolarHBondContact O-N 3.1Å; D101-A104 PolarHBondContact O-N 2.96Å; A104-E107 PolarHBondContact O-N 2.99Å; A104-H108 WeakPolarHBondContact O-CB 3.48Å; A104-H108 PolarHBondContact O-N 3.17Å
105	R	94.3	Very high	91.8	Very high	42 Å²	42	57.2 Å²	57.2	16%	0.158	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-41.1	174.1	-72.1	-162.8	-71.5	-106.5	-18.8	112.9	Y70 I74 D101 I102 L103 H108 M109	Y70-R105 HydrophobicContact CE1-CB 3.8Å; Y70-R105 HydrophobicContact CE1-CG 4.32Å; Y70-R105 WeakPolarHBondContact CE1-O 3.19Å; Y70-R105 WeakPolarHBondContact OH-CA 3.45Å; Y70-R105 WeakPolarHBondContact OH-CB 3.4Å; Y70-R105 WeakPolarHBondContact OH-CG 3.41Å; I74-R105 HydrophobicContact CD1-CB 4.11Å; I74-R105 HydrophobicContact CG1-CB 4.47Å; D101-R105 WeakPolarHBondContact O-CG 3.47Å; D101-R105 PolarHBondContact O-N 3.44Å; D101-R105 IonicContact OD1-NH1 2.84Å; D101-R105 IonicContact OD2-CZ 2.69Å; D101-R105 IonicContact OD2-NH1 2.67Å; D101-R105 PolarHBondContact OD2-NH1 3.04Å; D101-R105 IonicContact OD2-NH2 3.12Å; D101-R105 PolarHBondContact OD2-NH2 2.96Å; I102-R105 WeakPolarHBondContact O-CB 3.32Å; I102-R105 PolarHBondContact O-N 2.91Å; L103-R105 VanDerWaalsContact C-N 3.27Å; L103-R105 PolarHBondContact O-N 3.43Å; R105-H108 PolarHBondContact O-N 3.45Å; R105-M109 WeakPolarHBondContact O-CB 3.38Å; R105-M109 PolarHBondContact O-N 3Å
106	L	93.4	Very high	91.8	Very high	10 Å²	10	56.1 Å²	56.1	5%	0.052	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-43.1	177.1	-72.5	173.4	0	0	0	111.7	I74 I102 L103 M109 Q110 L132 L135 F139	I74-L106 HydrophobicContact CD1-CD2 4.11Å; I102-L106 HydrophobicContact CG2-CD1 4.18Å; I102-L106 HydrophobicContact CG2-CG 4.38Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 3.4Å; L103-L106 PolarHBondContact O-N 2.74Å; L103-L106 VanDerWaalsContact O-N 3.09Å; L106-M109 PolarHBondContact O-N 2.8Å; L106-Q110 WeakPolarHBondContact O-CB 3.23Å; L106-Q110 PolarHBondContact O-N 3.2Å; L106-L132 HydrophobicContact CD2-CD1 4.17Å; L106-L135 HydrophobicContact CD2-CD2 3.61Å; L106-L135 HydrophobicContact CD2-CG 3.86Å; L106-F139 HydrophobicContact CD1-CB 3.8Å; L106-F139 HydrophobicContact CD1-CD1 3.89Å; L106-F139 HydrophobicContact CD1-CD2 4.28Å; L106-F139 HydrophobicContact CD1-CG 3.68Å
107	E	93.3	Very high	91.7	Very high	128 Å²	128	55.8 Å²	55.8	60%	0.598	28%	0.284	S	S	*	.	H	α-helix	trans	-62.8	-45.1	175.2	-70.2	-179.2	178.5	0	0	111.7	L103 A104 M109 Q110 N111	L103-E107 PolarHBondContact O-N 3.28Å; A104-E107 PolarHBondContact O-N 2.99Å; E107-M109 VanDerWaalsContact C-N 3.33Å; E107-M109 PolarHBondContact O-N 2.92Å; E107-Q110 PolarHBondContact O-N 3.47Å; E107-N111 VanDerWaalsContact O-CG 3.29Å; E107-N111 PolarHBondContact O-N 2.73Å; E107-N111 PolarHBondContact O-ND2 3.01Å
108	H	94.2	Very high	91.2	Very high	96 Å²	96	53.8 Å²	53.8	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-57.3	-46.2	173.8	174.6	-99.3	0	0	0	111.6	Y70 A104 R105 Q110 N111 W112	Y70-H108 AromaticContact CZ-ND1 3.96Å; A104-H108 WeakPolarHBondContact O-CB 3.48Å; A104-H108 PolarHBondContact O-N 3.17Å; R105-H108 PolarHBondContact O-N 3.45Å; H108-Q110 VanDerWaalsContact C-N 3.35Å; H108-Q110 PolarHBondContact O-N 3.03Å; H108-N111 PolarHBondContact O-N 3.24Å; H108-W112 WeakPolarHBondContact O-CB 3.36Å; H108-W112 PolarHBondContact O-N 2.61Å
109	M	91.1	Very high	90.8	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-37.6	178.7	-169.5	160.4	79.3	0	0	112.5	F67 Y70 I74 R105 L106 E107 L113 L132 L135	F67-M109 HydrophobicContact CD2-CG 3.79Å; F67-M109 HydrophobicContact CD2-SD 3.94Å; F67-M109 HydrophobicContact CE2-CE 4.2Å; F67-M109 HydrophobicContact CE2-CG 3.56Å; F67-M109 HydrophobicContact CE2-SD 3.8Å; F67-M109 HydrophobicContact CZ-CE 4.22Å; F67-M109 HydrophobicContact CZ-CG 4.47Å; F67-M109 HydrophobicContact CZ-SD 4.27Å; Y70-M109 HydrophobicContact CD1-CB 4.17Å; Y70-M109 HydrophobicContact CD1-CG 4.3Å; Y70-M109 HydrophobicContact CD1-SD 3.6Å; Y70-M109 HydrophobicContact CE1-CB 4.15Å; Y70-M109 HydrophobicContact CE1-SD 4.46Å; Y70-M109 HydrophobicContact CG-SD 4.37Å; I74-M109 HydrophobicContact CD1-CE 4.5Å; R105-M109 WeakPolarHBondContact O-CB 3.38Å; R105-M109 PolarHBondContact O-N 3Å; L106-M109 PolarHBondContact O-N 2.8Å; E107-M109 VanDerWaalsContact C-N 3.33Å; E107-M109 PolarHBondContact O-N 2.92Å; M109-L113 WeakPolarHBondContact O-CB 3.47Å; M109-L113 PolarHBondContact O-N 3.07Å; M109-L132 HydrophobicContact CB-CD1 4.41Å; M109-L132 HydrophobicContact CE-CD1 3.38Å; M109-L132 HydrophobicContact CG-CD1 4.35Å; M109-L135 HydrophobicContact CE-CD2 3.41Å; M109-L135 VanDerWaalsContact CE-CD2 3.41Å
110	Q	93	Very high	90.4	Very high	63 Å²	63	55.6 Å²	55.6	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-64.1	-43.6	174.4	-177.2	57.8	85.7	0	0	112.1	L106 E107 H108 L113 N114 L132	L106-Q110 WeakPolarHBondContact O-CB 3.23Å; L106-Q110 PolarHBondContact O-N 3.2Å; E107-Q110 PolarHBondContact O-N 3.47Å; H108-Q110 VanDerWaalsContact C-N 3.35Å; H108-Q110 PolarHBondContact O-N 3.03Å; Q110-L113 PolarHBondContact O-N 2.75Å; Q110-N114 PolarHBondContact NE2-OD1 3.33Å; Q110-N114 VanDerWaalsContact O-CG 3.23Å; Q110-N114 PolarHBondContact O-N 2.91Å; Q110-N114 VanDerWaalsContact O-N 3.1Å; Q110-N114 PolarHBondContact O-ND2 2.96Å; Q110-L132 HydrophobicContact CB-CD2 3.77Å; Q110-L132 HydrophobicContact CG-CD2 4.14Å
111	N	91.8	Very high	89.9	Confident	88 Å²	88	53.7 Å²	53.7	47%	0.471	27%	0.273	S	S	.	.	H	α-helix	trans	-65	-45.2	177.9	-70.3	-24.5	0	0	0	111	E107 H108 L113 N114 E115	E107-N111 VanDerWaalsContact O-CG 3.29Å; E107-N111 PolarHBondContact O-N 2.73Å; E107-N111 PolarHBondContact O-ND2 3.01Å; H108-N111 PolarHBondContact O-N 3.24Å; N111-L113 VanDerWaalsContact C-N 3.29Å; N111-L113 PolarHBondContact O-N 3.3Å; N111-N114 WeakPolarHBondContact O-CA 3.09Å; N111-N114 WeakPolarHBondContact O-CB 3.42Å; N111-N114 PolarHBondContact O-N 3.36Å; N111-E115 WeakPolarHBondContact O-CG 3.3Å; N111-E115 PolarHBondContact O-N 3.44Å
112	W	90.7	Very high	89.2	Confident	46 Å²	46	52.7 Å²	52.7	17%	0.174	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-35.5	179.3	-169.4	34.5	0	0	0	112.6	F63 H66 F67 H108 N114 E115 T116	F63-W112 HydrophobicContact CB-CZ2 4.33Å; F63-W112 AromaticContact CD2-CD2 3.67Å; F63-W112 HydrophobicContact CD2-CD2 3.67Å; F63-W112 AromaticContact CD2-CE2 3.43Å; F63-W112 VanDerWaalsContact CD2-CE2 3.43Å; F63-W112 AromaticContact CD2-CE3 3.98Å; F63-W112 HydrophobicContact CD2-CE3 3.98Å; F63-W112 HydrophobicContact CD2-CG 4.23Å; F63-W112 AromaticContact CD2-CH2 3.64Å; F63-W112 HydrophobicContact CD2-CH2 3.64Å; F63-W112 AromaticContact CD2-CZ2 3.47Å; F63-W112 HydrophobicContact CD2-CZ2 3.47Å; F63-W112 VanDerWaalsContact CD2-CZ2 3.47Å; F63-W112 AromaticContact CD2-CZ3 3.94Å; F63-W112 HydrophobicContact CD2-CZ3 3.94Å; F63-W112 AromaticContact CD2-NE1 3.87Å; F63-W112 HydrophobicContact CE2-CB 4.48Å; F63-W112 AromaticContact CE2-CD2 3.56Å; F63-W112 HydrophobicContact CE2-CD2 3.56Å; F63-W112 AromaticContact CE2-CE2 3.85Å; F63-W112 AromaticContact CE2-CE3 3.7Å; F63-W112 HydrophobicContact CE2-CE3 3.7Å; F63-W112 AromaticContact CE2-CG 3.9Å; F63-W112 HydrophobicContact CE2-CG 3.9Å; F63-W112 HydrophobicContact CE2-CH2 4.18Å; F63-W112 HydrophobicContact CE2-CZ2 4.21Å; F63-W112 AromaticContact CE2-CZ3 3.99Å; F63-W112 HydrophobicContact CE2-CZ3 3.99Å; F63-W112 HydrophobicContact CG-CH2 4.35Å; F63-W112 HydrophobicContact CG-CZ2 4.31Å; H66-W112 HydrophobicContact CB-CH2 3.65Å; H66-W112 HydrophobicContact CB-CZ3 4.21Å; H66-W112 AromaticContact CE1-CZ3 3.89Å; H66-W112 AromaticContact CG-CH2 3.6Å; H66-W112 AromaticContact CG-CZ3 3.9Å; H66-W112 AromaticContact ND1-CE3 3.97Å; H66-W112 AromaticContact ND1-CH2 2.91Å; H66-W112 WeakPolarHBondContact ND1-CH2 3.49Å; H66-W112 AromaticContact ND1-CZ2 3.84Å; H66-W112 AromaticContact ND1-CZ3 2.96Å; H66-W112 WeakPolarHBondContact ND1-CZ3 3.32Å; F67-W112 HydrophobicContact CB-CZ3 4.47Å; H108-W112 WeakPolarHBondContact O-CB 3.36Å; H108-W112 PolarHBondContact O-N 2.61Å; W112-N114 VanDerWaalsContact C-N 3.34Å; W112-E115 PolarHBondContact O-N 3.1Å; W112-T116 WeakPolarHBondContact O-CB 3.16Å; W112-T116 WeakPolarHBondContact O-CG2 3.42Å; W112-T116 PolarHBondContact O-N 2.96Å; W112-T116 PolarHBondContact O-OG1 3.27Å
113	L	91.1	Very high	88.7	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-38.6	170.3	178.3	59.8	0	0	0	112.2	F63 M109 Q110 N111 T116 S117 L120 A128 R129 L132	F63-L113 HydrophobicContact CE1-CD1 4.06Å; F63-L113 HydrophobicContact CZ-CB 4.15Å; F63-L113 HydrophobicContact CZ-CD1 3.78Å; M109-L113 WeakPolarHBondContact O-CB 3.47Å; M109-L113 PolarHBondContact O-N 3.07Å; Q110-L113 PolarHBondContact O-N 2.75Å; N111-L113 VanDerWaalsContact C-N 3.29Å; N111-L113 PolarHBondContact O-N 3.3Å; L113-T116 PolarHBondContact O-OG1 2.95Å; L113-S117 VanDerWaalsContact O-CA 3.31Å; L113-S117 WeakPolarHBondContact O-CA 3.49Å; L113-S117 VanDerWaalsContact O-CB 3.28Å; L113-S117 WeakPolarHBondContact O-CB 3.47Å; L113-S117 PolarHBondContact O-N 3.37Å; L113-L120 HydrophobicContact CD1-CD1 3.77Å; L113-A128 HydrophobicContact CD1-CB 3.58Å; L113-A128 HydrophobicContact CD2-CB 3.96Å; L113-A128 HydrophobicContact CG-CB 4.44Å; L113-R129 HydrophobicContact CD2-CB 4.47Å; L113-R129 HydrophobicContact CD2-CG 3.71Å; L113-L132 HydrophobicContact CD2-CD2 4.26Å
114	N	89.3	Confident	88.2	Confident	78 Å²	78	57 Å²	57	42%	0.417	29%	0.289	S	S	.	.	H	α-helix	trans	-68.8	-38.1	177.6	-67.2	-29.4	0	0	0	112.1	Q110 N111 W112 S117	Q110-N114 PolarHBondContact NE2-OD1 3.33Å; Q110-N114 VanDerWaalsContact O-CG 3.23Å; Q110-N114 PolarHBondContact O-N 2.91Å; Q110-N114 VanDerWaalsContact O-N 3.1Å; Q110-N114 PolarHBondContact O-ND2 2.96Å; N111-N114 WeakPolarHBondContact O-CA 3.09Å; N111-N114 WeakPolarHBondContact O-CB 3.42Å; N111-N114 PolarHBondContact O-N 3.36Å; W112-N114 VanDerWaalsContact C-N 3.34Å; N114-S117 WeakPolarHBondContact O-CB 3.3Å; N114-S117 PolarHBondContact O-N 3.44Å
115	E	88.3	Confident	87.9	Confident	139 Å²	139	55 Å²	55	65%	0.65	27%	0.271	S	S	*	.	H	α-helix	trans	-68.1	-44.6	176.5	-70.6	171.5	-175.3	0	0	111.9	N111 W112 S117	N111-E115 WeakPolarHBondContact O-CG 3.3Å; N111-E115 PolarHBondContact O-N 3.44Å; W112-E115 PolarHBondContact O-N 3.1Å; E115-S117 VanDerWaalsContact C-N 3.25Å; E115-S117 PolarHBondContact O-N 3.41Å
116	T	86.6	Confident	87.5	Confident	14 Å²	14	58.1 Å²	58.1	9%	0.086	29%	0.287	C	S	.	.	H	α-helix	trans	-81	-8.6	179.2	58.1	0	0	0	0	113.4	F63 W112 L113 M118 Y119 L120	F63-T116 HydrophobicContact CB-CG2 4.32Å; F63-T116 HydrophobicContact CD2-CG2 3.44Å; F63-T116 VanDerWaalsContact CD2-CG2 3.44Å; F63-T116 VanDerWaalsContact CD2-OG1 3.23Å; F63-T116 WeakPolarHBondContact CD2-OG1 2.95Å; F63-T116 HydrophobicContact CE2-CG2 4Å; F63-T116 WeakPolarHBondContact CE2-OG1 3.46Å; F63-T116 HydrophobicContact CG-CG2 3.98Å; F63-T116 WeakPolarHBondContact CZ-OG1 3.4Å; W112-T116 WeakPolarHBondContact O-CB 3.16Å; W112-T116 WeakPolarHBondContact O-CG2 3.42Å; W112-T116 PolarHBondContact O-N 2.96Å; W112-T116 PolarHBondContact O-OG1 3.27Å; L113-T116 PolarHBondContact O-OG1 2.95Å; T116-M118 PolarHBondContact O-N 3.26Å; T116-Y119 PolarHBondContact O-N 3.07Å; T116-L120 PolarHBondContact O-N 3.44Å
117	S	86.5	Confident	87.1	Confident	41 Å²	41	60.6 Å²	60.6	29%	0.287	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-39.8	-177.8	172.4	0	0	0	0	113.2	R42 L113 N114 E115 Y119 N125	R42-S117 PolarHBondContact NH2-O 2.92Å; L113-S117 VanDerWaalsContact O-CA 3.31Å; L113-S117 WeakPolarHBondContact O-CA 3.49Å; L113-S117 VanDerWaalsContact O-CB 3.28Å; L113-S117 WeakPolarHBondContact O-CB 3.47Å; L113-S117 PolarHBondContact O-N 3.37Å; N114-S117 WeakPolarHBondContact O-CB 3.3Å; N114-S117 PolarHBondContact O-N 3.44Å; E115-S117 VanDerWaalsContact C-N 3.25Å; E115-S117 PolarHBondContact O-N 3.41Å; S117-Y119 VanDerWaalsContact C-N 3.3Å; S117-Y119 PolarHBondContact O-N 3.4Å; S117-N125 VanDerWaalsContact CA-ND2 3.27Å; S117-N125 WeakPolarHBondContact CA-ND2 3.38Å; S117-N125 WeakPolarHBondContact CB-ND2 3.41Å; S117-N125 PolarHBondContact O-ND2 3.26Å; S117-N125 PolarHBondContact OG-ND2 3.12Å
118	M	81.5	Confident	86.8	Confident	87 Å²	87	54.6 Å²	54.6	43%	0.429	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.9	-179	-167.9	-178.8	72.7	0	0	114	R42 V45 T116	R42-M118 VanDerWaalsContact CZ-O 3.27Å; R42-M118 PolarHBondContact NE-O 2.92Å; R42-M118 PolarHBondContact NH2-O 2.79Å; V45-M118 HydrophobicContact CG1-CE 4.07Å; V45-M118 HydrophobicContact CG1-SD 4.49Å; T116-M118 PolarHBondContact O-N 3.26Å
119	Y	82.5	Confident	86.6	Confident	68 Å²	68	55.4 Å²	55.4	27%	0.267	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-20	179.6	-52.6	-80.4	0	0	0	114	R42 T116 S117	R42-Y119 VanDerWaalsContact NH2-N 3.17Å; T116-Y119 PolarHBondContact O-N 3.07Å; S117-Y119 VanDerWaalsContact C-N 3.3Å; S117-Y119 PolarHBondContact O-N 3.4Å
120	L	83.4	Confident	86.4	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	30%	0.296	C	S	.	.	S	Bend	trans	-89.2	125.7	178.7	-56.7	176.4	0	0	0	115.9	R42 R60 F63 L64 L113 T116 D124	R42-L120 VanDerWaalsContact CZ-C 3.44Å; R42-L120 PolarHBondContact NH1-O 3.48Å; R42-L120 PolarHBondContact NH2-O 2.91Å; R60-L120 HydrophobicContact CG-CD2 4.11Å; F63-L120 HydrophobicContact CD1-CD1 3.58Å; F63-L120 HydrophobicContact CD1-CD2 3.66Å; F63-L120 HydrophobicContact CD1-CG 4.13Å; F63-L120 HydrophobicContact CE1-CD1 3.33Å; F63-L120 HydrophobicContact CE1-CD2 4.28Å; F63-L120 HydrophobicContact CE1-CG 4.35Å; F63-L120 HydrophobicContact CG-CD2 4.4Å; F63-L120 HydrophobicContact CZ-CD1 4.09Å; L64-L120 HydrophobicContact CD1-CD2 4.33Å; L64-L120 HydrophobicContact CD2-CD1 4.5Å; L64-L120 HydrophobicContact CD2-CD2 3.77Å; L64-L120 HydrophobicContact CG-CD2 3.94Å; L113-L120 HydrophobicContact CD1-CD1 3.77Å; T116-L120 PolarHBondContact O-N 3.44Å; L120-D124 HydrophobicContact CB-CB 4.16Å
121	T	82.7	Confident	86.3	Confident	51 Å²	51	59.2 Å²	59.2	31%	0.313	29%	0.29	S	S	.	.			trans	-47.1	152.9	178.3	72.1	0	0	0	0	113.4	F123 D124 N125	T121-F123 PolarHBondContact O-N 3.46Å; T121-F123 VanDerWaalsContact O-N 3.15Å; T121-D124 WeakPolarHBondContact O-CB 3.48Å; T121-D124 PolarHBondContact O-N 2.79Å; T121-D124 WeakPolarHBondContact OG1-CB 3.13Å; T121-D124 PolarHBondContact OG1-N 3.49Å; T121-D124 PolarHBondContact OG1-OD2 2.73Å; T121-N125 PolarHBondContact O-N 2.72Å
122	S	79.6	Confident	86.3	Confident	52 Å²	52	55.4 Å²	55.4	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-50.9	-43.5	-179.4	170.3	0	0	0	0	112	N125 E126	S122-N125 PolarHBondContact O-N 3.08Å; S122-E126 WeakPolarHBondContact O-CG 3.45Å; S122-E126 PolarHBondContact O-N 3.12Å; S122-E126 VanDerWaalsContact O-N 3.1Å
123	F	82.3	Confident	86.3	Confident	134 Å²	134	59.7 Å²	59.7	59%	0.588	29%	0.29	S	S	*	.	H	α-helix	trans	-59.7	-48.1	174.2	176.8	-98	0	0	0	112.8	T121 N125 E126 Q127	T121-F123 PolarHBondContact O-N 3.46Å; T121-F123 VanDerWaalsContact O-N 3.15Å; F123-N125 VanDerWaalsContact C-N 3.32Å; F123-N125 PolarHBondContact O-N 3.19Å; F123-E126 PolarHBondContact O-N 3.12Å; F123-Q127 VanDerWaalsContact O-CB 3.3Å; F123-Q127 WeakPolarHBondContact O-CB 3.28Å; F123-Q127 PolarHBondContact O-N 3.22Å
124	D	83.3	Confident	86.3	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-38.7	-178.9	-64.7	-35.6	0	0	0	112.8	R60 L64 L120 T121 A128 R347	R60-D124 IonicContact CZ-OD2 3.55Å; R60-D124 IonicContact NE-OD2 3.53Å; R60-D124 PolarHBondContact NE-OD2 3.15Å; R60-D124 IonicContact NH2-OD1 3.47Å; R60-D124 IonicContact NH2-OD2 2.73Å; R60-D124 PolarHBondContact NH2-OD2 2.58Å; L64-D124 HydrophobicContact CD2-CB 4.49Å; L120-D124 HydrophobicContact CB-CB 4.16Å; T121-D124 WeakPolarHBondContact O-CB 3.48Å; T121-D124 PolarHBondContact O-N 2.79Å; T121-D124 WeakPolarHBondContact OG1-CB 3.13Å; T121-D124 PolarHBondContact OG1-N 3.49Å; T121-D124 PolarHBondContact OG1-OD2 2.73Å; D124-A128 WeakPolarHBondContact O-CB 3.37Å; D124-A128 PolarHBondContact O-N 3.21Å; D124-R347 VanDerWaalsContact CB-NH1 3.3Å; D124-R347 WeakPolarHBondContact OD1-CD 3.35Å; D124-R347 IonicContact OD1-CZ 3.81Å; D124-R347 IonicContact OD1-NE 2.68Å; D124-R347 IonicContact OD1-NH1 2.73Å; D124-R347 PolarHBondContact OD1-NH1 2.99Å
125	N	87.2	Confident	86.5	Confident	14 Å²	14	59.9 Å²	59.9	8%	0.075	30%	0.297	C	S	.	.	H	α-helix	trans	-66	-50	179.2	-164.6	-70.1	0	0	0	110.6	S117 T121 S122 F123 Q127 A128 R129	S117-N125 VanDerWaalsContact CA-ND2 3.27Å; S117-N125 WeakPolarHBondContact CA-ND2 3.38Å; S117-N125 WeakPolarHBondContact CB-ND2 3.41Å; S117-N125 PolarHBondContact O-ND2 3.26Å; S117-N125 PolarHBondContact OG-ND2 3.12Å; T121-N125 PolarHBondContact O-N 2.72Å; S122-N125 PolarHBondContact O-N 3.08Å; F123-N125 VanDerWaalsContact C-N 3.32Å; F123-N125 PolarHBondContact O-N 3.19Å; N125-Q127 VanDerWaalsContact C-N 3.32Å; N125-Q127 PolarHBondContact O-N 2.91Å; N125-A128 PolarHBondContact O-N 3.04Å; N125-R129 VanDerWaalsContact O-CG 3.28Å; N125-R129 WeakPolarHBondContact O-CG 3.25Å; N125-R129 PolarHBondContact O-N 3.38Å; N125-R129 WeakPolarHBondContact OD1-CD 3.04Å
126	E	84.9	Confident	86.7	Confident	106 Å²	106	56.1 Å²	56.1	50%	0.495	28%	0.281	S	S	.	.	H	α-helix	trans	-60.9	-42.3	177.7	-65.9	-56.6	158.9	0	0	111.7	S122 F123 R129 L130	S122-E126 WeakPolarHBondContact O-CG 3.45Å; S122-E126 PolarHBondContact O-N 3.12Å; S122-E126 VanDerWaalsContact O-N 3.1Å; F123-E126 PolarHBondContact O-N 3.12Å; E126-R129 PolarHBondContact O-N 2.95Å; E126-L130 PolarHBondContact O-N 3.09Å
127	Q	85.4	Confident	87.1	Confident	62 Å²	62	59.6 Å²	59.6	29%	0.29	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-47.3	176.2	-177	61.7	34.7	0	0	111.8	F123 N125 R129 L130 E131	F123-Q127 VanDerWaalsContact O-CB 3.3Å; F123-Q127 WeakPolarHBondContact O-CB 3.28Å; F123-Q127 PolarHBondContact O-N 3.22Å; N125-Q127 VanDerWaalsContact C-N 3.32Å; N125-Q127 PolarHBondContact O-N 2.91Å; Q127-R129 VanDerWaalsContact C-N 3.31Å; Q127-R129 PolarHBondContact O-N 3.03Å; Q127-L130 PolarHBondContact O-N 3.01Å; Q127-E131 WeakPolarHBondContact CG-OE1 3.46Å; Q127-E131 PolarHBondContact NE2-OE1 3.44Å; Q127-E131 WeakPolarHBondContact O-CG 3.16Å; Q127-E131 PolarHBondContact O-N 3.41Å
128	A	86.8	Confident	87.3	Confident	2 Å²	2	60.1 Å²	60.1	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-37	178.1	0	0	0	0	0	112.2	F67 L113 D124 N125 E131 L132	F67-A128 HydrophobicContact CE1-CB 4.1Å; F67-A128 HydrophobicContact CE2-CB 4.32Å; F67-A128 HydrophobicContact CZ-CB 3.92Å; F67-A128 WeakPolarHBondContact CZ-O 3.47Å; L113-A128 HydrophobicContact CD1-CB 3.58Å; L113-A128 HydrophobicContact CD2-CB 3.96Å; L113-A128 HydrophobicContact CG-CB 4.44Å; D124-A128 WeakPolarHBondContact O-CB 3.37Å; D124-A128 PolarHBondContact O-N 3.21Å; N125-A128 PolarHBondContact O-N 3.04Å; A128-E131 PolarHBondContact O-N 3.24Å; A128-L132 VanDerWaalsContact O-CB 3.29Å; A128-L132 WeakPolarHBondContact O-CB 3.45Å; A128-L132 PolarHBondContact O-N 3.14Å
129	R	90.5	Very high	87.9	Confident	114 Å²	114	56.1 Å²	56.1	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-42.7	173.8	-67.9	175	78.1	95.2	4.5	111.9	L113 N125 E126 Q127 L132 K133	L113-R129 HydrophobicContact CD2-CB 4.47Å; L113-R129 HydrophobicContact CD2-CG 3.71Å; N125-R129 VanDerWaalsContact O-CG 3.28Å; N125-R129 WeakPolarHBondContact O-CG 3.25Å; N125-R129 PolarHBondContact O-N 3.38Å; N125-R129 WeakPolarHBondContact OD1-CD 3.04Å; E126-R129 PolarHBondContact O-N 2.95Å; Q127-R129 VanDerWaalsContact C-N 3.31Å; Q127-R129 PolarHBondContact O-N 3.03Å; R129-L132 PolarHBondContact O-N 2.93Å; R129-K133 WeakPolarHBondContact O-CB 3.39Å; R129-K133 PolarHBondContact O-N 3.14Å
130	L	88.1	Confident	88.4	Confident	107 Å²	107	56.6 Å²	56.6	56%	0.56	28%	0.284	S	S	*	.	H	α-helix	trans	-62.5	-44.5	175.7	-84.4	160.7	0	0	0	111.8	E126 Q127 K133 S134	E126-L130 PolarHBondContact O-N 3.09Å; Q127-L130 PolarHBondContact O-N 3.01Å; L130-K133 PolarHBondContact O-N 3.03Å; L130-S134 PolarHBondContact O-N 2.99Å
131	E	89.4	Confident	88.7	Confident	36 Å²	36	62 Å²	62	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-41.3	176.9	-73	-176.6	-145	0	0	112.4	F67 K71 Q127 A128 S134 L135	F67-E131 HydrophobicContact CE1-CB 4.3Å; K71-E131 HydrophobicContact CD-CB 4.47Å; K71-E131 IonicContact NZ-OE2 2.7Å; K71-E131 PolarHBondContact NZ-OE2 2.74Å; Q127-E131 WeakPolarHBondContact CG-OE1 3.46Å; Q127-E131 PolarHBondContact NE2-OE1 3.44Å; Q127-E131 WeakPolarHBondContact O-CG 3.16Å; Q127-E131 PolarHBondContact O-N 3.41Å; A128-E131 PolarHBondContact O-N 3.24Å; E131-S134 PolarHBondContact O-N 3.09Å; E131-L135 WeakPolarHBondContact O-CB 3.42Å; E131-L135 PolarHBondContact O-N 3.1Å
132	L	91.7	Very high	89	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-38.5	176.1	179.7	61.9	0	0	0	111.8	F67 L106 M109 Q110 L113 A128 R129 L135 N136	F67-L132 HydrophobicContact CZ-CB 4.37Å; L106-L132 HydrophobicContact CD2-CD1 4.17Å; M109-L132 HydrophobicContact CB-CD1 4.41Å; M109-L132 HydrophobicContact CE-CD1 3.38Å; M109-L132 HydrophobicContact CG-CD1 4.35Å; Q110-L132 HydrophobicContact CB-CD2 3.77Å; Q110-L132 HydrophobicContact CG-CD2 4.14Å; L113-L132 HydrophobicContact CD2-CD2 4.26Å; A128-L132 VanDerWaalsContact O-CB 3.29Å; A128-L132 WeakPolarHBondContact O-CB 3.45Å; A128-L132 PolarHBondContact O-N 3.14Å; R129-L132 PolarHBondContact O-N 2.93Å; L132-L135 PolarHBondContact O-N 2.94Å; L132-N136 WeakPolarHBondContact O-CB 3.38Å; L132-N136 PolarHBondContact O-N 2.75Å
133	K	91.5	Very high	89.5	Confident	136 Å²	136	62.2 Å²	62.2	59%	0.591	30%	0.299	S	S	*	.	H	α-helix	trans	-61.5	-50.4	172.7	-176.5	-174.9	175.8	-172.1	0	111.2	R129 L130 L135 N136 D137	R129-K133 WeakPolarHBondContact O-CB 3.39Å; R129-K133 PolarHBondContact O-N 3.14Å; L130-K133 PolarHBondContact O-N 3.03Å; K133-L135 VanDerWaalsContact C-N 3.28Å; K133-L135 PolarHBondContact O-N 2.87Å; K133-N136 WeakPolarHBondContact O-CB 3.36Å; K133-N136 PolarHBondContact O-N 2.85Å; K133-N136 VanDerWaalsContact O-N 3.11Å; K133-D137 VanDerWaalsContact O-CG 3.31Å; K133-D137 PolarHBondContact O-N 2.91Å
134	S	91.5	Very high	89.7	Confident	78 Å²	78	59.6 Å²	59.6	55%	0.545	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-40.1	177.4	173.1	0	0	0	0	112	L130 E131 D137 L138	L130-S134 PolarHBondContact O-N 2.99Å; E131-S134 PolarHBondContact O-N 3.09Å; S134-D137 PolarHBondContact O-N 3.32Å; S134-L138 PolarHBondContact O-N 2.93Å
135	L	92.3	Very high	89.8	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-66.5	-38.6	175.6	-174.1	64.3	0	0	0	112.3	K71 I74 V75 L106 M109 E131 L132 K133 L138 F139	K71-L135 HydrophobicContact CB-CD2 4.45Å; K71-L135 HydrophobicContact CG-CD2 4.31Å; I74-L135 HydrophobicContact CB-CD1 4.47Å; I74-L135 HydrophobicContact CB-CD2 4.23Å; I74-L135 HydrophobicContact CD1-CD2 3.94Å; I74-L135 HydrophobicContact CG2-CD1 3.95Å; I74-L135 HydrophobicContact CG2-CD2 4.08Å; I74-L135 HydrophobicContact CG2-CG 4.24Å; V75-L135 HydrophobicContact CG2-CD1 3.49Å; V75-L135 VanDerWaalsContact CG2-CD1 3.49Å; L106-L135 HydrophobicContact CD2-CD2 3.61Å; L106-L135 HydrophobicContact CD2-CG 3.86Å; M109-L135 HydrophobicContact CE-CD2 3.41Å; M109-L135 VanDerWaalsContact CE-CD2 3.41Å; E131-L135 WeakPolarHBondContact O-CB 3.42Å; E131-L135 PolarHBondContact O-N 3.1Å; L132-L135 PolarHBondContact O-N 2.94Å; K133-L135 VanDerWaalsContact C-N 3.28Å; K133-L135 PolarHBondContact O-N 2.87Å; L135-L138 HydrophobicContact CD1-CD2 4.43Å; L135-L138 PolarHBondContact O-N 3.19Å; L135-F139 WeakPolarHBondContact O-CB 3.44Å; L135-F139 PolarHBondContact O-N 3.41Å
136	N	94.1	Very high	89.6	Confident	60 Å²	60	63.6 Å²	63.6	32%	0.321	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-39.9	174.2	179.1	78.8	0	0	0	111.7	L132 K133 F139 Q140	L132-N136 WeakPolarHBondContact O-CB 3.38Å; L132-N136 PolarHBondContact O-N 2.75Å; K133-N136 WeakPolarHBondContact O-CB 3.36Å; K133-N136 PolarHBondContact O-N 2.85Å; K133-N136 VanDerWaalsContact O-N 3.11Å; N136-F139 WeakPolarHBondContact O-CB 3.32Å; N136-F139 PolarHBondContact O-N 3.18Å; N136-Q140 WeakPolarHBondContact O-CG 3.42Å; N136-Q140 PolarHBondContact O-N 3Å
137	D	93.6	Very high	89.6	Confident	87 Å²	87	60.4 Å²	60.4	47%	0.465	30%	0.299	S	S	.	.	H	α-helix	trans	-62.6	-45.8	176	-65.5	-22.9	0	0	0	110.9	K133 S134 F139 Q140 E141	K133-D137 VanDerWaalsContact O-CG 3.31Å; K133-D137 PolarHBondContact O-N 2.91Å; S134-D137 PolarHBondContact O-N 3.32Å; D137-F139 VanDerWaalsContact C-N 3.31Å; D137-F139 PolarHBondContact O-N 2.95Å; D137-Q140 PolarHBondContact O-N 3.48Å; D137-Q140 VanDerWaalsContact O-N 3.16Å; D137-E141 PolarHBondContact O-N 3.4Å
138	L	91	Very high	89.3	Confident	53 Å²	53	62 Å²	62	28%	0.277	32%	0.315	S	S	.	.	H	α-helix	trans	-59	-42.2	172.7	178.1	64.4	0	0	0	111.8	V75 L78 S134 L135 Q140 E141 K142	V75-L138 HydrophobicContact CG1-CD2 4.47Å; V75-L138 HydrophobicContact CG2-CD2 4.15Å; L78-L138 HydrophobicContact CD1-CD2 4.44Å; L78-L138 HydrophobicContact CD1-CG 4.36Å; S134-L138 PolarHBondContact O-N 2.93Å; L135-L138 HydrophobicContact CD1-CD2 4.43Å; L135-L138 PolarHBondContact O-N 3.19Å; L138-Q140 PolarHBondContact O-N 2.83Å; L138-E141 PolarHBondContact O-N 2.87Å; L138-K142 HydrophobicContact CD1-CG 4.3Å; L138-K142 WeakPolarHBondContact O-CG 3.37Å; L138-K142 PolarHBondContact O-N 3.2Å
139	F	94.1	Very high	88.3	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.009	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-41.9	175.5	163.6	-96.7	0	0	0	111.9	L78 V99 I102 L103 L106 L135 N136 D137 K142 K143	L78-F139 HydrophobicContact CD1-CB 4.45Å; L78-F139 HydrophobicContact CD2-CD2 4.35Å; V99-F139 HydrophobicContact CG1-CE2 4.04Å; V99-F139 HydrophobicContact CG1-CZ 3.84Å; I102-F139 HydrophobicContact CB-CD2 4.06Å; I102-F139 HydrophobicContact CB-CE2 3.97Å; I102-F139 HydrophobicContact CG2-CD2 3.33Å; I102-F139 HydrophobicContact CG2-CE2 3.74Å; I102-F139 HydrophobicContact CG2-CG 4.17Å; L103-F139 HydrophobicContact CD1-CE1 4.5Å; L103-F139 HydrophobicContact CD1-CZ 3.96Å; L103-F139 HydrophobicContact CD2-CD1 4.12Å; L103-F139 HydrophobicContact CD2-CE1 3.21Å; L103-F139 HydrophobicContact CD2-CE2 4.36Å; L103-F139 HydrophobicContact CD2-CZ 3.36Å; L103-F139 HydrophobicContact CG-CE1 3.81Å; L103-F139 HydrophobicContact CG-CE2 4.11Å; L103-F139 HydrophobicContact CG-CZ 3.34Å; L106-F139 HydrophobicContact CD1-CB 3.8Å; L106-F139 HydrophobicContact CD1-CD1 3.89Å; L106-F139 HydrophobicContact CD1-CD2 4.28Å; L106-F139 HydrophobicContact CD1-CG 3.68Å; L135-F139 WeakPolarHBondContact O-CB 3.44Å; L135-F139 PolarHBondContact O-N 3.41Å; N136-F139 WeakPolarHBondContact O-CB 3.32Å; N136-F139 PolarHBondContact O-N 3.18Å; D137-F139 VanDerWaalsContact C-N 3.31Å; D137-F139 PolarHBondContact O-N 2.95Å; F139-K142 PolarHBondContact O-N 2.94Å; F139-K143 HydrophobicContact CE1-CB 4.47Å; F139-K143 HydrophobicContact CE1-CD 4.07Å; F139-K143 HydrophobicContact CE2-CB 4.5Å; F139-K143 HydrophobicContact CZ-CB 4.22Å; F139-K143 HydrophobicContact CZ-CD 3.98Å; F139-K143 HydrophobicContact CZ-CG 4.49Å; F139-K143 WeakPolarHBondContact O-CB 3.44Å; F139-K143 PolarHBondContact O-N 3.48Å
140	Q	92.4	Very high	86.7	Confident	78 Å²	78	72.2 Å²	72.2	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-40.9	177.2	-66	-58	-26.2	0	0	111.8	N136 D137 L138 K143 T144	N136-Q140 WeakPolarHBondContact O-CG 3.42Å; N136-Q140 PolarHBondContact O-N 3Å; D137-Q140 PolarHBondContact O-N 3.48Å; D137-Q140 VanDerWaalsContact O-N 3.16Å; L138-Q140 PolarHBondContact O-N 2.83Å; Q140-K143 PolarHBondContact O-N 3.4Å; Q140-T144 WeakPolarHBondContact O-CG2 3.42Å; Q140-T144 PolarHBondContact O-N 2.9Å; Q140-T144 VanDerWaalsContact O-N 3.11Å
141	E	91.3	Very high	85.2	Confident	116 Å²	116	76.8 Å²	76.8	54%	0.542	38%	0.383	S	S	.	.	H	α-helix	trans	-56.7	-54.8	173.2	-175.4	-172.6	158.5	0	0	110.6	D137 L138 K143 T144 E145	D137-E141 PolarHBondContact O-N 3.4Å; L138-E141 PolarHBondContact O-N 2.87Å; E141-K143 VanDerWaalsContact C-N 3.32Å; E141-K143 PolarHBondContact O-N 3.41Å; E141-T144 PolarHBondContact O-N 3.21Å; E141-T144 VanDerWaalsContact O-N 3.09Å; E141-T144 PolarHBondContact O-OG1 2.91Å; E141-E145 PolarHBondContact O-N 2.82Å; E141-E145 VanDerWaalsContact O-N 3.16Å
142	K	87.9	Confident	83.2	Confident	36 Å²	36	84.5 Å²	84.5	16%	0.157	42%	0.417	C	S	.	.	H	α-helix	trans	-65.1	-32.4	179.7	-65.1	-55.7	-179.5	-175.6	0	113.5	L78 L138 F139 T144 E145 L146	L78-K142 HydrophobicContact CB-CG 4.47Å; L78-K142 HydrophobicContact CD2-CB 4.17Å; L138-K142 HydrophobicContact CD1-CG 4.3Å; L138-K142 WeakPolarHBondContact O-CG 3.37Å; L138-K142 PolarHBondContact O-N 3.2Å; F139-K142 PolarHBondContact O-N 2.94Å; K142-T144 VanDerWaalsContact C-N 3.33Å; K142-T144 PolarHBondContact O-N 3.39Å; K142-E145 VanDerWaalsContact CD-OE2 3.25Å; K142-E145 WeakPolarHBondContact CD-OE2 3.39Å; K142-E145 IonicContact NZ-OE2 3.69Å; K142-E145 PolarHBondContact NZ-OE2 2.85Å; K142-E145 PolarHBondContact O-N 3.34Å; K142-L146 WeakPolarHBondContact O-CB 3.28Å; K142-L146 VanDerWaalsContact O-CG 3.23Å; K142-L146 WeakPolarHBondContact O-CG 3.4Å; K142-L146 PolarHBondContact O-N 3.45Å
143	K	90.4	Very high	81	Confident	70 Å²	70	87.4 Å²	87.4	30%	0.304	45%	0.448	S	S	.	.	H	α-helix	trans	-60.1	-43.4	172	177.9	-179.4	176.2	176.5	0	111.3	V99 F139 Q140 E141 E145 L147	V99-K143 HydrophobicContact CG1-CD 4.27Å; V99-K143 HydrophobicContact CG1-CG 4.12Å; F139-K143 HydrophobicContact CE1-CB 4.47Å; F139-K143 HydrophobicContact CE1-CD 4.07Å; F139-K143 HydrophobicContact CE2-CB 4.5Å; F139-K143 HydrophobicContact CZ-CB 4.22Å; F139-K143 HydrophobicContact CZ-CD 3.98Å; F139-K143 HydrophobicContact CZ-CG 4.49Å; F139-K143 WeakPolarHBondContact O-CB 3.44Å; F139-K143 PolarHBondContact O-N 3.48Å; Q140-K143 PolarHBondContact O-N 3.4Å; E141-K143 VanDerWaalsContact C-N 3.32Å; E141-K143 PolarHBondContact O-N 3.41Å; K143-E145 VanDerWaalsContact C-N 3.31Å; K143-E145 PolarHBondContact O-N 3.17Å; K143-L147 CarbonylContact O-C 3.53Å; K143-L147 WeakPolarHBondContact O-CA 3.3Å; K143-L147 PolarHBondContact O-N 3.38Å
144	T	86.6	Confident	78.5	Confident	79 Å²	79	90.6 Å²	90.6	49%	0.485	46%	0.462	S	S	.	.	H	α-helix	trans	-69.8	-28.2	177.9	61.9	0	0	0	0	113.4	Q140 E141 K142 L147 P148	Q140-T144 WeakPolarHBondContact O-CG2 3.42Å; Q140-T144 PolarHBondContact O-N 2.9Å; Q140-T144 VanDerWaalsContact O-N 3.11Å; E141-T144 PolarHBondContact O-N 3.21Å; E141-T144 VanDerWaalsContact O-N 3.09Å; E141-T144 PolarHBondContact O-OG1 2.91Å; K142-T144 VanDerWaalsContact C-N 3.33Å; K142-T144 PolarHBondContact O-N 3.39Å; T144-L147 CarbonylContact O-C 3.58Å; T144-P148 VanDerWaalsContact O-CA 3.27Å; T144-P148 WeakPolarHBondContact O-CA 3.36Å
145	E	84.8	Confident	76	Confident	99 Å²	99	92 Å²	92	46%	0.463	47%	0.472	S	S	.	.	H	α-helix	trans	-73.9	-45.7	174.5	-170.9	177.1	177.8	0	0	111.7	T82 E141 K142 K143	T82-E145 VanDerWaalsContact CG2-OE1 3.22Å; T82-E145 WeakPolarHBondContact CG2-OE1 3.4Å; E141-E145 PolarHBondContact O-N 2.82Å; E141-E145 VanDerWaalsContact O-N 3.16Å; K142-E145 VanDerWaalsContact CD-OE2 3.25Å; K142-E145 WeakPolarHBondContact CD-OE2 3.39Å; K142-E145 IonicContact NZ-OE2 3.69Å; K142-E145 PolarHBondContact NZ-OE2 2.85Å; K142-E145 PolarHBondContact O-N 3.34Å; K143-E145 VanDerWaalsContact C-N 3.31Å; K143-E145 PolarHBondContact O-N 3.17Å
146	L	83.4	Confident	73.1	Confident	2 Å²	2	97.3 Å²	97.3	1%	0.01	51%	0.508	C	S	.	.	H	α-helix	trans	-73.1	-37	-179.4	-67.1	172.6	0	0	0	112.7	M81 V85 F98 V99 K142	M81-L146 HydrophobicContact CG-CD1 4.06Å; M81-L146 HydrophobicContact CG-CD2 3.85Å; V85-L146 HydrophobicContact CB-CD2 4.13Å; V85-L146 HydrophobicContact CG2-CD2 3.64Å; F98-L146 HydrophobicContact CD1-CD1 4.15Å; F98-L146 HydrophobicContact CE1-CD1 4.12Å; V99-L146 HydrophobicContact CG2-CD1 4.24Å; K142-L146 WeakPolarHBondContact O-CB 3.28Å; K142-L146 VanDerWaalsContact O-CG 3.23Å; K142-L146 WeakPolarHBondContact O-CG 3.4Å; K142-L146 PolarHBondContact O-N 3.45Å
147	L	84.3	Confident	70.3	Confident	40 Å²	40	102.9 Å²	102.9	21%	0.209	53%	0.533	C	S	.	.	S	Bend	trans	-128.7	79.3	179.9	-64.6	174.5	0	0	0	109.2	I92 R95 V99 K143 T144 N149	I92-L147 HydrophobicContact CG2-CD2 4.26Å; R95-L147 HydrophobicContact CB-CD2 4.16Å; V99-L147 HydrophobicContact CB-CD1 4.37Å; V99-L147 HydrophobicContact CG1-CD1 4.5Å; V99-L147 HydrophobicContact CG2-CD1 4.06Å; K143-L147 CarbonylContact O-C 3.53Å; K143-L147 WeakPolarHBondContact O-CA 3.3Å; K143-L147 PolarHBondContact O-N 3.38Å; T144-L147 CarbonylContact O-C 3.58Å; L147-N149 PolarHBondContact O-N 3.2Å
148	P	78.9	Confident	67.2	Low	96 Å²	96	107.8 Å²	107.8	62%	0.623	55%	0.553	S	S	*	*			trans	-62.2	113.2	176.5	24	-32.7	0	0	0	109.6	T144 K150	T144-P148 VanDerWaalsContact O-CA 3.27Å; T144-P148 WeakPolarHBondContact O-CA 3.36Å; P148-K150 PolarHBondContact O-N 3.34Å
149	N	66.7	Low	64.2	Low	132 Å²	132	111.5 Å²	111.5	71%	0.706	58%	0.578	S	S	*	*			trans	-61.7	126.6	172.1	-72.8	-43.6	0	0	0	108.8	L147 K151	L147-N149 PolarHBondContact O-N 3.2Å; N149-K151 PolarHBondContact O-N 3.41Å
150	K	57.1	Low	61.1	Low	198 Å²	198	117.8 Å²	117.8	86%	0.861	62%	0.616	S	S	*	*			trans	-61.4	104.6	170.4	-65.2	-173.8	179.8	-178.8	0	108	P148 F152	P148-K150 PolarHBondContact O-N 3.34Å; K150-F152 PolarHBondContact O-N 3.27Å; K150-F152 VanDerWaalsContact O-N 3.09Å
151	K	55.2	Low	58.1	Low	202 Å²	202	124 Å²	124	88%	0.878	64%	0.642	S	S	*	*			trans	-58.9	117.4	162.7	-71.7	-173.3	178.1	178.7	0	106	N149 G153	N149-K151 PolarHBondContact O-N 3.41Å; K151-G153 PolarHBondContact O-N 2.9Å
152	F	49.5	Very low	55.2	Low	199 Å²	199	128.2 Å²	128.2	87%	0.873	66%	0.659	S	S	*	*			trans	-43.9	100.2	178.4	-84.7	-103.2	0	0	0	110.5	K150 F154	K150-F152 PolarHBondContact O-N 3.27Å; K150-F152 VanDerWaalsContact O-N 3.09Å; F152-F154 PolarHBondContact O-N 3.09Å
153	G	43.7	Very low	52.3	Low	69 Å²	69	136.2 Å²	136.2	71%	0.711	70%	0.697	S	S	*	*			trans	-80.3	113.2	166.7	0	0	0	0	0	107.4	K151 S155	K151-G153 PolarHBondContact O-N 2.9Å; G153-S155 PolarHBondContact O-N 3.41Å
154	F	40.4	Very low	49.4	Very low	202 Å²	202	136.5 Å²	136.5	89%	0.886	72%	0.72	S	S	*	*			trans	-61.1	87.3	165.9	-70.5	-89.6	0	0	0	108.6	F152 C156	F152-F154 PolarHBondContact O-N 3.09Å; F154-C156 PolarHBondContact O-N 3.09Å; F154-C156 VanDerWaalsContact O-N 3.13Å
155	S	39.1	Very low	46.4	Very low	107 Å²	107	140.1 Å²	140.1	75%	0.748	74%	0.736	S	S	*	*			trans	-74.9	100.8	169.9	-172.5	0	0	0	0	107.4	G153 Q157	G153-S155 PolarHBondContact O-N 3.41Å; S155-Q157 PolarHBondContact O-N 3.31Å
156	C	31.7	Very low	43.8	Very low	116 Å²	116	140.8 Å²	140.8	78%	0.784	75%	0.747	S	S	*	*			trans	-56.7	105.2	163.8	-78.3	0	0	0	0	107.5	F154 Q158	F154-C156 PolarHBondContact O-N 3.09Å; F154-C156 VanDerWaalsContact O-N 3.13Å; C156-Q158 PolarHBondContact O-N 3.5Å
157	Q	34.2	Very low	41.1	Very low	178 Å²	178	147.3 Å²	147.3	83%	0.832	78%	0.781	S	S	*	*			trans	-57.7	107.3	169	-81.8	175.4	-20.4	0	0	107.6	S155 T159	S155-Q157 PolarHBondContact O-N 3.31Å; Q157-T159 VanDerWaalsContact C-N 3.28Å; Q157-T159 PolarHBondContact O-N 2.85Å
158	Q	28.1	Very low	38.6	Very low	189 Å²	189	155.6 Å²	155.6	88%	0.883	82%	0.816	S	S	*	*			trans	-61.4	95.2	168.1	-77.2	176.8	-2.9	0	0	107.4	C156 T160	C156-Q158 PolarHBondContact O-N 3.5Å; Q158-T160 PolarHBondContact O-N 2.8Å
159	T	28.9	Very low	36	Very low	131 Å²	131	156 Å²	156	80%	0.804	82%	0.821	S	S	*	*			trans	-63.9	122.6	163.2	45.3	0	0	0	0	107.2	Q157 K161	Q157-T159 VanDerWaalsContact C-N 3.28Å; Q157-T159 PolarHBondContact O-N 2.85Å; T159-K161 PolarHBondContact O-N 3.25Å
160	T	28.1	Very low	34.3	Very low	134 Å²	134	158.6 Å²	158.6	82%	0.822	83%	0.829	S	S	*	*			trans	-56.1	126	-177.1	35.9	0	0	0	0	110.5	Q158 K162	Q158-T160 PolarHBondContact O-N 2.8Å; T160-K162 PolarHBondContact O-N 3.05Å
161	K	30	Very low	32.6	Very low	209 Å²	209	154.4 Å²	154.4	91%	0.909	82%	0.823	S	S	*	*			trans	-48.8	107.5	168.8	-74.4	173.5	174.1	175.4	0	110	T159	T159-K161 PolarHBondContact O-N 3.25Å
162	K	30.3	Very low	31.2	Very low	205 Å²	205	155.3 Å²	155.3	89%	0.891	82%	0.823	S	S	*	*			trans	-111.6	114.8	149.7	-93.3	-172.2	175.2	-178.5	0	107.9	T160 G164	T160-K162 PolarHBondContact O-N 3.05Å; K162-G164 PolarHBondContact O-N 2.69Å
163	Q	27.1	Very low	30.7	Very low	204 Å²	204	151.9 Å²	151.9	95%	0.953	82%	0.82	S	S	*	*			trans	-52.8	114.6	175	-75.3	157.8	-28.8	0	0	110.1
164	G	29.3	Very low	29.9	Very low	76 Å²	76	156.8 Å²	156.8	78%	0.784	83%	0.825	S	S	*	*			trans	-127.1	101.6	166.7	0	0	0	0	0	107.2	K162	K162-G164 PolarHBondContact O-N 2.69Å
165	N	24	Very low	29.5	Very low	154 Å²	154	152.7 Å²	152.7	82%	0.824	82%	0.821	S	S	*	*			trans	-66	169.5	178.1	-158.1	2.5	0	0	0	110.7
166	V	30.9	Very low	29.5	Very low	114 Å²	114	153.1 Å²	153.1	69%	0.691	82%	0.824	S	S	*	*			trans	106.6	92.5	166.5	-169.4	0	0	0	0	116
167	N	25.7	Very low	29.4	Very low	138 Å²	138	153.2 Å²	153.2	74%	0.738	83%	0.826	S	S	*	*				45.2	115.4	128.8	-55.7	-15.7	0	0	0	119
168	K	32.1	Very low	29	Very low	215 Å²	215	150.1 Å²	150.1	94%	0.935	82%	0.823	S	S	*	*				-159.8	133.7	125.4	-106.8	164.4	-173.4	-173.3	0	111.3
169	S	25.1	Very low	29.1	Very low	105 Å²	105	148.3 Å²	148.3	73%	0.734	82%	0.819	S	S	*	*			trans	-67.1	172.6	178.1	177	0	0	0	0	112.3
170	E	30	Very low	29.3	Very low	186 Å²	186	147.6 Å²	147.6	87%	0.869	82%	0.815	S	S	*	*			trans	96.2	135.5	168.1	-57.8	160.1	-166.2	0	0	114.7
171	C	20.4	Very low	29.6	Very low	110 Å²	110	146.3 Å²	146.3	74%	0.743	81%	0.812	S	S	*	*			cis	-175.8	127.8	-20.7	176.2	0	0	0	0	102.8
172	Y	25.9	Very low	29.6	Very low	221 Å²	221	141.5 Å²	141.5	87%	0.867	80%	0.804	S	S	*	*			trans	-80.8	140.5	175.1	-70.4	-97.8	0	0	0	110.3
173	P	39.9	Very low	29.8	Very low	126 Å²	126	139.3 Å²	139.3	82%	0.818	80%	0.8	S	S	*	*			trans	-110.3	115.4	140.9	19.4	-2.3	0	0	0	108.9
174	E	27.6	Very low	30.1	Very low	173 Å²	173	135.4 Å²	135.4	81%	0.808	79%	0.79	S	S	*	*			trans	-67.4	165	161.3	-74	178.9	145	0	0	111.3
175	S	31.3	Very low	30.2	Very low	115 Å²	115	135 Å²	135	80%	0.804	78%	0.779	S	S	*	*			trans	85.9	109.9	161.6	79.6	0	0	0	0	116.9
176	S	39	Very low	30.6	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	78%	0.778	S	S	*	*				177.2	111.6	90	54.7	0	0	0	0	109.5	C178	S176-C178 PolarHBondContact O-N 2.67Å
177	S	29.5	Very low	30.9	Very low	118 Å²	118	135.3 Å²	135.3	83%	0.825	78%	0.784	S	S	*	*			trans	-65.6	117.2	173.2	-49.6	0	0	0	0	110.3
178	C	26.8	Very low	31.7	Very low	112 Å²	112	135.7 Å²	135.7	76%	0.757	79%	0.786	S	S	*	*			trans	-103	99	166.5	-168.2	0	0	0	0	108.5	S176 T180	S176-C178 PolarHBondContact O-N 2.67Å; C178-T180 PolarHBondContact O-N 2.84Å
179	N	30.1	Very low	32.4	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	78%	0.778	S	S	*	*			trans	-79.9	109.2	163.9	-68.8	-16.5	0	0	0	107.1
180	T	31.9	Very low	33.4	Very low	115 Å²	115	134.3 Å²	134.3	71%	0.706	78%	0.78	S	S	*	*			trans	-133.6	115.5	156.7	-60.5	0	0	0	0	107.8	C178 S182	C178-T180 PolarHBondContact O-N 2.84Å; T180-S182 PolarHBondContact O-N 2.7Å
181	S	34.1	Very low	34.8	Very low	108 Å²	108	130 Å²	130	76%	0.755	77%	0.771	S	S	*	*			trans	-37.8	115	-174.2	-51.1	0	0	0	0	114	I183	S181-I183 PolarHBondContact O-N 2.92Å
182	S	30.1	Very low	36.9	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	76%	0.756	S	S	*	*			trans	-62.5	95.7	161.3	-46.1	0	0	0	0	108.5	T180 V184	T180-S182 PolarHBondContact O-N 2.7Å; S182-V184 PolarHBondContact O-N 3Å
183	I	34.3	Very low	39.5	Very low	159 Å²	159	125.2 Å²	125.2	82%	0.815	75%	0.754	S	S	*	*			trans	-68.1	88.7	160.8	-62.8	171.4	0	0	0	105.3	S181 A185	S181-I183 PolarHBondContact O-N 2.92Å; I183-A185 VanDerWaalsContact C-N 3.32Å; I183-A185 PolarHBondContact O-N 2.71Å
184	V	34.2	Very low	41.7	Very low	123 Å²	123	122 Å²	122	75%	0.745	73%	0.726	S	S	*	*			trans	-71.6	96.9	168	179	0	0	0	0	105.8	S182 P186	S182-V184 PolarHBondContact O-N 3Å; V184-P186 VanDerWaalsContact O-CD 3.31Å; V184-P186 WeakPolarHBondContact O-CD 3.2Å
185	A	30.8	Very low	44.6	Very low	66 Å²	66	116.1 Å²	116.1	55%	0.545	70%	0.7	S	S	.	*			trans	-62.4	120.5	168.6	0	0	0	0	0	108.7	I183 N187	I183-A185 VanDerWaalsContact C-N 3.32Å; I183-A185 PolarHBondContact O-N 2.71Å; A185-N187 PolarHBondContact O-N 3.09Å
186	P	34	Very low	47.3	Very low	124 Å²	124	118.6 Å²	118.6	81%	0.805	70%	0.698	S	S	*	*			trans	-74.5	111.7	163.5	-1.8	20.3	0	0	0	106.7	V184	V184-P186 VanDerWaalsContact O-CD 3.31Å; V184-P186 WeakPolarHBondContact O-CD 3.2Å
187	N	36.4	Very low	49.6	Very low	152 Å²	152	116 Å²	116	81%	0.813	67%	0.671	S	S	*	*			trans	-61	139.3	170.3	-73.3	-30.3	0	0	0	109.8	A185	A185-N187 PolarHBondContact O-N 3.09Å
188	N	42.4	Very low	52.6	Low	145 Å²	145	110.6 Å²	110.6	78%	0.775	63%	0.632	S	S	*	*			trans	86	65.1	155.2	-142.8	27.9	0	0	0	117.9
189	N	47.6	Very low	55.8	Low	143 Å²	143	105.7 Å²	105.7	77%	0.765	60%	0.599	S	S	*	*			trans	-111.2	90.5	157.9	-81.5	-9.6	0	0	0	109	S191	N189-S191 PolarHBondContact O-N 3.13Å; N189-S191 PolarHBondContact O-OG 2.89Å
190	D	45.7	Very low	59	Low	148 Å²	148	99.6 Å²	99.6	79%	0.791	57%	0.567	S	S	*	*			trans	-56.1	94.4	148.9	-86.1	-30	0	0	0	105.9	V192	D190-V192 PolarHBondContact O-N 2.73Å
191	S	58.2	Low	62	Low	96 Å²	96	97.2 Å²	97.2	67%	0.671	55%	0.549	S	S	*	.			trans	-76.8	76.2	-175	-61.5	0	0	0	0	107.5	N189 I193	N189-S191 PolarHBondContact O-N 3.13Å; N189-S191 PolarHBondContact O-OG 2.89Å; S191-I193 PolarHBondContact O-N 3.44Å; S191-I193 VanDerWaalsContact O-N 3.11Å
192	V	66	Low	64.9	Low	72 Å²	72	98 Å²	98	44%	0.436	55%	0.545	S	S	.	.			trans	-61.9	112.6	166	-177.8	0	0	0	0	106	D190 Y194	D190-V192 PolarHBondContact O-N 2.73Å; V192-Y194 HydrophobicContact CB-CE1 4.18Å; V192-Y194 HydrophobicContact CB-CE2 3.91Å; V192-Y194 HydrophobicContact CG1-CD1 3.98Å; V192-Y194 HydrophobicContact CG1-CD2 4.47Å; V192-Y194 HydrophobicContact CG1-CE1 3.41Å; V192-Y194 VanDerWaalsContact CG1-CE1 3.41Å; V192-Y194 HydrophobicContact CG1-CE2 4Å; V192-Y194 HydrophobicContact CG1-CG 4.49Å; V192-Y194 VanDerWaalsContact CG1-CZ 3.44Å; V192-Y194 WeakPolarHBondContact O-CD2 3.27Å; V192-Y194 VanDerWaalsContact O-CE2 3.23Å; V192-Y194 WeakPolarHBondContact O-CE2 3.13Å
193	I	78.9	Confident	68.1	Low	158 Å²	158	94.3 Å²	94.3	81%	0.81	52%	0.516	S	S	*	.			trans	-81.8	120	176	-60.5	173.2	0	0	0	106.8	S191	S191-I193 PolarHBondContact O-N 3.44Å; S191-I193 VanDerWaalsContact O-N 3.11Å
194	Y	86.4	Confident	71.1	Confident	60 Å²	60	91 Å²	91	24%	0.235	50%	0.503	C	S	.	.			trans	-101.9	136.9	178	-57.1	-80.1	0	0	0	109.6	V192 E196 I201 Y227 I229	V192-Y194 HydrophobicContact CB-CE1 4.18Å; V192-Y194 HydrophobicContact CB-CE2 3.91Å; V192-Y194 HydrophobicContact CG1-CD1 3.98Å; V192-Y194 HydrophobicContact CG1-CD2 4.47Å; V192-Y194 HydrophobicContact CG1-CE1 3.41Å; V192-Y194 VanDerWaalsContact CG1-CE1 3.41Å; V192-Y194 HydrophobicContact CG1-CE2 4Å; V192-Y194 HydrophobicContact CG1-CG 4.49Å; V192-Y194 VanDerWaalsContact CG1-CZ 3.44Å; V192-Y194 WeakPolarHBondContact O-CD2 3.27Å; V192-Y194 VanDerWaalsContact O-CE2 3.23Å; V192-Y194 WeakPolarHBondContact O-CE2 3.13Å; Y194-E196 PolarHBondContact O-N 2.67Å; Y194-I201 HydrophobicContact CD1-CD1 4.14Å; Y194-I201 HydrophobicContact CD2-CD1 3.05Å; Y194-I201 HydrophobicContact CD2-CG1 4.44Å; Y194-I201 HydrophobicContact CE2-CD1 3.55Å; Y194-I201 HydrophobicContact CG-CD1 3.38Å; Y194-Y227 AromaticContact CD1-CD1 3.94Å; Y194-Y227 HydrophobicContact CD1-CD1 3.94Å; Y194-Y227 AromaticContact CD1-CD2 3.57Å; Y194-Y227 HydrophobicContact CD1-CD2 3.57Å; Y194-Y227 HydrophobicContact CD1-CE1 4.45Å; Y194-Y227 HydrophobicContact CD1-CE2 4.14Å; Y194-Y227 AromaticContact CD1-CG 3.44Å; Y194-Y227 HydrophobicContact CD1-CG 3.44Å; Y194-Y227 VanDerWaalsContact CD1-CG 3.44Å; Y194-Y227 AromaticContact CE1-CD1 3.54Å; Y194-Y227 HydrophobicContact CE1-CD1 3.54Å; Y194-Y227 HydrophobicContact CE1-CD2 4.04Å; Y194-Y227 AromaticContact CE1-CE1 3.96Å; Y194-Y227 HydrophobicContact CE1-CE1 3.96Å; Y194-Y227 HydrophobicContact CE1-CE2 4.43Å; Y194-Y227 AromaticContact CE1-CG 3.56Å; Y194-Y227 HydrophobicContact CE1-CG 3.56Å; Y194-I229 HydrophobicContact CD1-CD1 4.5Å; Y194-I229 HydrophobicContact CE1-CD1 3.55Å; Y194-I229 HydrophobicContact CE2-CD1 4.44Å; Y194-I229 VanDerWaalsContact OH-CD1 3.25Å; Y194-I229 WeakPolarHBondContact OH-CD1 3.35Å
195	D	88.5	Confident	73.8	Confident	48 Å²	48	86 Å²	86	26%	0.257	48%	0.477	S	S	.	.			trans	-80.6	110.7	174.7	-171.3	-30.7	0	0	0	109.2	R197 F198 S199	D195-R197 PolarHBondContact O-N 3.06Å; D195-R197 VanDerWaalsContact O-N 3.08Å; D195-R197 WeakPolarHBondContact OD1-CB 3.23Å; D195-R197 WeakPolarHBondContact OD1-CG 3.16Å; D195-R197 PolarHBondContact OD1-N 3.11Å; D195-R197 IonicContact OD1-NE 2.72Å; D195-R197 PolarHBondContact OD1-NE 2.9Å; D195-R197 IonicContact OD2-CZ 2.98Å; D195-R197 VanDerWaalsContact OD2-CZ 3.25Å; D195-R197 IonicContact OD2-NE 3.74Å; D195-R197 PolarHBondContact OD2-NE 3.24Å; D195-R197 IonicContact OD2-NH2 3.01Å; D195-R197 PolarHBondContact OD2-NH2 2.91Å; D195-F198 HydrophobicContact CB-CD1 4.44Å; D195-F198 HydrophobicContact CB-CD2 4.33Å; D195-F198 HydrophobicContact CB-CE1 3.77Å; D195-F198 HydrophobicContact CB-CE2 3.63Å; D195-F198 HydrophobicContact CB-CZ 3.31Å; D195-F198 VanDerWaalsContact CG-CZ 3.46Å; D195-F198 PolarHBondContact O-N 2.99Å; D195-F198 VanDerWaalsContact O-N 3.16Å; D195-F198 WeakPolarHBondContact OD2-CE1 3.29Å; D195-F198 WeakPolarHBondContact OD2-CZ 3.37Å; D195-S199 WeakPolarHBondContact O-CB 3.26Å; D195-S199 PolarHBondContact O-N 3.05Å; D195-S199 PolarHBondContact O-OG 3.11Å
196	E	87.5	Confident	76.8	Confident	167 Å²	167	88.9 Å²	88.9	78%	0.78	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.1	-177.5	-60.4	-178.2	172.6	0	0	113.4	Y194 F198	Y194-E196 PolarHBondContact O-N 2.67Å; E196-F198 PolarHBondContact O-N 3.21Å
197	R	88.8	Confident	79.7	Confident	62 Å²	62	87.1 Å²	87.1	23%	0.234	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.2	177.3	-59.4	-179.3	-64.9	164.4	-0.4	112.3	D195 P212 N213 I214 D219	D195-R197 PolarHBondContact O-N 3.06Å; D195-R197 VanDerWaalsContact O-N 3.08Å; D195-R197 WeakPolarHBondContact OD1-CB 3.23Å; D195-R197 WeakPolarHBondContact OD1-CG 3.16Å; D195-R197 PolarHBondContact OD1-N 3.11Å; D195-R197 IonicContact OD1-NE 2.72Å; D195-R197 PolarHBondContact OD1-NE 2.9Å; D195-R197 IonicContact OD2-CZ 2.98Å; D195-R197 VanDerWaalsContact OD2-CZ 3.25Å; D195-R197 IonicContact OD2-NE 3.74Å; D195-R197 PolarHBondContact OD2-NE 3.24Å; D195-R197 IonicContact OD2-NH2 3.01Å; D195-R197 PolarHBondContact OD2-NH2 2.91Å; R197-P212 CarbonylContact O-C 3.53Å; R197-P212 WeakPolarHBondContact O-CA 3.15Å; R197-N213 PolarHBondContact O-N 3.08Å; R197-I214 HydrophobicContact CB-CD1 4.5Å; R197-I214 HydrophobicContact CG-CD1 3.73Å; R197-D219 IonicContact CZ-OD2 2.78Å; R197-D219 IonicContact NH1-OD2 2.72Å; R197-D219 PolarHBondContact NH1-OD2 3.1Å; R197-D219 IonicContact NH2-OD2 3.05Å
198	F	91.8	Very high	82.5	Confident	5 Å²	5	84.7 Å²	84.7	2%	0.022	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-146.2	19.5	-175.1	52	-102.4	0	0	0	113.6	D195 E196 I211 Q224 T225 V226 F242	D195-F198 HydrophobicContact CB-CD1 4.44Å; D195-F198 HydrophobicContact CB-CD2 4.33Å; D195-F198 HydrophobicContact CB-CE1 3.77Å; D195-F198 HydrophobicContact CB-CE2 3.63Å; D195-F198 HydrophobicContact CB-CZ 3.31Å; D195-F198 VanDerWaalsContact CG-CZ 3.46Å; D195-F198 PolarHBondContact O-N 2.99Å; D195-F198 VanDerWaalsContact O-N 3.16Å; D195-F198 WeakPolarHBondContact OD2-CE1 3.29Å; D195-F198 WeakPolarHBondContact OD2-CZ 3.37Å; E196-F198 PolarHBondContact O-N 3.21Å; F198-I211 HydrophobicContact CB-CG2 3.73Å; F198-Q224 HydrophobicContact CE1-CB 4.17Å; F198-Q224 HydrophobicContact CE1-CG 4.16Å; F198-Q224 HydrophobicContact CE2-CB 3.96Å; F198-Q224 HydrophobicContact CZ-CB 3.69Å; F198-Q224 HydrophobicContact CZ-CG 3.93Å; F198-T225 WeakPolarHBondContact CD2-O 3.34Å; F198-T225 WeakPolarHBondContact CE2-O 3.36Å; F198-V226 HydrophobicContact CB-CG2 4.38Å; F198-V226 VanDerWaalsContact O-CG1 3.3Å; F198-V226 WeakPolarHBondContact O-CG1 3.25Å; F198-F242 HydrophobicContact CB-CE1 3.72Å; F198-F242 HydrophobicContact CB-CZ 3.79Å; F198-F242 HydrophobicContact CD1-CE1 4.12Å; F198-F242 HydrophobicContact CD2-CE1 4.31Å; F198-F242 AromaticContact CG-CE1 3.79Å; F198-F242 HydrophobicContact CG-CE1 3.79Å; F198-F242 HydrophobicContact CG-CZ 4.36Å
199	S	94.3	Very high	85	Confident	9 Å²	9	80 Å²	80	6%	0.063	43%	0.428	C	S	.	.			trans	-128.7	141.9	175	-54.1	0	0	0	0	110.5	D195 Y227	D195-S199 WeakPolarHBondContact O-CB 3.26Å; D195-S199 PolarHBondContact O-N 3.05Å; D195-S199 PolarHBondContact O-OG 3.11Å; S199-Y227 CarbonylContact C-O 3.58Å; S199-Y227 WeakPolarHBondContact CA-O 3.36Å; S199-Y227 WeakPolarHBondContact CB-O 3.23Å
200	L	96.1	Very high	87.2	Confident	24 Å²	24	76.7 Å²	76.7	13%	0.126	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.3	179.3	-61.6	176	0	0	0	109.2	I203 F209 I211 Y227 L228 I229 L231 I236	L200-I203 HydrophobicContact CB-CD1 3.97Å; L200-I203 HydrophobicContact CD2-CD1 3.88Å; L200-I203 HydrophobicContact CG-CD1 4.38Å; L200-F209 HydrophobicContact CD1-CB 3.73Å; L200-F209 HydrophobicContact CD1-CD1 4.32Å; L200-F209 HydrophobicContact CD1-CD2 3.85Å; L200-F209 HydrophobicContact CD1-CG 3.7Å; L200-F209 HydrophobicContact CD2-CD1 4.22Å; L200-F209 HydrophobicContact CD2-CG 4.43Å; L200-I211 HydrophobicContact CD1-CD1 3.96Å; L200-I211 HydrophobicContact CG-CD1 4.14Å; L200-Y227 PolarHBondContact N-O 3.43Å; L200-L228 HydrophobicContact CB-CD2 3.92Å; L200-L228 HydrophobicContact CD1-CD2 4.07Å; L200-L228 HydrophobicContact CG-CD2 4.14Å; L200-L228 WeakPolarHBondContact O-CA 3.25Å; L200-I229 PolarHBondContact O-N 2.84Å; L200-L231 HydrophobicContact CB-CD1 4.01Å; L200-L231 HydrophobicContact CB-CD2 4.07Å; L200-I236 HydrophobicContact CD1-CD1 4.18Å; L200-I236 HydrophobicContact CD1-CG1 4.21Å; L200-I236 HydrophobicContact CD1-CG2 4.23Å
201	I	95.4	Very high	89.5	Confident	66 Å²	66	69.8 Å²	69.8	34%	0.338	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.8	-173.6	-50.2	172.5	0	0	0	110.2	Y194 I203 I229	Y194-I201 HydrophobicContact CD1-CD1 4.14Å; Y194-I201 HydrophobicContact CD2-CD1 3.05Å; Y194-I201 HydrophobicContact CD2-CG1 4.44Å; Y194-I201 HydrophobicContact CE2-CD1 3.55Å; Y194-I201 HydrophobicContact CG-CD1 3.38Å; I201-I203 WeakPolarHBondContact O-CG1 3.41Å; I201-I203 PolarHBondContact O-N 3.13Å; I201-I229 CarbonylContact C-O 3.45Å; I201-I229 VanDerWaalsContact CA-O 3.23Å; I201-I229 WeakPolarHBondContact CA-O 3.4Å; I201-I229 HydrophobicContact CG1-CB 4.45Å; I201-I229 HydrophobicContact CG2-CB 4.32Å
202	N	96	Very high	91	Very high	124 Å²	124	66.5 Å²	66.5	66%	0.663	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.3	48.5	171.4	-98.2	23.7	0	0	0	113.3	I229 D230	N202-I229 PolarHBondContact N-O 3.21Å; N202-D230 VanDerWaalsContact CA-O 3.29Å; N202-D230 WeakPolarHBondContact CA-O 3.3Å; N202-D230 PolarHBondContact N-O 3.18Å; N202-D230 WeakPolarHBondContact OD1-CB 3.13Å
203	I	96.3	Very high	91.8	Very high	29 Å²	29	69.2 Å²	69.2	15%	0.149	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127	-179	-50.1	-174.5	0	0	0	110	L200 I201 F209 D230 L231 I232	L200-I203 HydrophobicContact CB-CD1 3.97Å; L200-I203 HydrophobicContact CD2-CD1 3.88Å; L200-I203 HydrophobicContact CG-CD1 4.38Å; I201-I203 WeakPolarHBondContact O-CG1 3.41Å; I201-I203 PolarHBondContact O-N 3.13Å; I203-F209 HydrophobicContact CD1-CE1 4.25Å; I203-F209 HydrophobicContact CD1-CE2 4Å; I203-F209 HydrophobicContact CD1-CZ 3.68Å; I203-F209 HydrophobicContact CG2-CE2 3.85Å; I203-F209 HydrophobicContact CG2-CZ 3.81Å; I203-D230 PolarHBondContact N-O 2.97Å; I203-D230 VanDerWaalsContact N-O 3.14Å; I203-L231 HydrophobicContact CB-CD2 3.75Å; I203-L231 HydrophobicContact CD1-CD2 4.37Å; I203-L231 HydrophobicContact CG1-CD2 3.89Å; I203-L231 CarbonylContact O-C 3.53Å; I203-L231 VanDerWaalsContact O-CA 3.31Å; I203-L231 WeakPolarHBondContact O-CA 3.34Å; I203-I232 PolarHBondContact O-N 3.05Å
204	T	97.4	Very high	91.5	Very high	89 Å²	89	65.8 Å²	65.8	55%	0.546	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.1	171.3	-58.6	0	0	0	0	109.5	Q207 I232	T204-Q207 PolarHBondContact O-NE2 3.3Å; T204-I232 HydrophobicContact CG2-CB 4.26Å; T204-I232 HydrophobicContact CG2-CG2 4.46Å
205	G	91.6	Very high	90.3	Very high	19 Å²	19	71.3 Å²	71.3	20%	0.196	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-167.1	-175.6	0	0	0	0	0	114.4	I232	G205-I232 WeakPolarHBondContact CA-O 3.32Å; G205-I232 PolarHBondContact N-O 2.78Å
206	P	93.4	Very high	88.8	Confident	126 Å²	126	70.9 Å²	70.9	82%	0.818	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-73.2	123	7.4	28.5	-34.2	0	0	0	113.2	D233	P206-D233 VanDerWaalsContact CA-O 3.32Å; P206-D233 WeakPolarHBondContact CA-O 3.31Å
207	Q	94	Very high	87.4	Confident	88 Å²	88	67.4 Å²	67.4	41%	0.411	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	150.6	177.2	-71.4	-175.9	74.5	0	0	111.2	T204 F209 C234 T235	T204-Q207 PolarHBondContact O-NE2 3.3Å; Q207-F209 HydrophobicContact CB-CD2 4.3Å; Q207-F209 HydrophobicContact CB-CE2 3.47Å; Q207-F209 VanDerWaalsContact CB-CE2 3.47Å; Q207-F209 HydrophobicContact CB-CZ 3.82Å; Q207-F209 HydrophobicContact CG-CE2 4.45Å; Q207-F209 HydrophobicContact CG-CZ 4.4Å; Q207-F209 VanDerWaalsContact OE1-CZ 3.26Å; Q207-C234 WeakPolarHBondContact O-CA 3.45Å; Q207-T235 PolarHBondContact O-N 2.83Å
208	H	95.2	Very high	85.9	Confident	100 Å²	100	70.5 Å²	70.5	46%	0.463	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.3	175.9	-179.3	-95.6	0	0	0	109.9	T235 E237	H208-T235 CarbonylContact C-O 3.57Å; H208-T235 VanDerWaalsContact CA-O 3.25Å; H208-T235 WeakPolarHBondContact CA-O 3.26Å; H208-E237 IonicContact CE1-OE1 3.92Å; H208-E237 PolarHBondContact CE1-OE1 3.49Å; H208-E237 IonicContact NE2-OE1 3.68Å; H208-E237 PolarHBondContact NE2-OE1 3.31Å
209	F	95.1	Very high	84.4	Confident	47 Å²	47	74 Å²	74	21%	0.206	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.8	-178	-63	-80.6	0	0	0	111.3	L200 I203 Q207 T235 I236 E237	L200-F209 HydrophobicContact CD1-CB 3.73Å; L200-F209 HydrophobicContact CD1-CD1 4.32Å; L200-F209 HydrophobicContact CD1-CD2 3.85Å; L200-F209 HydrophobicContact CD1-CG 3.7Å; L200-F209 HydrophobicContact CD2-CD1 4.22Å; L200-F209 HydrophobicContact CD2-CG 4.43Å; I203-F209 HydrophobicContact CD1-CE1 4.25Å; I203-F209 HydrophobicContact CD1-CE2 4Å; I203-F209 HydrophobicContact CD1-CZ 3.68Å; I203-F209 HydrophobicContact CG2-CE2 3.85Å; I203-F209 HydrophobicContact CG2-CZ 3.81Å; Q207-F209 HydrophobicContact CB-CD2 4.3Å; Q207-F209 HydrophobicContact CB-CE2 3.47Å; Q207-F209 VanDerWaalsContact CB-CE2 3.47Å; Q207-F209 HydrophobicContact CB-CZ 3.82Å; Q207-F209 HydrophobicContact CG-CE2 4.45Å; Q207-F209 HydrophobicContact CG-CZ 4.4Å; Q207-F209 VanDerWaalsContact OE1-CZ 3.26Å; F209-T235 PolarHBondContact N-O 2.66Å; F209-I236 HydrophobicContact CD2-CG1 4.48Å; F209-I236 WeakPolarHBondContact O-CA 3.39Å; F209-E237 PolarHBondContact O-N 2.93Å
210	I	94.7	Very high	83.7	Confident	73 Å²	73	77.3 Å²	77.3	37%	0.374	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.1	170.9	-59.4	175	0	0	0	107.8	P212 E237 R239	I210-P212 CarbonylContact O-C 3.59Å; I210-E237 CarbonylContact C-O 3.51Å; I210-E237 WeakPolarHBondContact CA-O 3.44Å; I210-E237 HydrophobicContact CG1-CB 4.49Å; I210-R239 HydrophobicContact CG2-CG 4.22Å
211	I	93.7	Very high	83.3	Confident	4 Å²	4	76.6 Å²	76.6	2%	0.021	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133	178.5	-69.2	175.6	0	0	0	108.7	F198 L200 V226 L228 I236 E237 I238 R239 F242	F198-I211 HydrophobicContact CB-CG2 3.73Å; L200-I211 HydrophobicContact CD1-CD1 3.96Å; L200-I211 HydrophobicContact CG-CD1 4.14Å; I211-V226 HydrophobicContact CD1-CG1 4.22Å; I211-V226 HydrophobicContact CG2-CG2 4.46Å; I211-L228 HydrophobicContact CD1-CD2 3.79Å; I211-I236 HydrophobicContact CD1-CG2 3.79Å; I211-I236 HydrophobicContact CG1-CG2 4.36Å; I211-E237 PolarHBondContact N-O 2.92Å; I211-I238 HydrophobicContact CB-CB 4.47Å; I211-I238 HydrophobicContact CB-CG1 4.06Å; I211-I238 HydrophobicContact CD1-CG1 4.19Å; I211-I238 HydrophobicContact CG2-CG1 4.31Å; I211-I238 HydrophobicContact CG2-CG2 4.19Å; I211-R239 PolarHBondContact O-N 3.34Å; I211-F242 HydrophobicContact CG2-CE2 3.95Å; I211-F242 HydrophobicContact CG2-CZ 3.89Å
212	P	89.7	Confident	82.9	Confident	26 Å²	26	76.6 Å²	76.6	17%	0.169	44%	0.44	C	S	.	.	S	Bend	cis	-72	152.3	-2.9	29.6	-34.6	0	0	0	113.6	R197 I210 I214 F221	R197-P212 CarbonylContact O-C 3.53Å; R197-P212 WeakPolarHBondContact O-CA 3.15Å; I210-P212 CarbonylContact O-C 3.59Å; P212-I214 PolarHBondContact O-N 3.34Å; P212-F221 HydrophobicContact CB-CE1 4.17Å; P212-F221 HydrophobicContact CB-CZ 4.27Å; P212-F221 HydrophobicContact CG-CE1 4.22Å; P212-F221 HydrophobicContact CG-CZ 3.93Å
213	N	83.9	Confident	82.6	Confident	129 Å²	129	74.4 Å²	74.4	69%	0.69	44%	0.435	S	S	*	.	S	Bend	trans	-74.6	0.6	-179.5	-169.3	13.6	0	0	0	113.5	R197	R197-N213 PolarHBondContact O-N 3.08Å
214	I	72.6	Confident	82.4	Confident	86 Å²	86	76.1 Å²	76.1	44%	0.441	44%	0.442	S	S	.	.	S	Bend	trans	-133.7	144.4	-174.8	-54	-177.8	0	0	0	108.7	R197 P212 C216	R197-I214 HydrophobicContact CB-CD1 4.5Å; R197-I214 HydrophobicContact CG-CD1 3.73Å; P212-I214 PolarHBondContact O-N 3.34Å; I214-C216 HydrophobicContact CB-CB 4.13Å; I214-C216 HydrophobicContact CG2-CB 3.91Å; I214-C216 PolarHBondContact O-N 3.34Å
215	N	60.9	Low	82.3	Confident	177 Å²	177	73.5 Å²	73.5	95%	0.947	43%	0.426	S	S	*	.			trans	-69.8	46.3	163.5	-67.9	-20	0	0	0	111.2	S217	N215-S217 PolarHBondContact O-N 2.81Å
216	C	56	Low	82.5	Confident	39 Å²	39	72.6 Å²	72.6	26%	0.264	42%	0.417	S	S	.	.			trans	-70.7	127.7	-169.4	-156.7	0	0	0	0	109.7	I214 F221	I214-C216 HydrophobicContact CB-CB 4.13Å; I214-C216 HydrophobicContact CG2-CB 3.91Å; I214-C216 PolarHBondContact O-N 3.34Å; C216-F221 HydrophobicContact CB-CZ 4.38Å
217	S	58.7	Low	82.7	Confident	94 Å²	94	69.5 Å²	69.5	66%	0.657	39%	0.389	S	S	*	.			trans	-66.2	127.8	179.4	56.5	0	0	0	0	111.5	N215 D219	N215-S217 PolarHBondContact O-N 2.81Å; S217-D219 PolarHBondContact O-N 3.14Å
218	S	57.1	Low	82.9	Confident	127 Å²	127	65.3 Å²	65.3	89%	0.888	37%	0.37	S	S	*	.	S	Bend	trans	48.1	9.4	153.6	-57.5	0	0	0	0	120.6	S220	S218-S220 PolarHBondContact O-N 2.79Å
219	D	60.5	Low	83.1	Confident	78 Å²	78	60.8 Å²	60.8	42%	0.417	35%	0.349	S	S	.	.			trans	-62.7	134.6	167.9	-82.5	-13.3	0	0	0	109	R197 S217 F221	R197-D219 IonicContact CZ-OD2 2.78Å; R197-D219 IonicContact NH1-OD2 2.72Å; R197-D219 PolarHBondContact NH1-OD2 3.1Å; R197-D219 IonicContact NH2-OD2 3.05Å; S217-D219 PolarHBondContact O-N 3.14Å; D219-F221 VanDerWaalsContact C-N 3.25Å; D219-F221 VanDerWaalsContact O-CD2 3.32Å; D219-F221 WeakPolarHBondContact O-CD2 3.35Å; D219-F221 PolarHBondContact O-N 3.31Å
220	S	80.1	Confident	83.2	Confident	79 Å²	79	60.7 Å²	60.7	55%	0.552	35%	0.35	S	S	*	.			trans	-74.2	80.9	179.9	-160.9	0	0	0	0	109.8	S218 I222 S223	S218-S220 PolarHBondContact O-N 2.79Å; S220-I222 PolarHBondContact O-N 3.02Å; S220-I222 VanDerWaalsContact OG-CG2 3.3Å; S220-I222 WeakPolarHBondContact OG-CG2 3.34Å; S220-S223 PolarHBondContact O-N 2.75Å; S220-S223 PolarHBondContact O-OG 3.33Å
221	F	86.9	Confident	83.3	Confident	9 Å²	9	57.2 Å²	57.2	4%	0.039	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-53.7	-22.3	179.5	-67.7	-69.9	0	0	0	113.6	P212 C216 D219 S223 Q224 H240 V241 F242 G243	P212-F221 HydrophobicContact CB-CE1 4.17Å; P212-F221 HydrophobicContact CB-CZ 4.27Å; P212-F221 HydrophobicContact CG-CE1 4.22Å; P212-F221 HydrophobicContact CG-CZ 3.93Å; C216-F221 HydrophobicContact CB-CZ 4.38Å; D219-F221 VanDerWaalsContact C-N 3.25Å; D219-F221 VanDerWaalsContact O-CD2 3.32Å; D219-F221 WeakPolarHBondContact O-CD2 3.35Å; D219-F221 PolarHBondContact O-N 3.31Å; F221-S223 PolarHBondContact O-N 3.33Å; F221-S223 VanDerWaalsContact O-N 3.13Å; F221-Q224 WeakPolarHBondContact O-CB 3.23Å; F221-Q224 PolarHBondContact O-N 2.73Å; F221-H240 WeakPolarHBondContact CB-ND1 3.29Å; F221-H240 AromaticContact CD2-CD2 3.66Å; F221-H240 AromaticContact CD2-CE1 3.33Å; F221-H240 WeakPolarHBondContact CD2-CE1 3.31Å; F221-H240 AromaticContact CD2-CG 3.7Å; F221-H240 AromaticContact CD2-ND1 3.47Å; F221-H240 WeakPolarHBondContact CD2-ND1 3.3Å; F221-H240 AromaticContact CD2-NE2 3.43Å; F221-H240 WeakPolarHBondContact CD2-NE2 3.47Å; F221-H240 AromaticContact CE2-CD2 3.92Å; F221-H240 AromaticContact CE2-NE2 3.91Å; F221-H240 AromaticContact CG-CE1 4Å; F221-H240 AromaticContact CG-ND1 3.77Å; F221-V241 WeakPolarHBondContact CB-O 2.99Å; F221-F242 HydrophobicContact CB-CD1 4.04Å; F221-F242 HydrophobicContact CB-CE1 4Å; F221-F242 HydrophobicContact CB-CZ 4.5Å; F221-F242 HydrophobicContact CD1-CD1 4.4Å; F221-F242 AromaticContact CD1-CE1 3.57Å; F221-F242 HydrophobicContact CD1-CE1 3.57Å; F221-F242 AromaticContact CD1-CZ 3.93Å; F221-F242 HydrophobicContact CD1-CZ 3.93Å; F221-F242 HydrophobicContact CE1-CE1 4.41Å; F221-F242 HydrophobicContact CE1-CZ 4.49Å; F221-F242 HydrophobicContact CG-CE1 4.12Å; F221-F242 HydrophobicContact CG-CZ 4.39Å; F221-F242 WeakPolarHBondContact O-CA 3.4Å; F221-G243 PolarHBondContact O-N 2.77Å
222	I	87.7	Confident	83.6	Confident	65 Å²	65	60 Å²	60	33%	0.333	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-61.3	-19	175	-156.9	167.4	0	0	0	113.6	S220 V241 G243 T325	S220-I222 PolarHBondContact O-N 3.02Å; S220-I222 VanDerWaalsContact OG-CG2 3.3Å; S220-I222 WeakPolarHBondContact OG-CG2 3.34Å; I222-V241 HydrophobicContact CG1-CG1 4.46Å; I222-G243 WeakPolarHBondContact O-CA 3.44Å; I222-G243 PolarHBondContact O-N 3.34Å; I222-T325 HydrophobicContact CD1-CG2 4.45Å; I222-T325 WeakPolarHBondContact CD1-O 3.34Å
223	S	88.8	Confident	84	Confident	79 Å²	79	62.1 Å²	62.1	55%	0.552	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-90.3	-5.8	174.4	63.8	0	0	0	0	113.5	S220 F221	S220-S223 PolarHBondContact O-N 2.75Å; S220-S223 PolarHBondContact O-OG 3.33Å; F221-S223 PolarHBondContact O-N 3.33Å; F221-S223 VanDerWaalsContact O-N 3.13Å
224	Q	92.3	Very high	84.6	Confident	65 Å²	65	56 Å²	56	30%	0.304	33%	0.325	S	S	.	.			trans	-103.7	152.4	-170.3	-56.1	-57.2	-41.8	0	0	112	F198 F221 F242 G243 S244	F198-Q224 HydrophobicContact CE1-CB 4.17Å; F198-Q224 HydrophobicContact CE1-CG 4.16Å; F198-Q224 HydrophobicContact CE2-CB 3.96Å; F198-Q224 HydrophobicContact CZ-CB 3.69Å; F198-Q224 HydrophobicContact CZ-CG 3.93Å; F221-Q224 WeakPolarHBondContact O-CB 3.23Å; F221-Q224 PolarHBondContact O-N 2.73Å; Q224-F242 HydrophobicContact CB-CD1 4.15Å; Q224-G243 WeakPolarHBondContact O-CA 3.44Å; Q224-G243 PolarHBondContact O-N 2.95Å; Q224-S244 PolarHBondContact O-N 2.85Å
225	T	95.1	Very high	85.8	Confident	34 Å²	34	53.9 Å²	53.9	21%	0.209	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125	177.9	-60.3	0	0	0	0	110.3	F198 Y227 S244 I246	F198-T225 WeakPolarHBondContact CD2-O 3.34Å; F198-T225 WeakPolarHBondContact CE2-O 3.36Å; T225-Y227 HydrophobicContact CG2-CD2 3.96Å; T225-Y227 HydrophobicContact CG2-CE1 4.13Å; T225-Y227 HydrophobicContact CG2-CE2 3.51Å; T225-Y227 HydrophobicContact CG2-CG 4.46Å; T225-Y227 WeakPolarHBondContact O-CD2 3.3Å; T225-S244 WeakPolarHBondContact CA-O 3.32Å; T225-S244 WeakPolarHBondContact CB-OG 3.47Å; T225-S244 VanDerWaalsContact CG2-OG 3.24Å; T225-S244 WeakPolarHBondContact CG2-OG 3.45Å; T225-S244 PolarHBondContact OG1-OG 2.79Å; T225-I246 HydrophobicContact CG2-CD1 3.89Å; T225-I246 HydrophobicContact CG2-CG1 4.09Å
226	V	96.5	Very high	87.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	126.4	172.1	174.9	0	0	0	0	108.8	F198 I211 L228 I238 F242 S244 L245 I246	F198-V226 HydrophobicContact CB-CG2 4.38Å; F198-V226 VanDerWaalsContact O-CG1 3.3Å; F198-V226 WeakPolarHBondContact O-CG1 3.25Å; I211-V226 HydrophobicContact CD1-CG1 4.22Å; I211-V226 HydrophobicContact CG2-CG2 4.46Å; V226-L228 HydrophobicContact CG1-CD2 4.17Å; V226-L228 HydrophobicContact CG1-CG 4.11Å; V226-I238 HydrophobicContact CG1-CD1 3.9Å; V226-F242 HydrophobicContact CG2-CB 3.96Å; V226-F242 HydrophobicContact CG2-CD1 3.5Å; V226-F242 HydrophobicContact CG2-CD2 3.62Å; V226-F242 HydrophobicContact CG2-CE1 3.78Å; V226-F242 HydrophobicContact CG2-CE2 3.91Å; V226-F242 HydrophobicContact CG2-CG 3.41Å; V226-F242 VanDerWaalsContact CG2-CG 3.41Å; V226-F242 HydrophobicContact CG2-CZ 3.99Å; V226-S244 PolarHBondContact N-O 2.9Å; V226-L245 HydrophobicContact CB-CD1 3.77Å; V226-L245 HydrophobicContact CG1-CD1 3.48Å; V226-L245 VanDerWaalsContact CG1-CD1 3.48Å; V226-L245 WeakPolarHBondContact O-CA 3.34Å; V226-I246 PolarHBondContact O-N 3.22Å
227	Y	97.8	Very high	89.4	Confident	60 Å²	60	45.1 Å²	45.1	24%	0.235	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.9	174.4	-68.4	-89.1	0	0	0	110.9	Y194 S199 L200 T225 I229 I246	Y194-Y227 AromaticContact CD1-CD1 3.94Å; Y194-Y227 HydrophobicContact CD1-CD1 3.94Å; Y194-Y227 AromaticContact CD1-CD2 3.57Å; Y194-Y227 HydrophobicContact CD1-CD2 3.57Å; Y194-Y227 HydrophobicContact CD1-CE1 4.45Å; Y194-Y227 HydrophobicContact CD1-CE2 4.14Å; Y194-Y227 AromaticContact CD1-CG 3.44Å; Y194-Y227 HydrophobicContact CD1-CG 3.44Å; Y194-Y227 VanDerWaalsContact CD1-CG 3.44Å; Y194-Y227 AromaticContact CE1-CD1 3.54Å; Y194-Y227 HydrophobicContact CE1-CD1 3.54Å; Y194-Y227 HydrophobicContact CE1-CD2 4.04Å; Y194-Y227 AromaticContact CE1-CE1 3.96Å; Y194-Y227 HydrophobicContact CE1-CE1 3.96Å; Y194-Y227 HydrophobicContact CE1-CE2 4.43Å; Y194-Y227 AromaticContact CE1-CG 3.56Å; Y194-Y227 HydrophobicContact CE1-CG 3.56Å; S199-Y227 CarbonylContact C-O 3.58Å; S199-Y227 WeakPolarHBondContact CA-O 3.36Å; S199-Y227 WeakPolarHBondContact CB-O 3.23Å; L200-Y227 PolarHBondContact N-O 3.43Å; T225-Y227 HydrophobicContact CG2-CD2 3.96Å; T225-Y227 HydrophobicContact CG2-CE1 4.13Å; T225-Y227 HydrophobicContact CG2-CE2 3.51Å; T225-Y227 HydrophobicContact CG2-CG 4.46Å; T225-Y227 WeakPolarHBondContact O-CD2 3.3Å; Y227-I229 HydrophobicContact CD1-CD1 4.2Å; Y227-I246 HydrophobicContact CD1-CB 3.85Å; Y227-I246 HydrophobicContact CD1-CD1 4.21Å; Y227-I246 HydrophobicContact CD1-CG2 4.07Å; Y227-I246 HydrophobicContact CE1-CB 4.09Å; Y227-I246 HydrophobicContact CE1-CD1 3.53Å; Y227-I246 HydrophobicContact CE1-CG1 4.32Å; Y227-I246 HydrophobicContact CE1-CG2 4.31Å
228	L	98.2	Very high	91.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	105.2	174.2	-58.5	-177.8	0	0	0	107.7	L200 I211 V226 L231 I236 I238 L245 I246 G247 R248 L250 I255	L200-L228 HydrophobicContact CB-CD2 3.92Å; L200-L228 HydrophobicContact CD1-CD2 4.07Å; L200-L228 HydrophobicContact CG-CD2 4.14Å; L200-L228 WeakPolarHBondContact O-CA 3.25Å; I211-L228 HydrophobicContact CD1-CD2 3.79Å; V226-L228 HydrophobicContact CG1-CD2 4.17Å; V226-L228 HydrophobicContact CG1-CG 4.11Å; L228-L231 HydrophobicContact CB-CD1 3.79Å; L228-L231 HydrophobicContact CD2-CD1 4.08Å; L228-L231 HydrophobicContact CG-CD1 4.42Å; L228-I236 HydrophobicContact CD1-CD1 3.99Å; L228-I236 HydrophobicContact CD1-CG2 4.33Å; L228-I236 HydrophobicContact CD2-CD1 4.15Å; L228-I236 HydrophobicContact CD2-CG2 4.38Å; L228-I238 HydrophobicContact CD1-CD1 4.37Å; L228-L245 HydrophobicContact CD1-CD1 3.91Å; L228-L245 HydrophobicContact CG-CD1 4.04Å; L228-I246 PolarHBondContact N-O 3.14Å; L228-G247 CarbonylContact O-C 3.49Å; L228-G247 VanDerWaalsContact O-CA 3.3Å; L228-G247 WeakPolarHBondContact O-CA 3.25Å; L228-R248 PolarHBondContact O-N 3.26Å; L228-L250 HydrophobicContact CB-CD2 4.13Å; L228-I255 HydrophobicContact CD1-CD1 3.49Å; L228-I255 VanDerWaalsContact CD1-CD1 3.49Å; L228-I255 HydrophobicContact CD1-CG1 4.22Å; L228-I255 HydrophobicContact CD1-CG2 4.29Å
229	I	98	Very high	92.9	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.3	-169.3	-56	178.3	0	0	0	109.9	Y194 L200 I201 N202 Y227 L231 R248	Y194-I229 HydrophobicContact CD1-CD1 4.5Å; Y194-I229 HydrophobicContact CE1-CD1 3.55Å; Y194-I229 HydrophobicContact CE2-CD1 4.44Å; Y194-I229 VanDerWaalsContact OH-CD1 3.25Å; Y194-I229 WeakPolarHBondContact OH-CD1 3.35Å; L200-I229 PolarHBondContact O-N 2.84Å; I201-I229 CarbonylContact C-O 3.45Å; I201-I229 VanDerWaalsContact CA-O 3.23Å; I201-I229 WeakPolarHBondContact CA-O 3.4Å; I201-I229 HydrophobicContact CG1-CB 4.45Å; I201-I229 HydrophobicContact CG2-CB 4.32Å; N202-I229 PolarHBondContact N-O 3.21Å; Y227-I229 HydrophobicContact CD1-CD1 4.2Å; I229-L231 WeakPolarHBondContact O-CD2 3.33Å; I229-L231 PolarHBondContact O-N 3.18Å; I229-R248 WeakPolarHBondContact CA-O 3.13Å
230	D	97.5	Very high	94.4	Very high	45 Å²	45	40.1 Å²	40.1	24%	0.241	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.4	53.1	174.9	-66.9	-49.4	0	0	0	112.5	N202 I203 R248 R249	N202-D230 VanDerWaalsContact CA-O 3.29Å; N202-D230 WeakPolarHBondContact CA-O 3.3Å; N202-D230 PolarHBondContact N-O 3.18Å; N202-D230 WeakPolarHBondContact OD1-CB 3.13Å; I203-D230 PolarHBondContact N-O 2.97Å; I203-D230 VanDerWaalsContact N-O 3.14Å; D230-R248 PolarHBondContact N-O 2.93Å; D230-R249 WeakPolarHBondContact OD1-CB 3.12Å; D230-R249 IonicContact OD1-CZ 3.89Å; D230-R249 IonicContact OD1-NE 2.83Å; D230-R249 PolarHBondContact OD1-NE 2.91Å; D230-R249 IonicContact OD1-NH2 3.96Å; D230-R249 PolarHBondContact OD1-NH2 3.43Å; D230-R249 IonicContact OD2-CZ 3.44Å; D230-R249 IonicContact OD2-NE 3.31Å; D230-R249 IonicContact OD2-NH2 2.67Å; D230-R249 PolarHBondContact OD2-NH2 3.15Å
231	L	98.4	Very high	95.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.5	179.5	-46.6	-179.9	0	0	0	110.2	L200 I203 L228 I229 I236 L250 K251 C253	L200-L231 HydrophobicContact CB-CD1 4.01Å; L200-L231 HydrophobicContact CB-CD2 4.07Å; I203-L231 HydrophobicContact CB-CD2 3.75Å; I203-L231 HydrophobicContact CD1-CD2 4.37Å; I203-L231 HydrophobicContact CG1-CD2 3.89Å; I203-L231 CarbonylContact O-C 3.53Å; I203-L231 VanDerWaalsContact O-CA 3.31Å; I203-L231 WeakPolarHBondContact O-CA 3.34Å; L228-L231 HydrophobicContact CB-CD1 3.79Å; L228-L231 HydrophobicContact CD2-CD1 4.08Å; L228-L231 HydrophobicContact CG-CD1 4.42Å; I229-L231 WeakPolarHBondContact O-CD2 3.33Å; I229-L231 PolarHBondContact O-N 3.18Å; L231-I236 HydrophobicContact CD1-CD1 3.37Å; L231-L250 HydrophobicContact CB-CD2 3.71Å; L231-L250 HydrophobicContact CD1-CD2 3.9Å; L231-L250 HydrophobicContact CG-CD2 3.75Å; L231-L250 CarbonylContact O-C 3.53Å; L231-L250 WeakPolarHBondContact O-CA 3.48Å; L231-K251 PolarHBondContact O-N 2.93Å; L231-C253 PolarHBondContact O-SG 2.97Å
232	I	98.5	Very high	95.6	Very high	61 Å²	61	36.1 Å²	36.1	31%	0.313	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.7	-179.5	-55.3	-179	0	0	0	108.9	I203 T204 G205 C234 K251	I203-I232 PolarHBondContact O-N 3.05Å; T204-I232 HydrophobicContact CG2-CB 4.26Å; T204-I232 HydrophobicContact CG2-CG2 4.46Å; G205-I232 WeakPolarHBondContact CA-O 3.32Å; G205-I232 PolarHBondContact N-O 2.78Å; I232-C234 PolarHBondContact O-N 3.45Å; I232-C234 PolarHBondContact O-SG 3.38Å; I232-K251 CarbonylContact C-O 3.53Å; I232-K251 VanDerWaalsContact CA-O 3.3Å; I232-K251 WeakPolarHBondContact CA-O 3.45Å; I232-K251 HydrophobicContact CG1-CB 4.3Å; I232-K251 HydrophobicContact CG2-CB 4.44Å
233	D	97.8	Very high	95.9	Very high	72 Å²	72	33.7 Å²	33.7	39%	0.385	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.9	35.5	175.7	-65.1	-46.7	0	0	0	114	P206 K251 N252	P206-D233 VanDerWaalsContact CA-O 3.32Å; P206-D233 WeakPolarHBondContact CA-O 3.31Å; D233-K251 PolarHBondContact N-O 2.91Å; D233-N252 WeakPolarHBondContact OD1-CB 3.48Å; D233-N252 PolarHBondContact OD1-ND2 2.87Å
234	C	97.9	Very high	96.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.3	-178.1	-66.8	0	0	0	0	112.4	Q207 I232 I236 C253 K254	Q207-C234 WeakPolarHBondContact O-CA 3.45Å; I232-C234 PolarHBondContact O-N 3.45Å; I232-C234 PolarHBondContact O-SG 3.38Å; C234-I236 HydrophobicContact CB-CD1 4.35Å; C234-I236 HydrophobicContact CB-CG1 4.31Å; C234-C253 CarbonylContact O-C 3.59Å; C234-C253 WeakPolarHBondContact O-CA 3.36Å; C234-C253 WeakPolarHBondContact O-CB 3.3Å; C234-K254 PolarHBondContact O-N 3.41Å
235	T	97.2	Very high	96.6	Very high	41 Å²	41	27.8 Å²	27.8	25%	0.252	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.7	167	-58	0	0	0	0	109.6	Q207 H208 F209 K254 Y256	Q207-T235 PolarHBondContact O-N 2.83Å; H208-T235 CarbonylContact C-O 3.57Å; H208-T235 VanDerWaalsContact CA-O 3.25Å; H208-T235 WeakPolarHBondContact CA-O 3.26Å; F209-T235 PolarHBondContact N-O 2.66Å; T235-K254 CarbonylContact C-O 3.57Å; T235-K254 VanDerWaalsContact CA-O 3.28Å; T235-K254 WeakPolarHBondContact CA-O 3.4Å; T235-K254 HydrophobicContact CG2-CB 4.11Å; T235-Y256 HydrophobicContact CG2-CD2 4.28Å; T235-Y256 HydrophobicContact CG2-CE2 3.99Å
236	I	96.9	Very high	96.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	126.6	-169.9	-54.5	163.6	0	0	0	108.6	L200 F209 I211 L228 L231 C234 I238 K254 I255 Y256	L200-I236 HydrophobicContact CD1-CD1 4.18Å; L200-I236 HydrophobicContact CD1-CG1 4.21Å; L200-I236 HydrophobicContact CD1-CG2 4.23Å; F209-I236 HydrophobicContact CD2-CG1 4.48Å; F209-I236 WeakPolarHBondContact O-CA 3.39Å; I211-I236 HydrophobicContact CD1-CG2 3.79Å; I211-I236 HydrophobicContact CG1-CG2 4.36Å; L228-I236 HydrophobicContact CD1-CD1 3.99Å; L228-I236 HydrophobicContact CD1-CG2 4.33Å; L228-I236 HydrophobicContact CD2-CD1 4.15Å; L228-I236 HydrophobicContact CD2-CG2 4.38Å; L231-I236 HydrophobicContact CD1-CD1 3.37Å; C234-I236 HydrophobicContact CB-CD1 4.35Å; C234-I236 HydrophobicContact CB-CG1 4.31Å; I236-I238 HydrophobicContact CG2-CG1 4.32Å; I236-K254 PolarHBondContact N-O 3.43Å; I236-I255 HydrophobicContact CB-CG1 4.3Å; I236-I255 HydrophobicContact CD1-CD1 4.44Å; I236-I255 HydrophobicContact CD1-CG1 4.21Å; I236-I255 WeakPolarHBondContact O-CA 3.28Å; I236-Y256 PolarHBondContact O-N 3.46Å
237	E	95.7	Very high	96.8	Very high	32 Å²	32	27.7 Å²	27.7	15%	0.15	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.4	176.4	-67.8	-177.4	-146.2	0	0	110.4	H208 F209 I210 I211 R239 Y256	H208-E237 IonicContact CE1-OE1 3.92Å; H208-E237 PolarHBondContact CE1-OE1 3.49Å; H208-E237 IonicContact NE2-OE1 3.68Å; H208-E237 PolarHBondContact NE2-OE1 3.31Å; F209-E237 PolarHBondContact O-N 2.93Å; I210-E237 CarbonylContact C-O 3.51Å; I210-E237 WeakPolarHBondContact CA-O 3.44Å; I210-E237 HydrophobicContact CG1-CB 4.49Å; I211-E237 PolarHBondContact N-O 2.92Å; E237-R239 HydrophobicContact CB-CG 4.28Å; E237-R239 IonicContact OE2-CZ 3.17Å; E237-R239 IonicContact OE2-NE 2.89Å; E237-R239 PolarHBondContact OE2-NE 3.25Å; E237-R239 IonicContact OE2-NH2 2.66Å; E237-R239 PolarHBondContact OE2-NH2 3.34Å; E237-Y256 CarbonylContact C-O 3.53Å; E237-Y256 VanDerWaalsContact CA-O 3.29Å; E237-Y256 WeakPolarHBondContact CA-O 3.24Å; E237-Y256 HydrophobicContact CG-CD2 4.27Å
238	I	96	Very high	96.9	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	103.2	176.1	-57.3	164.2	0	0	0	107.2	I211 V226 L228 I236 F242 L245 I255 Y256 A257 Y258	I211-I238 HydrophobicContact CB-CB 4.47Å; I211-I238 HydrophobicContact CB-CG1 4.06Å; I211-I238 HydrophobicContact CD1-CG1 4.19Å; I211-I238 HydrophobicContact CG2-CG1 4.31Å; I211-I238 HydrophobicContact CG2-CG2 4.19Å; V226-I238 HydrophobicContact CG1-CD1 3.9Å; L228-I238 HydrophobicContact CD1-CD1 4.37Å; I236-I238 HydrophobicContact CG2-CG1 4.32Å; I238-F242 HydrophobicContact CG2-CD2 3.5Å; I238-F242 HydrophobicContact CG2-CE2 3.5Å; I238-L245 HydrophobicContact CD1-CD1 3.92Å; I238-L245 HydrophobicContact CD1-CD2 4.13Å; I238-I255 HydrophobicContact CD1-CG2 4.31Å; I238-Y256 PolarHBondContact N-O 3.48Å; I238-A257 HydrophobicContact CB-CB 3.8Å; I238-A257 HydrophobicContact CD1-CB 3.82Å; I238-A257 HydrophobicContact CG1-CB 4.28Å; I238-A257 HydrophobicContact CG2-CB 4.46Å; I238-Y258 WeakPolarHBondContact O-CB 3.44Å; I238-Y258 WeakPolarHBondContact O-CD1 3.41Å; I238-Y258 PolarHBondContact O-N 3.16Å
239	R	93.3	Very high	96.9	Very high	118 Å²	118	31.3 Å²	31.3	45%	0.445	15%	0.15	S	C	.	.			trans	-102.5	31.4	-171.4	-62.1	-175.3	175.5	-172.7	-2.5	113.2	I210 I211 E237 Y258	I210-R239 HydrophobicContact CG2-CG 4.22Å; I211-R239 PolarHBondContact O-N 3.34Å; E237-R239 HydrophobicContact CB-CG 4.28Å; E237-R239 IonicContact OE2-CZ 3.17Å; E237-R239 IonicContact OE2-NE 2.89Å; E237-R239 PolarHBondContact OE2-NE 3.25Å; E237-R239 IonicContact OE2-NH2 2.66Å; E237-R239 PolarHBondContact OE2-NH2 3.34Å; R239-Y258 HydrophobicContact CB-CD2 4.42Å; R239-Y258 HydrophobicContact CB-CE1 4.45Å; R239-Y258 HydrophobicContact CB-CE2 3.98Å; R239-Y258 HydrophobicContact CG-CE1 4.26Å; R239-Y258 WeakPolarHBondContact O-CE2 3.31Å
240	H	93	Very high	96.9	Very high	75 Å²	75	31.1 Å²	31.1	35%	0.347	15%	0.149	S	C	.	.	S	Bend	trans	-146.8	156.3	174.8	-156.3	-73	0	0	0	110.4	F221 F242	F221-H240 WeakPolarHBondContact CB-ND1 3.29Å; F221-H240 AromaticContact CD2-CD2 3.66Å; F221-H240 AromaticContact CD2-CE1 3.33Å; F221-H240 WeakPolarHBondContact CD2-CE1 3.31Å; F221-H240 AromaticContact CD2-CG 3.7Å; F221-H240 AromaticContact CD2-ND1 3.47Å; F221-H240 WeakPolarHBondContact CD2-ND1 3.3Å; F221-H240 AromaticContact CD2-NE2 3.43Å; F221-H240 WeakPolarHBondContact CD2-NE2 3.47Å; F221-H240 AromaticContact CE2-CD2 3.92Å; F221-H240 AromaticContact CE2-NE2 3.91Å; F221-H240 AromaticContact CG-CE1 4Å; F221-H240 AromaticContact CG-ND1 3.77Å; H240-F242 HydrophobicContact CB-CD2 4.29Å; H240-F242 HydrophobicContact CB-CE2 3.74Å; H240-F242 HydrophobicContact CB-CZ 4.34Å; H240-F242 VanDerWaalsContact O-CD2 3.25Å; H240-F242 WeakPolarHBondContact O-CD2 3.4Å; H240-F242 PolarHBondContact O-N 3.21Å
241	V	94.5	Very high	96.9	Very high	4 Å²	4	34 Å²	34	2%	0.024	16%	0.159	C	C	.	.			trans	-74.6	121.7	170.4	178.7	0	0	0	0	109.8	F221 I222 P259 D322 T325 A326	F221-V241 WeakPolarHBondContact CB-O 2.99Å; I222-V241 HydrophobicContact CG1-CG1 4.46Å; V241-P259 WeakPolarHBondContact CA-O 3.45Å; V241-P259 WeakPolarHBondContact CG1-O 3.38Å; V241-D322 HydrophobicContact CG2-CB 3.61Å; V241-T325 HydrophobicContact CB-CG2 4.49Å; V241-T325 HydrophobicContact CG1-CG2 4.32Å; V241-A326 HydrophobicContact CG1-CB 3.99Å
242	F	95.8	Very high	96.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-115	164.1	176.3	-74.5	-88.2	0	0	0	111.7	F198 I211 F221 Q224 V226 I238 H240 I260 S261	F198-F242 HydrophobicContact CB-CE1 3.72Å; F198-F242 HydrophobicContact CB-CZ 3.79Å; F198-F242 HydrophobicContact CD1-CE1 4.12Å; F198-F242 HydrophobicContact CD2-CE1 4.31Å; F198-F242 AromaticContact CG-CE1 3.79Å; F198-F242 HydrophobicContact CG-CE1 3.79Å; F198-F242 HydrophobicContact CG-CZ 4.36Å; I211-F242 HydrophobicContact CG2-CE2 3.95Å; I211-F242 HydrophobicContact CG2-CZ 3.89Å; F221-F242 HydrophobicContact CB-CD1 4.04Å; F221-F242 HydrophobicContact CB-CE1 4Å; F221-F242 HydrophobicContact CB-CZ 4.5Å; F221-F242 HydrophobicContact CD1-CD1 4.4Å; F221-F242 AromaticContact CD1-CE1 3.57Å; F221-F242 HydrophobicContact CD1-CE1 3.57Å; F221-F242 AromaticContact CD1-CZ 3.93Å; F221-F242 HydrophobicContact CD1-CZ 3.93Å; F221-F242 HydrophobicContact CE1-CE1 4.41Å; F221-F242 HydrophobicContact CE1-CZ 4.49Å; F221-F242 HydrophobicContact CG-CE1 4.12Å; F221-F242 HydrophobicContact CG-CZ 4.39Å; F221-F242 WeakPolarHBondContact O-CA 3.4Å; Q224-F242 HydrophobicContact CB-CD1 4.15Å; V226-F242 HydrophobicContact CG2-CB 3.96Å; V226-F242 HydrophobicContact CG2-CD1 3.5Å; V226-F242 HydrophobicContact CG2-CD2 3.62Å; V226-F242 HydrophobicContact CG2-CE1 3.78Å; V226-F242 HydrophobicContact CG2-CE2 3.91Å; V226-F242 HydrophobicContact CG2-CG 3.41Å; V226-F242 VanDerWaalsContact CG2-CG 3.41Å; V226-F242 HydrophobicContact CG2-CZ 3.99Å; I238-F242 HydrophobicContact CG2-CD2 3.5Å; I238-F242 HydrophobicContact CG2-CE2 3.5Å; H240-F242 HydrophobicContact CB-CD2 4.29Å; H240-F242 HydrophobicContact CB-CE2 3.74Å; H240-F242 HydrophobicContact CB-CZ 4.34Å; H240-F242 VanDerWaalsContact O-CD2 3.25Å; H240-F242 WeakPolarHBondContact O-CD2 3.4Å; H240-F242 PolarHBondContact O-N 3.21Å; F242-I260 HydrophobicContact CB-CD1 4.14Å; F242-S261 PolarHBondContact O-N 2.91Å
243	G	95.3	Very high	96.9	Very high	13 Å²	13	34.8 Å²	34.8	13%	0.134	16%	0.164	C	C	.	.	S	Bend	trans	-71.4	-45.7	177.3	0	0	0	0	0	112.7	F221 I222 Q224 G262	F221-G243 PolarHBondContact O-N 2.77Å; I222-G243 WeakPolarHBondContact O-CA 3.44Å; I222-G243 PolarHBondContact O-N 3.34Å; Q224-G243 WeakPolarHBondContact O-CA 3.44Å; Q224-G243 PolarHBondContact O-N 2.95Å; G243-G262 WeakPolarHBondContact O-CA 3.37Å; G243-G262 PolarHBondContact O-N 2.85Å
244	S	97.2	Very high	96.9	Very high	18 Å²	18	35.2 Å²	35.2	13%	0.126	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.5	176.4	55.1	0	0	0	0	112.1	Q224 T225 V226 S263	Q224-S244 PolarHBondContact O-N 2.85Å; T225-S244 WeakPolarHBondContact CA-O 3.32Å; T225-S244 WeakPolarHBondContact CB-OG 3.47Å; T225-S244 VanDerWaalsContact CG2-OG 3.24Å; T225-S244 WeakPolarHBondContact CG2-OG 3.45Å; T225-S244 PolarHBondContact OG1-OG 2.79Å; V226-S244 PolarHBondContact N-O 2.9Å; S244-S263 VanDerWaalsContact CA-O 3.23Å; S244-S263 WeakPolarHBondContact CA-O 3.34Å; S244-S263 WeakPolarHBondContact CB-O 3.5Å
245	L	98.2	Very high	96.9	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.2	174.5	170	63.9	0	0	0	109.1	V226 L228 I238 I260 S263 V264 W265 F276	V226-L245 HydrophobicContact CB-CD1 3.77Å; V226-L245 HydrophobicContact CG1-CD1 3.48Å; V226-L245 VanDerWaalsContact CG1-CD1 3.48Å; V226-L245 WeakPolarHBondContact O-CA 3.34Å; L228-L245 HydrophobicContact CD1-CD1 3.91Å; L228-L245 HydrophobicContact CG-CD1 4.04Å; I238-L245 HydrophobicContact CD1-CD1 3.92Å; I238-L245 HydrophobicContact CD1-CD2 4.13Å; L245-I260 HydrophobicContact CB-CD1 4.47Å; L245-I260 HydrophobicContact CB-CG1 4.42Å; L245-S263 PolarHBondContact N-O 2.92Å; L245-S263 VanDerWaalsContact N-O 3.1Å; L245-V264 HydrophobicContact CB-CG1 4.18Å; L245-V264 HydrophobicContact CB-CG2 4.11Å; L245-V264 HydrophobicContact CD2-CG1 4.05Å; L245-V264 HydrophobicContact CG-CG1 4.16Å; L245-V264 CarbonylContact O-C 3.53Å; L245-V264 VanDerWaalsContact O-CA 3.28Å; L245-V264 WeakPolarHBondContact O-CA 3.41Å; L245-W265 PolarHBondContact O-N 2.91Å; L245-F276 HydrophobicContact CD2-CD1 4.46Å
246	I	98.4	Very high	96.9	Very high	31 Å²	31	34.1 Å²	34.1	16%	0.159	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	113.5	175.2	-64.8	175.5	0	0	0	107.9	T225 V226 Y227 L228 W265	T225-I246 HydrophobicContact CG2-CD1 3.89Å; T225-I246 HydrophobicContact CG2-CG1 4.09Å; V226-I246 PolarHBondContact O-N 3.22Å; Y227-I246 HydrophobicContact CD1-CB 3.85Å; Y227-I246 HydrophobicContact CD1-CD1 4.21Å; Y227-I246 HydrophobicContact CD1-CG2 4.07Å; Y227-I246 HydrophobicContact CE1-CB 4.09Å; Y227-I246 HydrophobicContact CE1-CD1 3.53Å; Y227-I246 HydrophobicContact CE1-CG1 4.32Å; Y227-I246 HydrophobicContact CE1-CG2 4.31Å; L228-I246 PolarHBondContact N-O 3.14Å; I246-W265 WeakPolarHBondContact CA-O 3.17Å; I246-W265 HydrophobicContact CD1-CE3 4.47Å; I246-W265 HydrophobicContact CG1-CE3 4.35Å; I246-W265 HydrophobicContact CG2-CE3 3.69Å; I246-W265 HydrophobicContact CG2-CZ3 4.08Å
247	G	98.2	Very high	96.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.6	175.2	0	0	0	0	0	110.4	L228 W265 L266 D267	L228-G247 CarbonylContact O-C 3.49Å; L228-G247 VanDerWaalsContact O-CA 3.3Å; L228-G247 WeakPolarHBondContact O-CA 3.25Å; G247-W265 PolarHBondContact N-O 3Å; G247-L266 CarbonylContact O-C 3.48Å; G247-L266 VanDerWaalsContact O-CA 3.29Å; G247-L266 WeakPolarHBondContact O-CA 3.24Å; G247-D267 PolarHBondContact O-N 2.94Å
248	R	98.2	Very high	96.9	Very high	76 Å²	76	34.7 Å²	34.7	29%	0.287	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	134.2	179.9	-171.7	167.8	63.2	140.5	0.4	112.3	L228 I229 D230 L250 D267	L228-R248 PolarHBondContact O-N 3.26Å; I229-R248 WeakPolarHBondContact CA-O 3.13Å; D230-R248 PolarHBondContact N-O 2.93Å; R248-L250 VanDerWaalsContact C-N 3.34Å; R248-L250 PolarHBondContact O-N 2.89Å; R248-D267 CarbonylContact C-O 3.54Å; R248-D267 VanDerWaalsContact CA-O 3.26Å; R248-D267 WeakPolarHBondContact CA-O 3.19Å; R248-D267 HydrophobicContact CG-CB 4.19Å
249	R	98.2	Very high	96.9	Very high	61 Å²	61	34.7 Å²	34.7	23%	0.23	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.8	48.8	178.3	-66.7	-177	-57	-88.3	-2.2	112.8	D230 D267 E268	D230-R249 WeakPolarHBondContact OD1-CB 3.12Å; D230-R249 IonicContact OD1-CZ 3.89Å; D230-R249 IonicContact OD1-NE 2.83Å; D230-R249 PolarHBondContact OD1-NE 2.91Å; D230-R249 IonicContact OD1-NH2 3.96Å; D230-R249 PolarHBondContact OD1-NH2 3.43Å; D230-R249 IonicContact OD2-CZ 3.44Å; D230-R249 IonicContact OD2-NE 3.31Å; D230-R249 IonicContact OD2-NH2 2.67Å; D230-R249 PolarHBondContact OD2-NH2 3.15Å; R249-D267 PolarHBondContact N-O 3.08Å; R249-E268 WeakPolarHBondContact CA-O 3.43Å; R249-E268 HydrophobicContact CG-CB 3.75Å; R249-E268 HydrophobicContact CG-CG 4.38Å; R249-E268 IonicContact NH1-OE1 3.7Å
250	L	98.6	Very high	97.1	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.4	177.1	-52.9	178.1	0	0	0	109.8	L228 L231 R248 C253 I255 C269 V270 C272	L228-L250 HydrophobicContact CB-CD2 4.13Å; L231-L250 HydrophobicContact CB-CD2 3.71Å; L231-L250 HydrophobicContact CD1-CD2 3.9Å; L231-L250 HydrophobicContact CG-CD2 3.75Å; L231-L250 CarbonylContact O-C 3.53Å; L231-L250 WeakPolarHBondContact O-CA 3.48Å; R248-L250 VanDerWaalsContact C-N 3.34Å; R248-L250 PolarHBondContact O-N 2.89Å; L250-C253 HydrophobicContact CB-CB 4.43Å; L250-I255 HydrophobicContact CD1-CD1 3.41Å; L250-I255 VanDerWaalsContact CD1-CD1 3.41Å; L250-C269 HydrophobicContact CB-CB 4.39Å; L250-C269 CarbonylContact O-C 3.54Å; L250-C269 VanDerWaalsContact O-CA 3.3Å; L250-C269 WeakPolarHBondContact O-CA 3.26Å; L250-V270 PolarHBondContact O-N 3.1Å; L250-C272 PolarHBondContact O-SG 2.87Å; L250-C272 VanDerWaalsContact O-SG 3.41Å
251	K	98.6	Very high	97.2	Very high	105 Å²	105	26.6 Å²	26.6	46%	0.457	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.1	-179.6	-61.9	-178.3	-178.9	175.6	0	110.9	L231 I232 D233 C253 V270	L231-K251 PolarHBondContact O-N 2.93Å; I232-K251 CarbonylContact C-O 3.53Å; I232-K251 VanDerWaalsContact CA-O 3.3Å; I232-K251 WeakPolarHBondContact CA-O 3.45Å; I232-K251 HydrophobicContact CG1-CB 4.3Å; I232-K251 HydrophobicContact CG2-CB 4.44Å; D233-K251 PolarHBondContact N-O 2.91Å; K251-C253 PolarHBondContact O-N 2.92Å; K251-C253 VanDerWaalsContact O-N 3.15Å; K251-C253 PolarHBondContact O-SG 2.88Å; K251-V270 WeakPolarHBondContact CA-O 3.19Å; K251-V270 HydrophobicContact CG-CB 4.46Å
252	N	98	Very high	97.3	Very high	79 Å²	79	27.2 Å²	27.2	42%	0.422	13%	0.132	S	C	.	.	S	Bend	trans	55.2	31.6	178.5	-63	23.8	0	0	0	113.1	D233 V270 N271	D233-N252 WeakPolarHBondContact OD1-CB 3.48Å; D233-N252 PolarHBondContact OD1-ND2 2.87Å; N252-V270 PolarHBondContact N-O 3Å; N252-N271 WeakPolarHBondContact CA-O 3.47Å; N252-N271 WeakPolarHBondContact OD1-CB 3.3Å
253	C	98.4	Very high	97.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.149	C	C	.	.			trans	-96.7	152.4	-177.1	-73.6	0	0	0	0	112.1	L231 C234 L250 K251 C272 D273	L231-C253 PolarHBondContact O-SG 2.97Å; C234-C253 CarbonylContact O-C 3.59Å; C234-C253 WeakPolarHBondContact O-CA 3.36Å; C234-C253 WeakPolarHBondContact O-CB 3.3Å; L250-C253 HydrophobicContact CB-CB 4.43Å; K251-C253 PolarHBondContact O-N 2.92Å; K251-C253 VanDerWaalsContact O-N 3.15Å; K251-C253 PolarHBondContact O-SG 2.88Å; C253-C272 PolarHBondContact N-SG 2.7Å; C253-C272 CarbonylContact O-C 3.54Å; C253-C272 WeakPolarHBondContact O-CA 3.19Å; C253-C272 VanDerWaalsContact O-CB 3.25Å; C253-C272 WeakPolarHBondContact O-CB 3.3Å; C253-D273 PolarHBondContact O-N 2.94Å
254	K	97.5	Very high	97.5	Very high	82 Å²	82	29 Å²	29	36%	0.357	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	117.6	170.4	-61.4	-175	176.4	-178.6	0	108.9	C234 T235 I236 Y256 D273	C234-K254 PolarHBondContact O-N 3.41Å; T235-K254 CarbonylContact C-O 3.57Å; T235-K254 VanDerWaalsContact CA-O 3.28Å; T235-K254 WeakPolarHBondContact CA-O 3.4Å; T235-K254 HydrophobicContact CG2-CB 4.11Å; I236-K254 PolarHBondContact N-O 3.43Å; K254-Y256 HydrophobicContact CB-CE2 3.9Å; K254-D273 CarbonylContact C-O 3.55Å; K254-D273 WeakPolarHBondContact CA-O 3.35Å; K254-D273 HydrophobicContact CB-CB 4.47Å; K254-D273 HydrophobicContact CG-CB 4.14Å
255	I	97.6	Very high	97.5	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.015	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.5	-178.1	-60.6	175.6	0	0	0	108.5	L228 I236 I238 L250 D273 L274 V275	L228-I255 HydrophobicContact CD1-CD1 3.49Å; L228-I255 VanDerWaalsContact CD1-CD1 3.49Å; L228-I255 HydrophobicContact CD1-CG1 4.22Å; L228-I255 HydrophobicContact CD1-CG2 4.29Å; I236-I255 HydrophobicContact CB-CG1 4.3Å; I236-I255 HydrophobicContact CD1-CD1 4.44Å; I236-I255 HydrophobicContact CD1-CG1 4.21Å; I236-I255 WeakPolarHBondContact O-CA 3.28Å; I238-I255 HydrophobicContact CD1-CG2 4.31Å; L250-I255 HydrophobicContact CD1-CD1 3.41Å; L250-I255 VanDerWaalsContact CD1-CD1 3.41Å; I255-D273 PolarHBondContact N-O 2.91Å; I255-L274 HydrophobicContact CB-CD2 3.89Å; I255-L274 HydrophobicContact CD1-CD2 3.66Å; I255-L274 HydrophobicContact CG1-CD2 3.92Å; I255-V275 PolarHBondContact O-N 2.51Å
256	Y	97.2	Very high	97.6	Very high	15 Å²	15	32.7 Å²	32.7	6%	0.059	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	104.3	175.8	-55.6	-70.6	0	0	0	108.1	T235 I236 E237 I238 K254 V275 L314 L366 P368	T235-Y256 HydrophobicContact CG2-CD2 4.28Å; T235-Y256 HydrophobicContact CG2-CE2 3.99Å; I236-Y256 PolarHBondContact O-N 3.46Å; E237-Y256 CarbonylContact C-O 3.53Å; E237-Y256 VanDerWaalsContact CA-O 3.29Å; E237-Y256 WeakPolarHBondContact CA-O 3.24Å; E237-Y256 HydrophobicContact CG-CD2 4.27Å; I238-Y256 PolarHBondContact N-O 3.48Å; K254-Y256 HydrophobicContact CB-CE2 3.9Å; Y256-V275 HydrophobicContact CD1-CB 3.95Å; Y256-V275 HydrophobicContact CD1-CG2 3.95Å; Y256-V275 HydrophobicContact CE1-CG2 4.02Å; Y256-L314 HydrophobicContact CD1-CD2 3.89Å; Y256-L314 HydrophobicContact CG-CD2 4.34Å; Y256-L366 VanDerWaalsContact CE1-O 3.26Å; Y256-L366 WeakPolarHBondContact CE1-O 3.45Å; Y256-P368 HydrophobicContact CD2-CB 4.11Å; Y256-P368 HydrophobicContact CE1-CB 4.44Å; Y256-P368 HydrophobicContact CE2-CB 3.96Å; Y256-P368 HydrophobicContact CG-CB 4.39Å
257	A	97.2	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.6	-178.6	0	0	0	0	0	111.7	I238 I260 V275 F276 Y312	I238-A257 HydrophobicContact CB-CB 3.8Å; I238-A257 HydrophobicContact CD1-CB 3.82Å; I238-A257 HydrophobicContact CG1-CB 4.28Å; I238-A257 HydrophobicContact CG2-CB 4.46Å; A257-I260 HydrophobicContact CB-CD1 4.46Å; A257-V275 PolarHBondContact N-O 2.92Å; A257-F276 HydrophobicContact CB-CB 3.82Å; A257-Y312 PolarHBondContact O-OH 3.3Å; A257-Y312 VanDerWaalsContact O-OH 3.08Å
258	Y	96	Very high	97.5	Very high	45 Å²	45	35.4 Å²	35.4	18%	0.176	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-61.8	166.7	162.9	-73.9	14.6	0	0	0	109.9	I238 R239 I260 Y316 D322	I238-Y258 WeakPolarHBondContact O-CB 3.44Å; I238-Y258 WeakPolarHBondContact O-CD1 3.41Å; I238-Y258 PolarHBondContact O-N 3.16Å; R239-Y258 HydrophobicContact CB-CD2 4.42Å; R239-Y258 HydrophobicContact CB-CE1 4.45Å; R239-Y258 HydrophobicContact CB-CE2 3.98Å; R239-Y258 HydrophobicContact CG-CE1 4.26Å; R239-Y258 WeakPolarHBondContact O-CE2 3.31Å; Y258-I260 PolarHBondContact O-N 2.83Å; Y258-Y316 HydrophobicContact CD1-CD1 4.11Å; Y258-Y316 AromaticContact CD1-CE1 3.5Å; Y258-Y316 HydrophobicContact CD1-CE1 3.5Å; Y258-Y316 HydrophobicContact CD1-CE2 4.22Å; Y258-Y316 AromaticContact CD1-CZ 3.57Å; Y258-Y316 HydrophobicContact CD2-CD2 4.5Å; Y258-Y316 HydrophobicContact CD2-CE1 4.39Å; Y258-Y316 AromaticContact CD2-CE2 3.69Å; Y258-Y316 HydrophobicContact CD2-CE2 3.69Å; Y258-Y316 AromaticContact CD2-CZ 3.61Å; Y258-Y316 WeakPolarHBondContact CD2-OH 3.33Å; Y258-Y316 AromaticContact CE1-CD1 3.66Å; Y258-Y316 HydrophobicContact CE1-CD1 3.66Å; Y258-Y316 HydrophobicContact CE1-CD2 4.08Å; Y258-Y316 AromaticContact CE1-CE1 3.54Å; Y258-Y316 HydrophobicContact CE1-CE1 3.54Å; Y258-Y316 AromaticContact CE1-CE2 3.98Å; Y258-Y316 HydrophobicContact CE1-CE2 3.98Å; Y258-Y316 AromaticContact CE1-CG 3.92Å; Y258-Y316 HydrophobicContact CE1-CG 3.92Å; Y258-Y316 AromaticContact CE1-CZ 3.71Å; Y258-Y316 AromaticContact CE2-CD2 3.82Å; Y258-Y316 HydrophobicContact CE2-CD2 3.82Å; Y258-Y316 HydrophobicContact CE2-CE1 4.43Å; Y258-Y316 AromaticContact CE2-CE2 3.43Å; Y258-Y316 HydrophobicContact CE2-CE2 3.43Å; Y258-Y316 VanDerWaalsContact CE2-CE2 3.43Å; Y258-Y316 HydrophobicContact CE2-CG 4.48Å; Y258-Y316 AromaticContact CE2-CZ 3.76Å; Y258-Y316 AromaticContact CG-CE1 3.97Å; Y258-Y316 HydrophobicContact CG-CE1 3.97Å; Y258-Y316 HydrophobicContact CG-CE2 4.1Å; Y258-Y316 AromaticContact CG-CZ 3.53Å; Y258-Y316 VanDerWaalsContact CG-OH 3.27Å; Y258-Y316 AromaticContact CZ-CD2 3.57Å; Y258-Y316 AromaticContact CZ-CE2 3.58Å; Y258-Y316 AromaticContact CZ-CG 3.81Å; Y258-Y316 AromaticContact CZ-CZ 3.8Å; Y258-D322 VanDerWaalsContact CD2-OD2 3.3Å; Y258-D322 WeakPolarHBondContact CD2-OD2 3.36Å
259	P	96.5	Very high	97.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-49.8	131	-179.5	-31.3	37.4	0	0	0	114.4	V241 A277 Y316 L319 D322 L323 A326 L328	V241-P259 WeakPolarHBondContact CA-O 3.45Å; V241-P259 WeakPolarHBondContact CG1-O 3.38Å; P259-A277 HydrophobicContact CB-CB 4.13Å; P259-A277 HydrophobicContact CG-CB 4.1Å; P259-Y316 WeakPolarHBondContact CD-OH 3.31Å; P259-L319 HydrophobicContact CG-CD1 4.33Å; P259-D322 HydrophobicContact CG-CB 4.02Å; P259-L323 HydrophobicContact CB-CD2 4.16Å; P259-L323 HydrophobicContact CG-CD2 3.67Å; P259-L323 HydrophobicContact CG-CG 3.92Å; P259-A326 HydrophobicContact CB-CB 3.7Å; P259-L328 HydrophobicContact CB-CD1 4.19Å
260	I	97.3	Very high	97.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.5	176.1	-53.3	-59.7	0	0	0	108	F242 L245 A257 Y258 G262 V264 A277 C278	F242-I260 HydrophobicContact CB-CD1 4.14Å; L245-I260 HydrophobicContact CB-CD1 4.47Å; L245-I260 HydrophobicContact CB-CG1 4.42Å; A257-I260 HydrophobicContact CB-CD1 4.46Å; Y258-I260 PolarHBondContact O-N 2.83Å; I260-G262 VanDerWaalsContact C-N 3.33Å; I260-G262 PolarHBondContact O-N 3.46Å; I260-V264 HydrophobicContact CB-CG2 4.13Å; I260-V264 HydrophobicContact CG1-CG2 4.13Å; I260-V264 HydrophobicContact CG2-CG2 4.14Å; I260-A277 PolarHBondContact N-O 3.33Å; I260-C278 HydrophobicContact CB-CB 4.09Å; I260-C278 WeakPolarHBondContact O-CA 3.11Å
261	S	95.3	Very high	97.5	Very high	23 Å²	23	34.8 Å²	34.8	16%	0.161	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-32	-173	-174.5	0	0	0	0	113.1	F242 R279 A326	F242-S261 PolarHBondContact O-N 2.91Å; S261-R279 WeakPolarHBondContact O-CD 3.15Å; S261-R279 VanDerWaalsContact O-CG 3.3Å; S261-R279 WeakPolarHBondContact O-CG 3.35Å; S261-A326 WeakPolarHBondContact CA-O 3.19Å; S261-A326 PolarHBondContact OG-O 2.94Å
262	G	94.8	Very high	97.5	Very high	17 Å²	17	29.8 Å²	29.8	18%	0.175	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-125.4	-176.2	0	0	0	0	0	112.7	G243 I260 R279 Q280	G243-G262 WeakPolarHBondContact O-CA 3.37Å; G243-G262 PolarHBondContact O-N 2.85Å; I260-G262 VanDerWaalsContact C-N 3.33Å; I260-G262 PolarHBondContact O-N 3.46Å; G262-R279 WeakPolarHBondContact O-CB 3.44Å; G262-R279 PolarHBondContact O-N 3.35Å; G262-Q280 PolarHBondContact O-N 2.62Å
263	S	96.7	Very high	97.5	Very high	51 Å²	51	26.8 Å²	26.8	36%	0.357	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	148.8	-175.9	54.1	0	0	0	0	111.9	S244 L245 Q280	S244-S263 VanDerWaalsContact CA-O 3.23Å; S244-S263 WeakPolarHBondContact CA-O 3.34Å; S244-S263 WeakPolarHBondContact CB-O 3.5Å; L245-S263 PolarHBondContact N-O 2.92Å; L245-S263 VanDerWaalsContact N-O 3.1Å; S263-Q280 CarbonylContact C-O 3.59Å; S263-Q280 VanDerWaalsContact CA-O 3.3Å; S263-Q280 WeakPolarHBondContact CA-O 3.41Å
264	V	98.7	Very high	97.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.9	162.2	-177.6	0	0	0	0	107.6	L245 I260 L266 F276 C278 Q280 L281 R282	L245-V264 HydrophobicContact CB-CG1 4.18Å; L245-V264 HydrophobicContact CB-CG2 4.11Å; L245-V264 HydrophobicContact CD2-CG1 4.05Å; L245-V264 HydrophobicContact CG-CG1 4.16Å; L245-V264 CarbonylContact O-C 3.53Å; L245-V264 VanDerWaalsContact O-CA 3.28Å; L245-V264 WeakPolarHBondContact O-CA 3.41Å; I260-V264 HydrophobicContact CB-CG2 4.13Å; I260-V264 HydrophobicContact CG1-CG2 4.13Å; I260-V264 HydrophobicContact CG2-CG2 4.14Å; V264-L266 HydrophobicContact CG1-CD2 4.24Å; V264-L266 HydrophobicContact CG1-CG 4.17Å; V264-F276 HydrophobicContact CB-CD2 4.36Å; V264-F276 HydrophobicContact CB-CE2 3.87Å; V264-F276 HydrophobicContact CB-CZ 4.18Å; V264-F276 HydrophobicContact CG1-CD2 4.37Å; V264-F276 HydrophobicContact CG1-CE1 3.97Å; V264-F276 HydrophobicContact CG1-CE2 3.78Å; V264-F276 HydrophobicContact CG1-CZ 3.57Å; V264-F276 HydrophobicContact CG2-CD2 3.89Å; V264-F276 HydrophobicContact CG2-CE2 3.92Å; V264-F276 HydrophobicContact CG2-CG 4.49Å; V264-C278 HydrophobicContact CB-CB 4.47Å; V264-C278 HydrophobicContact CG2-CB 3.51Å; V264-Q280 PolarHBondContact N-O 2.8Å; V264-L281 HydrophobicContact CB-CD1 3.99Å; V264-L281 HydrophobicContact CG1-CD1 4.02Å; V264-L281 WeakPolarHBondContact O-CA 3.28Å; V264-R282 PolarHBondContact O-N 2.85Å
265	W	98.6	Very high	97.5	Very high	96 Å²	96	22.9 Å²	22.9	36%	0.364	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.5	174.9	-179.6	45.5	0	0	0	109.5	L245 I246 G247 D267 R282 H284	L245-W265 PolarHBondContact O-N 2.91Å; I246-W265 WeakPolarHBondContact CA-O 3.17Å; I246-W265 HydrophobicContact CD1-CE3 4.47Å; I246-W265 HydrophobicContact CG1-CE3 4.35Å; I246-W265 HydrophobicContact CG2-CE3 3.69Å; I246-W265 HydrophobicContact CG2-CZ3 4.08Å; G247-W265 PolarHBondContact N-O 3Å; W265-D267 HydrophobicContact CH2-CB 4.46Å; W265-D267 HydrophobicContact CZ2-CB 3.9Å; W265-R282 WeakPolarHBondContact CA-O 3.36Å; W265-H284 AromaticContact NE1-ND1 3.83Å
266	L	98.6	Very high	97.5	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132	179.7	-61.4	174.4	0	0	0	109.1	G247 V264 L274 F276 L281 R282 I283 H284	G247-L266 CarbonylContact O-C 3.48Å; G247-L266 VanDerWaalsContact O-CA 3.29Å; G247-L266 WeakPolarHBondContact O-CA 3.24Å; V264-L266 HydrophobicContact CG1-CD2 4.24Å; V264-L266 HydrophobicContact CG1-CG 4.17Å; L266-L274 HydrophobicContact CD1-CD1 3.47Å; L266-L274 VanDerWaalsContact CD1-CD1 3.47Å; L266-L274 HydrophobicContact CD2-CD1 4.22Å; L266-L274 HydrophobicContact CG-CD1 4.43Å; L266-F276 HydrophobicContact CD1-CE1 4.17Å; L266-F276 HydrophobicContact CD1-CZ 3.97Å; L266-L281 HydrophobicContact CD1-CD1 4.13Å; L266-L281 HydrophobicContact CG-CD1 4.41Å; L266-R282 PolarHBondContact N-O 3.36Å; L266-I283 HydrophobicContact CB-CB 4.46Å; L266-I283 HydrophobicContact CB-CG1 4.27Å; L266-I283 HydrophobicContact CB-CG2 4.07Å; L266-I283 HydrophobicContact CD1-CD1 4.08Å; L266-I283 HydrophobicContact CD1-CG1 4.13Å; L266-I283 CarbonylContact O-C 3.58Å; L266-I283 VanDerWaalsContact O-CA 3.31Å; L266-I283 WeakPolarHBondContact O-CA 3.39Å; L266-H284 PolarHBondContact O-N 2.85Å
267	D	98.3	Very high	97.5	Very high	16 Å²	16	22.1 Å²	22.1	9%	0.086	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	134.4	-179.5	-171	33.1	0	0	0	110.6	G247 R248 R249 W265 C269 H284 Q285	G247-D267 PolarHBondContact O-N 2.94Å; R248-D267 CarbonylContact C-O 3.54Å; R248-D267 VanDerWaalsContact CA-O 3.26Å; R248-D267 WeakPolarHBondContact CA-O 3.19Å; R248-D267 HydrophobicContact CG-CB 4.19Å; R249-D267 PolarHBondContact N-O 3.08Å; W265-D267 HydrophobicContact CH2-CB 4.46Å; W265-D267 HydrophobicContact CZ2-CB 3.9Å; D267-C269 VanDerWaalsContact C-N 3.28Å; D267-C269 PolarHBondContact O-N 2.98Å; D267-H284 WeakPolarHBondContact CA-O 3.4Å; D267-H284 WeakPolarHBondContact OD1-CB 3.23Å; D267-Q285 PolarHBondContact OD1-NE2 2.78Å
268	E	98	Very high	97.5	Very high	73 Å²	73	22.1 Å²	22.1	34%	0.341	12%	0.117	S	C	.	.	S	Bend	trans	55.2	36.4	177.6	-58.5	180	-107.2	0	0	114.6	R249 H284 Q285	R249-E268 WeakPolarHBondContact CA-O 3.43Å; R249-E268 HydrophobicContact CG-CB 3.75Å; R249-E268 HydrophobicContact CG-CG 4.38Å; R249-E268 IonicContact NH1-OE1 3.7Å; E268-H284 PolarHBondContact N-O 3.35Å; E268-H284 VanDerWaalsContact N-O 3.11Å; E268-Q285 WeakPolarHBondContact CA-O 3.3Å; E268-Q285 HydrophobicContact CG-CB 4.15Å
269	C	98.4	Very high	97.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.			trans	-86.9	141.5	177.5	-65	0	0	0	0	111.3	L250 D267 T286 S287	L250-C269 HydrophobicContact CB-CB 4.39Å; L250-C269 CarbonylContact O-C 3.54Å; L250-C269 VanDerWaalsContact O-CA 3.3Å; L250-C269 WeakPolarHBondContact O-CA 3.26Å; D267-C269 VanDerWaalsContact C-N 3.28Å; D267-C269 PolarHBondContact O-N 2.98Å; C269-T286 HydrophobicContact CB-CG2 3.7Å; C269-T286 PolarHBondContact N-OG1 3.16Å; C269-T286 CarbonylContact O-C 3.5Å; C269-T286 VanDerWaalsContact O-CA 3.23Å; C269-T286 WeakPolarHBondContact O-CA 3.33Å; C269-T286 VanDerWaalsContact O-CG2 3.28Å; C269-T286 WeakPolarHBondContact O-CG2 3.25Å; C269-S287 PolarHBondContact O-N 3.03Å
270	V	98.5	Very high	97.5	Very high	40 Å²	40	29.9 Å²	29.9	24%	0.242	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-139.3	131.1	-177.6	-173.7	0	0	0	0	111.5	L250 K251 N252 C272 S287	L250-V270 PolarHBondContact O-N 3.1Å; K251-V270 WeakPolarHBondContact CA-O 3.19Å; K251-V270 HydrophobicContact CG-CB 4.46Å; N252-V270 PolarHBondContact N-O 3Å; V270-C272 VanDerWaalsContact C-N 3.3Å; V270-C272 PolarHBondContact O-N 2.84Å; V270-C272 PolarHBondContact O-SG 2.98Å; V270-S287 WeakPolarHBondContact CA-O 3.48Å
271	N	98	Very high	97.6	Very high	83 Å²	83	30 Å²	30	44%	0.444	15%	0.15	S	C	.	.	S	Bend	trans	56.8	38.6	176.6	-61.7	-29.1	0	0	0	113.8	N252 S287 N288	N252-N271 WeakPolarHBondContact CA-O 3.47Å; N252-N271 WeakPolarHBondContact OD1-CB 3.3Å; N271-S287 PolarHBondContact N-O 2.75Å; N271-S287 VanDerWaalsContact N-O 3.16Å; N271-N288 WeakPolarHBondContact CA-O 3.43Å; N271-N288 WeakPolarHBondContact OD1-CB 3.46Å
272	C	98.4	Very high	97.7	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	16%	0.164	C	C	.	.			trans	-107.8	148.9	-177.1	-60.4	0	0	0	0	113.3	L250 C253 V270 L274 C289 R290	L250-C272 PolarHBondContact O-SG 2.87Å; L250-C272 VanDerWaalsContact O-SG 3.41Å; C253-C272 PolarHBondContact N-SG 2.7Å; C253-C272 CarbonylContact O-C 3.54Å; C253-C272 WeakPolarHBondContact O-CA 3.19Å; C253-C272 VanDerWaalsContact O-CB 3.25Å; C253-C272 WeakPolarHBondContact O-CB 3.3Å; V270-C272 VanDerWaalsContact C-N 3.3Å; V270-C272 PolarHBondContact O-N 2.84Å; V270-C272 PolarHBondContact O-SG 2.98Å; C272-L274 HydrophobicContact CB-CD1 4.28Å; C272-L274 HydrophobicContact CB-CD2 3.77Å; C272-L274 HydrophobicContact CB-CG 3.88Å; C272-C289 PolarHBondContact N-SG 2.9Å; C272-C289 VanDerWaalsContact N-SG 3.36Å; C272-C289 CarbonylContact O-C 3.59Å; C272-C289 VanDerWaalsContact O-CA 3.26Å; C272-C289 WeakPolarHBondContact O-CA 3.49Å; C272-C289 WeakPolarHBondContact O-CB 3.36Å; C272-R290 PolarHBondContact O-N 2.96Å
273	D	98	Very high	97.9	Very high	15 Å²	15	33.9 Å²	33.9	8%	0.08	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.3	163.9	-64.5	-27.4	0	0	0	108.7	C253 K254 I255 R290 L366	C253-D273 PolarHBondContact O-N 2.94Å; K254-D273 CarbonylContact C-O 3.55Å; K254-D273 WeakPolarHBondContact CA-O 3.35Å; K254-D273 HydrophobicContact CB-CB 4.47Å; K254-D273 HydrophobicContact CG-CB 4.14Å; I255-D273 PolarHBondContact N-O 2.91Å; D273-R290 WeakPolarHBondContact CA-O 3.42Å; D273-R290 IonicContact OD1-CZ 2.7Å; D273-R290 VanDerWaalsContact OD1-CZ 3.22Å; D273-R290 IonicContact OD1-NE 3.81Å; D273-R290 PolarHBondContact OD1-NE 3.01Å; D273-R290 IonicContact OD1-NH2 3.75Å; D273-R290 PolarHBondContact OD1-NH2 2.85Å; D273-R290 IonicContact OD2-CZ 3.97Å; D273-R290 IonicContact OD2-NE 2.97Å; D273-R290 IonicContact OD2-NH2 3.22Å; D273-R290 PolarHBondContact OD2-NH2 2.9Å; D273-L366 HydrophobicContact CB-CD2 4.03Å
274	L	98	Very high	97.9	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	109.3	-172.4	-53.1	175.4	0	0	0	109.3	I255 L266 C272 F276 R290 L291 G292	I255-L274 HydrophobicContact CB-CD2 3.89Å; I255-L274 HydrophobicContact CD1-CD2 3.66Å; I255-L274 HydrophobicContact CG1-CD2 3.92Å; L266-L274 HydrophobicContact CD1-CD1 3.47Å; L266-L274 VanDerWaalsContact CD1-CD1 3.47Å; L266-L274 HydrophobicContact CD2-CD1 4.22Å; L266-L274 HydrophobicContact CG-CD1 4.43Å; C272-L274 HydrophobicContact CB-CD1 4.28Å; C272-L274 HydrophobicContact CB-CD2 3.77Å; C272-L274 HydrophobicContact CB-CG 3.88Å; L274-F276 HydrophobicContact CB-CD1 4.5Å; L274-F276 HydrophobicContact CB-CE1 3.92Å; L274-R290 PolarHBondContact N-O 2.85Å; L274-L291 HydrophobicContact CB-CD2 3.85Å; L274-L291 HydrophobicContact CD1-CD2 3.94Å; L274-L291 HydrophobicContact CG-CD2 4.3Å; L274-L291 CarbonylContact O-C 3.56Å; L274-L291 VanDerWaalsContact O-CA 3.29Å; L274-L291 WeakPolarHBondContact O-CA 3.25Å; L274-G292 PolarHBondContact O-N 2.81Å
275	V	97.9	Very high	97.8	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	114.1	-171.1	-173.2	0	0	0	0	109.7	I255 Y256 A257 G292 Y312 L314 L366	I255-V275 PolarHBondContact O-N 2.51Å; Y256-V275 HydrophobicContact CD1-CB 3.95Å; Y256-V275 HydrophobicContact CD1-CG2 3.95Å; Y256-V275 HydrophobicContact CE1-CG2 4.02Å; A257-V275 PolarHBondContact N-O 2.92Å; V275-G292 CarbonylContact C-O 3.59Å; V275-G292 VanDerWaalsContact CA-O 3.29Å; V275-G292 WeakPolarHBondContact CA-O 3.28Å; V275-Y312 HydrophobicContact CG1-CD2 3.75Å; V275-Y312 HydrophobicContact CG1-CE2 3.95Å; V275-L314 HydrophobicContact CG1-CD1 4.05Å; V275-L314 HydrophobicContact CG1-CD2 4.41Å; V275-L314 HydrophobicContact CG1-CG 3.76Å; V275-L366 HydrophobicContact CG2-CB 4.12Å; V275-L366 HydrophobicContact CG2-CD2 4.1Å
276	F	97	Very high	97.7	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	157.7	-177.8	50.3	-103.4	0	0	0	112	L245 A257 V264 L266 L274 C278 L281 G292 L293 H294 Y312	L245-F276 HydrophobicContact CD2-CD1 4.46Å; A257-F276 HydrophobicContact CB-CB 3.82Å; V264-F276 HydrophobicContact CB-CD2 4.36Å; V264-F276 HydrophobicContact CB-CE2 3.87Å; V264-F276 HydrophobicContact CB-CZ 4.18Å; V264-F276 HydrophobicContact CG1-CD2 4.37Å; V264-F276 HydrophobicContact CG1-CE1 3.97Å; V264-F276 HydrophobicContact CG1-CE2 3.78Å; V264-F276 HydrophobicContact CG1-CZ 3.57Å; V264-F276 HydrophobicContact CG2-CD2 3.89Å; V264-F276 HydrophobicContact CG2-CE2 3.92Å; V264-F276 HydrophobicContact CG2-CG 4.49Å; L266-F276 HydrophobicContact CD1-CE1 4.17Å; L266-F276 HydrophobicContact CD1-CZ 3.97Å; L274-F276 HydrophobicContact CB-CD1 4.5Å; L274-F276 HydrophobicContact CB-CE1 3.92Å; F276-C278 HydrophobicContact CD2-CB 4.42Å; F276-L281 HydrophobicContact CE2-CD1 3.79Å; F276-L281 HydrophobicContact CE2-CD2 3.93Å; F276-L281 HydrophobicContact CE2-CG 4.37Å; F276-L281 HydrophobicContact CZ-CD1 3.65Å; F276-L281 HydrophobicContact CZ-CD2 4.09Å; F276-G292 PolarHBondContact N-O 2.86Å; F276-L293 HydrophobicContact CD2-CD2 3.95Å; F276-L293 HydrophobicContact CE2-CD2 3.49Å; F276-L293 VanDerWaalsContact CE2-CD2 3.49Å; F276-L293 HydrophobicContact CZ-CD2 3.81Å; F276-L293 WeakPolarHBondContact O-CA 3.4Å; F276-H294 PolarHBondContact O-N 2.71Å; F276-Y312 VanDerWaalsContact C-CD2 3.42Å; F276-Y312 VanDerWaalsContact CA-CE2 3.5Å
277	A	97.3	Very high	97.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	135.7	167.6	0	0	0	0	0	109.2	P259 I260 H294 Y312 L323 L328	P259-A277 HydrophobicContact CB-CB 4.13Å; P259-A277 HydrophobicContact CG-CB 4.1Å; I260-A277 PolarHBondContact N-O 3.33Å; A277-H294 CarbonylContact C-O 3.57Å; A277-H294 VanDerWaalsContact CA-O 3.3Å; A277-H294 WeakPolarHBondContact CA-O 3.25Å; A277-H294 HydrophobicContact CB-CB 3.68Å; A277-Y312 HydrophobicContact CB-CE2 4.49Å; A277-L323 HydrophobicContact CB-CD2 4.07Å; A277-L328 HydrophobicContact CB-CD1 3.84Å
278	C	97.4	Very high	97.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	167.7	177.7	69.3	0	0	0	0	114.1	I260 V264 F276 Q280 H294 M295 A296	I260-C278 HydrophobicContact CB-CB 4.09Å; I260-C278 WeakPolarHBondContact O-CA 3.11Å; V264-C278 HydrophobicContact CB-CB 4.47Å; V264-C278 HydrophobicContact CG2-CB 3.51Å; F276-C278 HydrophobicContact CD2-CB 4.42Å; C278-Q280 PolarHBondContact SG-O 2.88Å; C278-H294 PolarHBondContact N-O 3.1Å; C278-M295 PolarHBondContact SG-SD 3.42Å; C278-A296 PolarHBondContact O-N 2.8Å
279	R	96.1	Very high	97.6	Very high	119 Å²	119	33.8 Å²	33.8	45%	0.449	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-44	177.2	-76.4	-172.7	43.2	-118.2	8.8	112	S261 G262 A296 S297 L328	S261-R279 WeakPolarHBondContact O-CD 3.15Å; S261-R279 VanDerWaalsContact O-CG 3.3Å; S261-R279 WeakPolarHBondContact O-CG 3.35Å; G262-R279 WeakPolarHBondContact O-CB 3.44Å; G262-R279 PolarHBondContact O-N 3.35Å; R279-A296 HydrophobicContact CG-CB 4.28Å; R279-S297 WeakPolarHBondContact O-CB 3.33Å; R279-S297 PolarHBondContact O-N 2.96Å; R279-S297 PolarHBondContact O-OG 2.87Å; R279-L328 HydrophobicContact CB-CD2 4.39Å; R279-L328 HydrophobicContact CG-CD2 3.43Å; R279-L328 VanDerWaalsContact CG-CD2 3.43Å; R279-L328 HydrophobicContact CG-CG 4.43Å
280	Q	96.5	Very high	97.6	Very high	89 Å²	89	37.1 Å²	37.1	42%	0.416	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.9	-179.2	-67	-179.5	-12	0	0	110.4	G262 S263 V264 C278	G262-Q280 PolarHBondContact O-N 2.62Å; S263-Q280 CarbonylContact C-O 3.59Å; S263-Q280 VanDerWaalsContact CA-O 3.3Å; S263-Q280 WeakPolarHBondContact CA-O 3.41Å; V264-Q280 PolarHBondContact N-O 2.8Å; C278-Q280 PolarHBondContact SG-O 2.88Å
281	L	98.5	Very high	97.6	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	124.5	176.1	175.2	55.8	0	0	0	109	V264 L266 F276 I283 L293 M295 P299 I300	V264-L281 HydrophobicContact CB-CD1 3.99Å; V264-L281 HydrophobicContact CG1-CD1 4.02Å; V264-L281 WeakPolarHBondContact O-CA 3.28Å; L266-L281 HydrophobicContact CD1-CD1 4.13Å; L266-L281 HydrophobicContact CG-CD1 4.41Å; F276-L281 HydrophobicContact CE2-CD1 3.79Å; F276-L281 HydrophobicContact CE2-CD2 3.93Å; F276-L281 HydrophobicContact CE2-CG 4.37Å; F276-L281 HydrophobicContact CZ-CD1 3.65Å; F276-L281 HydrophobicContact CZ-CD2 4.09Å; L281-I283 HydrophobicContact CD1-CD1 4.17Å; L281-I283 HydrophobicContact CD1-CG1 3.79Å; L281-I283 HydrophobicContact CD2-CD1 4.08Å; L281-I283 HydrophobicContact CD2-CG1 4.43Å; L281-I283 HydrophobicContact CG-CD1 4.13Å; L281-I283 HydrophobicContact CG-CG1 3.93Å; L281-L293 HydrophobicContact CD2-CD1 3.51Å; L281-L293 HydrophobicContact CD2-CD2 3.66Å; L281-L293 HydrophobicContact CD2-CG 4.23Å; L281-M295 HydrophobicContact CB-CE 3.44Å; L281-M295 VanDerWaalsContact CB-CE 3.44Å; L281-M295 HydrophobicContact CB-SD 3.84Å; L281-M295 HydrophobicContact CD2-SD 4.2Å; L281-P299 HydrophobicContact CB-CB 4.29Å; L281-P299 HydrophobicContact CD2-CB 4.12Å; L281-P299 HydrophobicContact CD2-CG 4.45Å; L281-P299 HydrophobicContact CG-CB 4.36Å; L281-I300 PolarHBondContact O-N 3.31Å
282	R	98.2	Very high	97.5	Very high	122 Å²	122	31.4 Å²	31.4	46%	0.46	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128	173	-65.1	-177.4	-178.5	-108.6	0.1	109	V264 W265 L266 I300	V264-R282 PolarHBondContact O-N 2.85Å; W265-R282 WeakPolarHBondContact CA-O 3.36Å; L266-R282 PolarHBondContact N-O 3.36Å; R282-I300 CarbonylContact C-O 3.53Å; R282-I300 WeakPolarHBondContact CA-O 3.22Å; R282-I300 HydrophobicContact CG-CB 4.43Å
283	I	98.4	Very high	97.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.1	-178.6	-47.6	-175.1	0	0	0	108.9	L266 L281 T286 L291 I300 I301 E302 L307	L266-I283 HydrophobicContact CB-CB 4.46Å; L266-I283 HydrophobicContact CB-CG1 4.27Å; L266-I283 HydrophobicContact CB-CG2 4.07Å; L266-I283 HydrophobicContact CD1-CD1 4.08Å; L266-I283 HydrophobicContact CD1-CG1 4.13Å; L266-I283 CarbonylContact O-C 3.58Å; L266-I283 VanDerWaalsContact O-CA 3.31Å; L266-I283 WeakPolarHBondContact O-CA 3.39Å; L281-I283 HydrophobicContact CD1-CD1 4.17Å; L281-I283 HydrophobicContact CD1-CG1 3.79Å; L281-I283 HydrophobicContact CD2-CD1 4.08Å; L281-I283 HydrophobicContact CD2-CG1 4.43Å; L281-I283 HydrophobicContact CG-CD1 4.13Å; L281-I283 HydrophobicContact CG-CG1 3.93Å; I283-T286 VanDerWaalsContact CG2-CB 3.43Å; I283-T286 HydrophobicContact CG2-CG2 3.86Å; I283-T286 WeakPolarHBondContact CG2-OG1 3.45Å; I283-L291 HydrophobicContact CD1-CD1 3.38Å; I283-L291 HydrophobicContact CD1-CD2 4.36Å; I283-I300 PolarHBondContact N-O 2.81Å; I283-I301 HydrophobicContact CB-CG2 4.11Å; I283-I301 HydrophobicContact CD1-CG2 4.17Å; I283-I301 HydrophobicContact CG1-CG2 4.31Å; I283-I301 WeakPolarHBondContact O-CA 3.49Å; I283-E302 PolarHBondContact O-N 2.92Å; I283-L307 HydrophobicContact CD1-CD1 4.39Å
284	H	97.3	Very high	97.5	Very high	44 Å²	44	31.4 Å²	31.4	20%	0.204	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.7	177	-73.4	61.1	0	0	0	110.5	W265 L266 D267 E268 T286 E302	W265-H284 AromaticContact NE1-ND1 3.83Å; L266-H284 PolarHBondContact O-N 2.85Å; D267-H284 WeakPolarHBondContact CA-O 3.4Å; D267-H284 WeakPolarHBondContact OD1-CB 3.23Å; E268-H284 PolarHBondContact N-O 3.35Å; E268-H284 VanDerWaalsContact N-O 3.11Å; H284-T286 PolarHBondContact O-N 2.79Å; H284-T286 PolarHBondContact O-OG1 2.72Å; H284-E302 CarbonylContact C-O 3.59Å; H284-E302 VanDerWaalsContact CA-O 3.31Å; H284-E302 WeakPolarHBondContact CA-O 3.11Å; H284-E302 IonicContact CD2-OE2 2.7Å; H284-E302 IonicContact NE2-OE2 3.25Å; H284-E302 PolarHBondContact NE2-OE2 3.01Å
285	Q	95.5	Very high	97.4	Very high	95 Å²	95	31.4 Å²	31.4	44%	0.444	14%	0.139	S	C	.	.	S	Bend	trans	49.2	33.8	167.2	-61.6	175.7	101.3	0	0	114.3	D267 E268 E302 Q303	D267-Q285 PolarHBondContact OD1-NE2 2.78Å; E268-Q285 WeakPolarHBondContact CA-O 3.3Å; E268-Q285 HydrophobicContact CG-CB 4.15Å; Q285-E302 PolarHBondContact N-O 2.86Å; Q285-Q303 VanDerWaalsContact CA-O 3.32Å; Q285-Q303 WeakPolarHBondContact CA-O 3.17Å; Q285-Q303 HydrophobicContact CG-CB 4.14Å
286	T	97.6	Very high	97.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	15%	0.154	C	C	.	.			trans	-110.6	137.7	-170.9	-69.1	0	0	0	0	110	C269 I283 H284 C289 C304 T305 L307	C269-T286 HydrophobicContact CB-CG2 3.7Å; C269-T286 PolarHBondContact N-OG1 3.16Å; C269-T286 CarbonylContact O-C 3.5Å; C269-T286 VanDerWaalsContact O-CA 3.23Å; C269-T286 WeakPolarHBondContact O-CA 3.33Å; C269-T286 VanDerWaalsContact O-CG2 3.28Å; C269-T286 WeakPolarHBondContact O-CG2 3.25Å; I283-T286 VanDerWaalsContact CG2-CB 3.43Å; I283-T286 HydrophobicContact CG2-CG2 3.86Å; I283-T286 WeakPolarHBondContact CG2-OG1 3.45Å; H284-T286 PolarHBondContact O-N 2.79Å; H284-T286 PolarHBondContact O-OG1 2.72Å; T286-C289 HydrophobicContact CG2-CB 3.99Å; T286-C304 CarbonylContact O-C 3.6Å; T286-C304 WeakPolarHBondContact O-CA 3.29Å; T286-C304 VanDerWaalsContact O-CB 3.3Å; T286-C304 WeakPolarHBondContact O-CB 3.29Å; T286-T305 PolarHBondContact O-N 3.4Å; T286-L307 HydrophobicContact CG2-CD2 3.89Å
287	S	97.1	Very high	97.1	Very high	26 Å²	26	35.2 Å²	35.2	18%	0.182	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-135.2	148.1	-175.6	62.8	0	0	0	0	114	C269 V270 N271 C289 T305	C269-S287 PolarHBondContact O-N 3.03Å; V270-S287 WeakPolarHBondContact CA-O 3.48Å; N271-S287 PolarHBondContact N-O 2.75Å; N271-S287 VanDerWaalsContact N-O 3.16Å; S287-C289 PolarHBondContact O-N 2.97Å; S287-T305 CarbonylContact C-O 3.54Å; S287-T305 VanDerWaalsContact CA-O 3.24Å; S287-T305 WeakPolarHBondContact CA-O 3.3Å; S287-T305 VanDerWaalsContact CB-OG1 3.25Å; S287-T305 WeakPolarHBondContact CB-OG1 3.34Å
288	N	97.6	Very high	97.1	Very high	70 Å²	70	41 Å²	41	37%	0.374	19%	0.19	S	C	.	.	S	Bend	trans	55.9	36	174.4	-56.4	-54.3	0	0	0	113.7	N271 T305 N306	N271-N288 WeakPolarHBondContact CA-O 3.43Å; N271-N288 WeakPolarHBondContact OD1-CB 3.46Å; N288-T305 PolarHBondContact N-O 3.31Å; N288-N306 WeakPolarHBondContact CA-O 3.49Å; N288-N306 WeakPolarHBondContact OD1-CB 3.39Å; N288-N306 PolarHBondContact OD1-ND2 3.4Å
289	C	98.3	Very high	97	Very high	1 Å²	1	41 Å²	41	1%	0.007	19%	0.19	C	C	.	.			trans	-103.3	147.3	-179.6	-75.5	0	0	0	0	112	C272 T286 S287 L291 L307 K308	C272-C289 PolarHBondContact N-SG 2.9Å; C272-C289 VanDerWaalsContact N-SG 3.36Å; C272-C289 CarbonylContact O-C 3.59Å; C272-C289 VanDerWaalsContact O-CA 3.26Å; C272-C289 WeakPolarHBondContact O-CA 3.49Å; C272-C289 WeakPolarHBondContact O-CB 3.36Å; T286-C289 HydrophobicContact CG2-CB 3.99Å; S287-C289 PolarHBondContact O-N 2.97Å; C289-L291 HydrophobicContact CB-CD2 4.37Å; C289-L307 HydrophobicContact CB-CD2 3.88Å; C289-L307 WeakPolarHBondContact O-CA 3.47Å; C289-K308 PolarHBondContact O-N 2.7Å
290	R	97.9	Very high	97	Very high	69 Å²	69	37.1 Å²	37.1	26%	0.26	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.8	171.5	-55.5	-171.6	-63.4	160.9	6.1	109.3	C272 D273 L274 K308 I358 S365 L366	C272-R290 PolarHBondContact O-N 2.96Å; D273-R290 WeakPolarHBondContact CA-O 3.42Å; D273-R290 IonicContact OD1-CZ 2.7Å; D273-R290 VanDerWaalsContact OD1-CZ 3.22Å; D273-R290 IonicContact OD1-NE 3.81Å; D273-R290 PolarHBondContact OD1-NE 3.01Å; D273-R290 IonicContact OD1-NH2 3.75Å; D273-R290 PolarHBondContact OD1-NH2 2.85Å; D273-R290 IonicContact OD2-CZ 3.97Å; D273-R290 IonicContact OD2-NE 2.97Å; D273-R290 IonicContact OD2-NH2 3.22Å; D273-R290 PolarHBondContact OD2-NH2 2.9Å; L274-R290 PolarHBondContact N-O 2.85Å; R290-K308 CarbonylContact C-O 3.51Å; R290-K308 WeakPolarHBondContact CA-O 3.29Å; R290-K308 HydrophobicContact CG-CB 4.39Å; R290-I358 HydrophobicContact CB-CD1 4.15Å; R290-I358 HydrophobicContact CG-CD1 4.4Å; R290-S365 PolarHBondContact NH1-OG 2.92Å; R290-L366 HydrophobicContact CB-CD2 3.79Å
291	L	98.1	Very high	97	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.1	-172.1	-50.9	179.5	0	0	0	109.7	L274 I283 C289 L293 L307 K308 V309 A310	L274-L291 HydrophobicContact CB-CD2 3.85Å; L274-L291 HydrophobicContact CD1-CD2 3.94Å; L274-L291 HydrophobicContact CG-CD2 4.3Å; L274-L291 CarbonylContact O-C 3.56Å; L274-L291 VanDerWaalsContact O-CA 3.29Å; L274-L291 WeakPolarHBondContact O-CA 3.25Å; I283-L291 HydrophobicContact CD1-CD1 3.38Å; I283-L291 HydrophobicContact CD1-CD2 4.36Å; C289-L291 HydrophobicContact CB-CD2 4.37Å; L291-L293 HydrophobicContact CB-CD1 3.84Å; L291-L293 HydrophobicContact CB-CD2 4.09Å; L291-L293 HydrophobicContact CB-CG 3.77Å; L291-L293 HydrophobicContact CD1-CD1 4.22Å; L291-L307 HydrophobicContact CD1-CD1 4.48Å; L291-K308 PolarHBondContact N-O 2.9Å; L291-V309 HydrophobicContact CB-CG1 4.27Å; L291-V309 HydrophobicContact CD1-CG1 4.12Å; L291-V309 CarbonylContact O-C 3.59Å; L291-V309 WeakPolarHBondContact O-CA 3.26Å; L291-A310 PolarHBondContact O-N 2.78Å
292	G	97.2	Very high	96.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	102.6	171.9	0	0	0	0	0	110	L274 V275 F276 A310	L274-G292 PolarHBondContact O-N 2.81Å; V275-G292 CarbonylContact C-O 3.59Å; V275-G292 VanDerWaalsContact CA-O 3.29Å; V275-G292 WeakPolarHBondContact CA-O 3.28Å; F276-G292 PolarHBondContact N-O 2.86Å; G292-A310 WeakPolarHBondContact CA-O 3.39Å
293	L	97.7	Very high	96.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	142.2	-160.7	-58.5	177.6	0	0	0	113.8	F276 L281 L291 M295 P299 A310 P311 Y312 W335	F276-L293 HydrophobicContact CD2-CD2 3.95Å; F276-L293 HydrophobicContact CE2-CD2 3.49Å; F276-L293 VanDerWaalsContact CE2-CD2 3.49Å; F276-L293 HydrophobicContact CZ-CD2 3.81Å; F276-L293 WeakPolarHBondContact O-CA 3.4Å; L281-L293 HydrophobicContact CD2-CD1 3.51Å; L281-L293 HydrophobicContact CD2-CD2 3.66Å; L281-L293 HydrophobicContact CD2-CG 4.23Å; L291-L293 HydrophobicContact CB-CD1 3.84Å; L291-L293 HydrophobicContact CB-CD2 4.09Å; L291-L293 HydrophobicContact CB-CG 3.77Å; L291-L293 HydrophobicContact CD1-CD1 4.22Å; L293-M295 HydrophobicContact CB-CG 3.93Å; L293-M295 HydrophobicContact CB-SD 4.46Å; L293-M295 HydrophobicContact CD1-CG 4.48Å; L293-P299 HydrophobicContact CD1-CG 4.27Å; L293-A310 PolarHBondContact N-O 2.8Å; L293-P311 CarbonylContact O-C 3.52Å; L293-Y312 PolarHBondContact O-N 3.04Å; L293-W335 HydrophobicContact CB-CB 3.86Å; L293-W335 VanDerWaalsContact O-CB 3.22Å; L293-W335 WeakPolarHBondContact O-CB 3.42Å
294	H	97	Very high	96.2	Very high	17 Å²	17	35.6 Å²	35.6	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	119.8	160.3	-177.2	105.9	0	0	0	108.4	F276 A277 C278 Y312 S329 N333	F276-H294 PolarHBondContact O-N 2.71Å; A277-H294 CarbonylContact C-O 3.57Å; A277-H294 VanDerWaalsContact CA-O 3.3Å; A277-H294 WeakPolarHBondContact CA-O 3.25Å; A277-H294 HydrophobicContact CB-CB 3.68Å; C278-H294 PolarHBondContact N-O 3.1Å; H294-Y312 HydrophobicContact CB-CG 4.28Å; H294-S329 PolarHBondContact CE1-O 2.92Å; H294-S329 PolarHBondContact NE2-O 2.86Å; H294-N333 WeakPolarHBondContact CA-OD1 2.96Å; H294-N333 PolarHBondContact ND1-ND2 2.81Å; H294-N333 VanDerWaalsContact ND1-ND2 3.17Å
295	M	96.8	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125.2	-162.2	-67.8	-61.5	-50	0	0	112.1	C278 L281 L293 S297 P299 N333 L334 W335	C278-M295 PolarHBondContact SG-SD 3.42Å; L281-M295 HydrophobicContact CB-CE 3.44Å; L281-M295 VanDerWaalsContact CB-CE 3.44Å; L281-M295 HydrophobicContact CB-SD 3.84Å; L281-M295 HydrophobicContact CD2-SD 4.2Å; L293-M295 HydrophobicContact CB-CG 3.93Å; L293-M295 HydrophobicContact CB-SD 4.46Å; L293-M295 HydrophobicContact CD1-CG 4.48Å; M295-S297 WeakPolarHBondContact CB-O 3.44Å; M295-S297 WeakPolarHBondContact CE-O 3.07Å; M295-P299 HydrophobicContact CE-CG 4.12Å; M295-P299 HydrophobicContact CG-CG 3.83Å; M295-P299 HydrophobicContact SD-CG 4.31Å; M295-N333 PolarHBondContact N-OD1 2.85Å; M295-N333 WeakPolarHBondContact O-CA 3.37Å; M295-L334 HydrophobicContact CB-CB 4.47Å; M295-L334 PolarHBondContact O-N 2.78Å; M295-W335 HydrophobicContact CG-CB 4.39Å
296	A	94.8	Very high	95.9	Very high	39 Å²	39	35.9 Å²	35.9	32%	0.322	19%	0.185	S	C	.	.	S	Bend	trans	-79.9	-19.6	170.9	0	0	0	0	0	113.3	C278 R279 L328	C278-A296 PolarHBondContact O-N 2.8Å; R279-A296 HydrophobicContact CG-CB 4.28Å; A296-L328 HydrophobicContact CB-CD2 3.79Å
297	S	94.6	Very high	95.9	Very high	42 Å²	42	36 Å²	36	29%	0.294	19%	0.185	S	C	.	.	S	Bend	trans	-136	164.6	176.8	69.9	0	0	0	0	111.1	R279 M295 P299	R279-S297 WeakPolarHBondContact O-CB 3.33Å; R279-S297 PolarHBondContact O-N 2.96Å; R279-S297 PolarHBondContact O-OG 2.87Å; M295-S297 WeakPolarHBondContact CB-O 3.44Å; M295-S297 WeakPolarHBondContact CE-O 3.07Å; S297-P299 WeakPolarHBondContact O-CD 3.4Å
298	R	95.7	Very high	95.9	Very high	121 Å²	121	38.7 Å²	38.7	46%	0.457	19%	0.194	S	C	.	.			trans	-61.5	124.7	179.8	-66.2	-172	175	-162.7	-4.4	111.3	L334 E337 D339	R298-L334 HydrophobicContact CG-CD1 4.36Å; R298-E337 VanDerWaalsContact CB-O 3.25Å; R298-E337 WeakPolarHBondContact CB-O 3.46Å; R298-E337 HydrophobicContact CG-CB 3.98Å; R298-E337 WeakPolarHBondContact CG-O 3.5Å; R298-E337 IonicContact CZ-OE2 2.75Å; R298-E337 IonicContact NE-OE2 2.8Å; R298-E337 PolarHBondContact NE-OE2 2.86Å; R298-E337 IonicContact NH2-OE1 3.42Å; R298-E337 IonicContact NH2-OE2 3.74Å; R298-E337 PolarHBondContact NH2-OE2 3.43Å; R298-D339 WeakPolarHBondContact CD-OD2 3.15Å
299	P	97.1	Very high	95.9	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.013	18%	0.176	C	C	.	.			trans	-58.7	139.8	169.8	-25.2	35.5	0	0	0	111.3	L281 L293 M295 S297 E337 V338 D339	L281-P299 HydrophobicContact CB-CB 4.29Å; L281-P299 HydrophobicContact CD2-CB 4.12Å; L281-P299 HydrophobicContact CD2-CG 4.45Å; L281-P299 HydrophobicContact CG-CB 4.36Å; L293-P299 HydrophobicContact CD1-CG 4.27Å; M295-P299 HydrophobicContact CE-CG 4.12Å; M295-P299 HydrophobicContact CG-CG 3.83Å; M295-P299 HydrophobicContact SD-CG 4.31Å; S297-P299 WeakPolarHBondContact O-CD 3.4Å; P299-E337 WeakPolarHBondContact CD-O 3.43Å; P299-V338 HydrophobicContact CB-CG1 4.3Å; P299-V338 HydrophobicContact CB-CG2 4.15Å; P299-V338 HydrophobicContact CG-CG2 4.22Å; P299-V338 WeakPolarHBondContact O-CA 3.41Å; P299-D339 PolarHBondContact O-N 2.81Å
300	I	95.7	Very high	95.8	Very high	36 Å²	36	35.4 Å²	35.4	19%	0.185	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.6	176.8	-65.2	173.9	0	0	0	108.6	L281 R282 I283 D339 F341	L281-I300 PolarHBondContact O-N 3.31Å; R282-I300 CarbonylContact C-O 3.53Å; R282-I300 WeakPolarHBondContact CA-O 3.22Å; R282-I300 HydrophobicContact CG-CB 4.43Å; I283-I300 PolarHBondContact N-O 2.81Å; I300-D339 WeakPolarHBondContact CA-O 3.48Å; I300-D339 HydrophobicContact CG1-CB 4.44Å; I300-F341 HydrophobicContact CB-CE2 4.45Å; I300-F341 HydrophobicContact CD1-CE2 4.46Å; I300-F341 HydrophobicContact CG1-CE2 4.18Å; I300-F341 HydrophobicContact CG2-CD2 3.63Å; I300-F341 HydrophobicContact CG2-CE2 3.62Å
301	I	95.3	Very high	95.7	Very high	2 Å²	2	33 Å²	33	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.7	173.9	71.9	171.3	0	0	0	110.5	I283 C304 L307 V338 D339 D340 F341 N354 W355	I283-I301 HydrophobicContact CB-CG2 4.11Å; I283-I301 HydrophobicContact CD1-CG2 4.17Å; I283-I301 HydrophobicContact CG1-CG2 4.31Å; I283-I301 WeakPolarHBondContact O-CA 3.49Å; I301-C304 HydrophobicContact CB-CB 4.26Å; I301-C304 HydrophobicContact CD1-CB 4.37Å; I301-L307 HydrophobicContact CB-CD1 4.19Å; I301-L307 HydrophobicContact CD1-CD1 4Å; I301-L307 HydrophobicContact CG2-CD1 3.73Å; I301-V338 HydrophobicContact CB-CG1 4.39Å; I301-V338 HydrophobicContact CD1-CG1 4.02Å; I301-V338 HydrophobicContact CG1-CG1 3.94Å; I301-V338 HydrophobicContact CG2-CG1 3.65Å; I301-D339 PolarHBondContact N-O 2.93Å; I301-D340 HydrophobicContact CD1-CB 3.83Å; I301-D340 HydrophobicContact CG1-CB 3.66Å; I301-F341 PolarHBondContact O-N 3.17Å; I301-N354 HydrophobicContact CD1-CB 4.34Å; I301-W355 HydrophobicContact CD1-CB 4.1Å; I301-W355 HydrophobicContact CD1-CG 4.09Å
302	E	93	Very high	95.6	Very high	69 Å²	69	34.1 Å²	34.1	32%	0.322	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	134.5	176.2	-179.7	174.2	168.7	0	0	110.1	I283 H284 Q285 C304	I283-E302 PolarHBondContact O-N 2.92Å; H284-E302 CarbonylContact C-O 3.59Å; H284-E302 VanDerWaalsContact CA-O 3.31Å; H284-E302 WeakPolarHBondContact CA-O 3.11Å; H284-E302 IonicContact CD2-OE2 2.7Å; H284-E302 IonicContact NE2-OE2 3.25Å; H284-E302 PolarHBondContact NE2-OE2 3.01Å; Q285-E302 PolarHBondContact N-O 2.86Å; E302-C304 PolarHBondContact O-N 3Å; E302-C304 VanDerWaalsContact O-N 3.13Å; E302-C304 PolarHBondContact O-SG 2.92Å
303	Q	91.5	Very high	95.2	Very high	109 Å²	109	36.3 Å²	36.3	51%	0.509	18%	0.184	S	C	.	.	S	Bend	trans	53.5	34	179.9	-62.1	167.1	40.6	0	0	112.5	Q285 S342	Q285-Q303 VanDerWaalsContact CA-O 3.32Å; Q285-Q303 WeakPolarHBondContact CA-O 3.17Å; Q285-Q303 HydrophobicContact CG-CB 4.14Å; Q303-S342 PolarHBondContact N-OG 2.72Å
304	C	94.1	Very high	94.9	Very high	1 Å²	1	37 Å²	37	1%	0.007	19%	0.187	C	C	.	.			trans	-102.5	154.9	-179.1	-65.5	0	0	0	0	110.9	T286 I301 E302 L307 N354	T286-C304 CarbonylContact O-C 3.6Å; T286-C304 WeakPolarHBondContact O-CA 3.29Å; T286-C304 VanDerWaalsContact O-CB 3.3Å; T286-C304 WeakPolarHBondContact O-CB 3.29Å; I301-C304 HydrophobicContact CB-CB 4.26Å; I301-C304 HydrophobicContact CD1-CB 4.37Å; E302-C304 PolarHBondContact O-N 3Å; E302-C304 VanDerWaalsContact O-N 3.13Å; E302-C304 PolarHBondContact O-SG 2.92Å; C304-L307 HydrophobicContact CB-CD1 3.57Å; C304-L307 HydrophobicContact CB-CD2 4.48Å; C304-L307 HydrophobicContact CB-CG 3.95Å; C304-N354 VanDerWaalsContact O-CB 3.26Å; C304-N354 WeakPolarHBondContact O-CB 3.1Å; C304-N354 PolarHBondContact O-OD1 2.82Å
305	T	93.3	Very high	94.6	Very high	72 Å²	72	42.4 Å²	42.4	44%	0.442	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-141.2	142.6	177.8	54.3	0	0	0	0	112	T286 S287 N288 L307	T286-T305 PolarHBondContact O-N 3.4Å; S287-T305 CarbonylContact C-O 3.54Å; S287-T305 VanDerWaalsContact CA-O 3.24Å; S287-T305 WeakPolarHBondContact CA-O 3.3Å; S287-T305 VanDerWaalsContact CB-OG1 3.25Å; S287-T305 WeakPolarHBondContact CB-OG1 3.34Å; N288-T305 PolarHBondContact N-O 3.31Å; T305-L307 VanDerWaalsContact C-N 3.3Å; T305-L307 PolarHBondContact O-N 3.13Å
306	N	94.1	Very high	94.4	Very high	74 Å²	74	44.3 Å²	44.3	40%	0.396	23%	0.229	S	C	.	.	S	Bend	trans	50.3	45.4	178.7	-170.9	33.7	0	0	0	113.9	N288 N354	N288-N306 WeakPolarHBondContact CA-O 3.49Å; N288-N306 WeakPolarHBondContact OD1-CB 3.39Å; N288-N306 PolarHBondContact OD1-ND2 3.4Å; N306-N354 PolarHBondContact N-O 2.85Å; N306-N354 VanDerWaalsContact N-O 3.1Å
307	L	97	Very high	94.2	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.4	170.2	-60.5	-173.6	0	0	0	110	I283 T286 C289 L291 I301 C304 T305 N354 W355 C356	I283-L307 HydrophobicContact CD1-CD1 4.39Å; T286-L307 HydrophobicContact CG2-CD2 3.89Å; C289-L307 HydrophobicContact CB-CD2 3.88Å; C289-L307 WeakPolarHBondContact O-CA 3.47Å; L291-L307 HydrophobicContact CD1-CD1 4.48Å; I301-L307 HydrophobicContact CB-CD1 4.19Å; I301-L307 HydrophobicContact CD1-CD1 4Å; I301-L307 HydrophobicContact CG2-CD1 3.73Å; C304-L307 HydrophobicContact CB-CD1 3.57Å; C304-L307 HydrophobicContact CB-CD2 4.48Å; C304-L307 HydrophobicContact CB-CG 3.95Å; T305-L307 VanDerWaalsContact C-N 3.3Å; T305-L307 PolarHBondContact O-N 3.13Å; L307-N354 PolarHBondContact N-O 2.77Å; L307-W355 HydrophobicContact CB-CB 3.9Å; L307-W355 CarbonylContact O-C 3.58Å; L307-W355 WeakPolarHBondContact O-CA 3.45Å; L307-C356 PolarHBondContact O-N 3.42Å
308	K	96.8	Very high	94.1	Very high	83 Å²	83	52.8 Å²	52.8	36%	0.361	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.6	175.9	-52.4	-174.9	175.8	177.4	0	109.9	C289 R290 L291 C356 I358	C289-K308 PolarHBondContact O-N 2.7Å; R290-K308 CarbonylContact C-O 3.51Å; R290-K308 WeakPolarHBondContact CA-O 3.29Å; R290-K308 HydrophobicContact CG-CB 4.39Å; L291-K308 PolarHBondContact N-O 2.9Å; K308-C356 CarbonylContact C-O 3.53Å; K308-C356 VanDerWaalsContact CA-O 3.31Å; K308-C356 WeakPolarHBondContact CA-O 3.37Å; K308-I358 HydrophobicContact CB-CD1 3.78Å; K308-I358 HydrophobicContact CB-CG1 3.41Å; K308-I358 VanDerWaalsContact CB-CG1 3.41Å; K308-I358 HydrophobicContact CD-CG1 4.42Å
309	V	97.6	Very high	94	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	143.3	-176.5	-58.4	0	0	0	0	111.7	L291 W335 V338 W355 C356 I357 I358	L291-V309 HydrophobicContact CB-CG1 4.27Å; L291-V309 HydrophobicContact CD1-CG1 4.12Å; L291-V309 CarbonylContact O-C 3.59Å; L291-V309 WeakPolarHBondContact O-CA 3.26Å; V309-W335 HydrophobicContact CB-CE3 4.37Å; V309-W335 HydrophobicContact CG2-CE3 4.23Å; V309-W335 HydrophobicContact CG2-CZ3 4.1Å; V309-V338 HydrophobicContact CG1-CG2 4.04Å; V309-W355 HydrophobicContact CG2-CE3 3.71Å; V309-W355 HydrophobicContact CG2-CZ3 3.72Å; V309-C356 PolarHBondContact N-O 2.89Å; V309-I357 HydrophobicContact CG2-CG1 3.95Å; V309-I357 CarbonylContact O-C 3.54Å; V309-I357 WeakPolarHBondContact O-CA 3.5Å; V309-I358 PolarHBondContact O-N 3.23Å
310	A	97	Very high	93.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	161.5	176.5	0	0	0	0	0	108.9	L291 G292 L293 W335 I358 W363 L366	L291-A310 PolarHBondContact O-N 2.78Å; G292-A310 WeakPolarHBondContact CA-O 3.39Å; L293-A310 PolarHBondContact N-O 2.8Å; A310-W335 VanDerWaalsContact CA-CZ3 3.48Å; A310-I358 HydrophobicContact CB-CB 4.25Å; A310-I358 HydrophobicContact CB-CD1 3.97Å; A310-I358 HydrophobicContact CB-CG1 4.42Å; A310-W363 HydrophobicContact CB-CG 4.19Å; A310-L366 HydrophobicContact CB-CD1 3.67Å
311	P	96.1	Very high	93.8	Very high	19 Å²	19	58.3 Å²	58.3	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	155.4	171.1	26.7	-31.2	0	0	0	110.5	L293 Q313 W335 W363	L293-P311 CarbonylContact O-C 3.52Å; P311-Q313 WeakPolarHBondContact O-CG 3.28Å; P311-Q313 PolarHBondContact O-N 3.01Å; P311-W335 HydrophobicContact CB-CD2 4.22Å; P311-W335 HydrophobicContact CB-CZ2 4.22Å; P311-W335 HydrophobicContact CG-CZ2 4.16Å; P311-W363 VanDerWaalsContact CD-CE2 3.47Å; P311-W363 HydrophobicContact CG-CD2 3.73Å; P311-W363 HydrophobicContact CG-CE3 3.52Å; P311-W363 HydrophobicContact CG-CG 4.45Å; P311-W363 HydrophobicContact CG-CH2 4.05Å; P311-W363 HydrophobicContact CG-CZ2 4.22Å; P311-W363 HydrophobicContact CG-CZ3 3.7Å
312	Y	95	Very high	93.8	Very high	27 Å²	27	59.3 Å²	59.3	11%	0.106	30%	0.298	C	S	.	.			trans	-61.2	126.1	174.5	-177.9	-105.2	0	0	0	111.3	A257 V275 F276 A277 L293 H294 L314 L319	A257-Y312 PolarHBondContact O-OH 3.3Å; A257-Y312 VanDerWaalsContact O-OH 3.08Å; V275-Y312 HydrophobicContact CG1-CD2 3.75Å; V275-Y312 HydrophobicContact CG1-CE2 3.95Å; F276-Y312 VanDerWaalsContact C-CD2 3.42Å; F276-Y312 VanDerWaalsContact CA-CE2 3.5Å; A277-Y312 HydrophobicContact CB-CE2 4.49Å; L293-Y312 PolarHBondContact O-N 3.04Å; H294-Y312 HydrophobicContact CB-CG 4.28Å; Y312-L314 HydrophobicContact CE1-CB 3.83Å; Y312-L314 WeakPolarHBondContact CE1-O 3.45Å; Y312-L314 HydrophobicContact CE2-CB 4.03Å; Y312-L314 HydrophobicContact CE2-CD1 3.79Å; Y312-L314 HydrophobicContact CE2-CG 3.97Å; Y312-L314 WeakPolarHBondContact OH-CB 3.45Å; Y312-L319 HydrophobicContact CE1-CD1 3.73Å
313	Q	89.1	Confident	93.9	Very high	45 Å²	45	56.5 Å²	56.5	21%	0.21	29%	0.285	C	S	.	.			trans	-112.4	-2	-171.8	-67.2	-62	-13.3	0	0	114.9	P311 V315 W363 C367	P311-Q313 WeakPolarHBondContact O-CG 3.28Å; P311-Q313 PolarHBondContact O-N 3.01Å; Q313-V315 PolarHBondContact O-N 2.94Å; Q313-W363 HydrophobicContact CG-CB 4.45Å; Q313-C367 VanDerWaalsContact CB-SG 3.58Å
314	L	91.5	Very high	94	Very high	14 Å²	14	56.4 Å²	56.4	7%	0.073	29%	0.292	C	S	.	.			trans	-73.7	115.5	179.4	-59.6	177.1	0	0	0	110	Y256 V275 Y312 Y316 P368	Y256-L314 HydrophobicContact CD1-CD2 3.89Å; Y256-L314 HydrophobicContact CG-CD2 4.34Å; V275-L314 HydrophobicContact CG1-CD1 4.05Å; V275-L314 HydrophobicContact CG1-CD2 4.41Å; V275-L314 HydrophobicContact CG1-CG 3.76Å; Y312-L314 HydrophobicContact CE1-CB 3.83Å; Y312-L314 WeakPolarHBondContact CE1-O 3.45Å; Y312-L314 HydrophobicContact CE2-CB 4.03Å; Y312-L314 HydrophobicContact CE2-CD1 3.79Å; Y312-L314 HydrophobicContact CE2-CG 3.97Å; Y312-L314 WeakPolarHBondContact OH-CB 3.45Å; L314-Y316 HydrophobicContact CB-CD1 4.41Å; L314-P368 HydrophobicContact CD2-CG 3.85Å
315	V	90.6	Very high	94	Very high	131 Å²	131	59.9 Å²	59.9	79%	0.794	31%	0.313	S	S	*	.			trans	-111.2	121.6	175.1	-177.7	0	0	0	0	109	Q313	Q313-V315 PolarHBondContact O-N 2.94Å
316	Y	92.5	Very high	94	Very high	40 Å²	40	56.4 Å²	56.4	16%	0.157	29%	0.292	C	S	.	.			trans	-152.3	163.9	177.7	62.4	-88.1	0	0	0	110.3	Y258 P259 L314 S318 L319 D322	Y258-Y316 HydrophobicContact CD1-CD1 4.11Å; Y258-Y316 AromaticContact CD1-CE1 3.5Å; Y258-Y316 HydrophobicContact CD1-CE1 3.5Å; Y258-Y316 HydrophobicContact CD1-CE2 4.22Å; Y258-Y316 AromaticContact CD1-CZ 3.57Å; Y258-Y316 HydrophobicContact CD2-CD2 4.5Å; Y258-Y316 HydrophobicContact CD2-CE1 4.39Å; Y258-Y316 AromaticContact CD2-CE2 3.69Å; Y258-Y316 HydrophobicContact CD2-CE2 3.69Å; Y258-Y316 AromaticContact CD2-CZ 3.61Å; Y258-Y316 WeakPolarHBondContact CD2-OH 3.33Å; Y258-Y316 AromaticContact CE1-CD1 3.66Å; Y258-Y316 HydrophobicContact CE1-CD1 3.66Å; Y258-Y316 HydrophobicContact CE1-CD2 4.08Å; Y258-Y316 AromaticContact CE1-CE1 3.54Å; Y258-Y316 HydrophobicContact CE1-CE1 3.54Å; Y258-Y316 AromaticContact CE1-CE2 3.98Å; Y258-Y316 HydrophobicContact CE1-CE2 3.98Å; Y258-Y316 AromaticContact CE1-CG 3.92Å; Y258-Y316 HydrophobicContact CE1-CG 3.92Å; Y258-Y316 AromaticContact CE1-CZ 3.71Å; Y258-Y316 AromaticContact CE2-CD2 3.82Å; Y258-Y316 HydrophobicContact CE2-CD2 3.82Å; Y258-Y316 HydrophobicContact CE2-CE1 4.43Å; Y258-Y316 AromaticContact CE2-CE2 3.43Å; Y258-Y316 HydrophobicContact CE2-CE2 3.43Å; Y258-Y316 VanDerWaalsContact CE2-CE2 3.43Å; Y258-Y316 HydrophobicContact CE2-CG 4.48Å; Y258-Y316 AromaticContact CE2-CZ 3.76Å; Y258-Y316 AromaticContact CG-CE1 3.97Å; Y258-Y316 HydrophobicContact CG-CE1 3.97Å; Y258-Y316 HydrophobicContact CG-CE2 4.1Å; Y258-Y316 AromaticContact CG-CZ 3.53Å; Y258-Y316 VanDerWaalsContact CG-OH 3.27Å; Y258-Y316 AromaticContact CZ-CD2 3.57Å; Y258-Y316 AromaticContact CZ-CE2 3.58Å; Y258-Y316 AromaticContact CZ-CG 3.81Å; Y258-Y316 AromaticContact CZ-CZ 3.8Å; P259-Y316 WeakPolarHBondContact CD-OH 3.31Å; L314-Y316 HydrophobicContact CB-CD1 4.41Å; Y316-S318 VanDerWaalsContact C-N 3.34Å; Y316-S318 WeakPolarHBondContact CD2-OG 3.43Å; Y316-S318 VanDerWaalsContact CE2-OG 3.27Å; Y316-S318 WeakPolarHBondContact CE2-OG 3.32Å; Y316-S318 PolarHBondContact O-N 3.07Å; Y316-L319 HydrophobicContact CD1-CB 4.28Å; Y316-L319 HydrophobicContact CD1-CD1 4.48Å; Y316-L319 HydrophobicContact CD2-CB 4.38Å; Y316-L319 HydrophobicContact CE1-CB 4.05Å; Y316-L319 HydrophobicContact CE1-CD1 3.67Å; Y316-L319 HydrophobicContact CE1-CG 4.41Å; Y316-L319 HydrophobicContact CE2-CB 4.14Å; Y316-L319 VanDerWaalsContact CE2-N 3.35Å; Y316-L319 HydrophobicContact CG-CB 4.44Å; Y316-L319 WeakPolarHBondContact O-CB 3.49Å; Y316-L319 PolarHBondContact O-N 3.33Å; Y316-D322 WeakPolarHBondContact CE2-OD2 3.3Å; Y316-D322 WeakPolarHBondContact OH-CB 3.47Å; Y316-D322 PolarHBondContact OH-OD2 3.02Å
317	K	91.3	Very high	93.9	Very high	217 Å²	217	55.6 Å²	55.6	94%	0.943	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-37	-165.1	-173.8	179.7	177	-176.6	0	114.8
318	S	92.1	Very high	93.8	Very high	42 Å²	42	55.9 Å²	55.9	29%	0.294	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	11.3	-177.1	55.3	0	0	0	0	114	Y316 D320 Q321 D322	Y316-S318 VanDerWaalsContact C-N 3.34Å; Y316-S318 WeakPolarHBondContact CD2-OG 3.43Å; Y316-S318 VanDerWaalsContact CE2-OG 3.27Å; Y316-S318 WeakPolarHBondContact CE2-OG 3.32Å; Y316-S318 PolarHBondContact O-N 3.07Å; S318-D320 PolarHBondContact O-N 3.33Å; S318-Q321 PolarHBondContact O-N 3.42Å; S318-Q321 VanDerWaalsContact O-N 3.11Å; S318-D322 PolarHBondContact O-N 3.29Å; S318-D322 PolarHBondContact OG-OD2 3.27Å
319	L	94.1	Very high	93.4	Very high	28 Å²	28	54.4 Å²	54.4	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-53.3	-49.3	-173.8	175	61.9	0	0	0	113.2	P259 Y312 Y316 Q321 D322 L323	P259-L319 HydrophobicContact CG-CD1 4.33Å; Y312-L319 HydrophobicContact CE1-CD1 3.73Å; Y316-L319 HydrophobicContact CD1-CB 4.28Å; Y316-L319 HydrophobicContact CD1-CD1 4.48Å; Y316-L319 HydrophobicContact CD2-CB 4.38Å; Y316-L319 HydrophobicContact CE1-CB 4.05Å; Y316-L319 HydrophobicContact CE1-CD1 3.67Å; Y316-L319 HydrophobicContact CE1-CG 4.41Å; Y316-L319 HydrophobicContact CE2-CB 4.14Å; Y316-L319 VanDerWaalsContact CE2-N 3.35Å; Y316-L319 HydrophobicContact CG-CB 4.44Å; Y316-L319 WeakPolarHBondContact O-CB 3.49Å; Y316-L319 PolarHBondContact O-N 3.33Å; L319-Q321 VanDerWaalsContact C-N 3.31Å; L319-Q321 PolarHBondContact O-N 2.72Å; L319-D322 PolarHBondContact O-N 3.1Å; L319-L323 HydrophobicContact CD1-CD1 4.07Å; L319-L323 HydrophobicContact CD1-CG 4.08Å; L319-L323 HydrophobicContact CG-CD1 4.07Å; L319-L323 WeakPolarHBondContact O-CB 3.34Å; L319-L323 WeakPolarHBondContact O-CG 3.3Å; L319-L323 PolarHBondContact O-N 3.16Å
320	D	93.5	Very high	92.7	Very high	111 Å²	111	58.1 Å²	58.1	59%	0.594	33%	0.326	S	S	*	.	H	α-helix	trans	-64.3	-37	-178.4	-63.6	-37.8	0	0	0	112.3	S318 T324	S318-D320 PolarHBondContact O-N 3.33Å; D320-T324 WeakPolarHBondContact O-CB 3Å; D320-T324 PolarHBondContact O-N 2.75Å; D320-T324 VanDerWaalsContact O-N 3.08Å; D320-T324 PolarHBondContact O-OG1 2.8Å
321	Q	94.2	Very high	92	Very high	137 Å²	137	65.4 Å²	65.4	64%	0.64	37%	0.365	S	S	*	.	H	α-helix	trans	-68.9	-40.3	176.4	-176.8	176.9	1.6	0	0	111.2	S318 L319 T324 T325	S318-Q321 PolarHBondContact O-N 3.42Å; S318-Q321 VanDerWaalsContact O-N 3.11Å; L319-Q321 VanDerWaalsContact C-N 3.31Å; L319-Q321 PolarHBondContact O-N 2.72Å; Q321-T324 PolarHBondContact O-N 2.66Å; Q321-T325 WeakPolarHBondContact O-CB 3.4Å; Q321-T325 PolarHBondContact O-N 2.89Å; Q321-T325 PolarHBondContact O-OG1 3.2Å
322	D	95.2	Very high	91.4	Very high	23 Å²	23	67.1 Å²	67.1	12%	0.123	38%	0.377	C	S	.	.	H	α-helix	trans	-71.1	-38.2	179.4	-70.7	-12.2	0	0	0	111.8	V241 Y258 P259 Y316 S318 L319 T324 T325 A326	V241-D322 HydrophobicContact CG2-CB 3.61Å; Y258-D322 VanDerWaalsContact CD2-OD2 3.3Å; Y258-D322 WeakPolarHBondContact CD2-OD2 3.36Å; P259-D322 HydrophobicContact CG-CB 4.02Å; Y316-D322 WeakPolarHBondContact CE2-OD2 3.3Å; Y316-D322 WeakPolarHBondContact OH-CB 3.47Å; Y316-D322 PolarHBondContact OH-OD2 3.02Å; S318-D322 PolarHBondContact O-N 3.29Å; S318-D322 PolarHBondContact OG-OD2 3.27Å; L319-D322 PolarHBondContact O-N 3.1Å; D322-T324 VanDerWaalsContact C-N 3.33Å; D322-T325 PolarHBondContact O-N 2.63Å; D322-A326 VanDerWaalsContact O-CB 3.25Å; D322-A326 WeakPolarHBondContact O-CB 3.45Å; D322-A326 PolarHBondContact O-N 3.07Å
323	L	95.1	Very high	91.2	Very high	10 Å²	10	67.7 Å²	67.7	5%	0.052	38%	0.382	C	S	.	.	H	α-helix	trans	-59.3	-46.6	171.2	-75.5	171	0	0	0	110.7	P259 A277 L319 T325 A326 G327 L328 T330	P259-L323 HydrophobicContact CB-CD2 4.16Å; P259-L323 HydrophobicContact CG-CD2 3.67Å; P259-L323 HydrophobicContact CG-CG 3.92Å; A277-L323 HydrophobicContact CB-CD2 4.07Å; L319-L323 HydrophobicContact CD1-CD1 4.07Å; L319-L323 HydrophobicContact CD1-CG 4.08Å; L319-L323 HydrophobicContact CG-CD1 4.07Å; L319-L323 WeakPolarHBondContact O-CB 3.34Å; L319-L323 WeakPolarHBondContact O-CG 3.3Å; L319-L323 PolarHBondContact O-N 3.16Å; L323-T325 PolarHBondContact O-N 2.91Å; L323-A326 PolarHBondContact O-N 2.8Å; L323-G327 PolarHBondContact O-N 2.86Å; L323-G327 VanDerWaalsContact O-N 3.13Å; L323-L328 CarbonylContact C-O 3.53Å; L323-L328 HydrophobicContact CD2-CB 3.95Å; L323-L328 HydrophobicContact CD2-CD1 4.04Å; L323-L328 PolarHBondContact O-N 2.76Å; L323-T330 HydrophobicContact CD1-CG2 4.06Å
324	T	94.3	Very high	91.5	Very high	107 Å²	107	68 Å²	68	66%	0.656	39%	0.385	S	S	*	.	H	α-helix	trans	-61.5	-44.7	176.4	-56.5	0	0	0	0	111.4	D320 Q321 D322 A326 G327	D320-T324 WeakPolarHBondContact O-CB 3Å; D320-T324 PolarHBondContact O-N 2.75Å; D320-T324 VanDerWaalsContact O-N 3.08Å; D320-T324 PolarHBondContact O-OG1 2.8Å; Q321-T324 PolarHBondContact O-N 2.66Å; D322-T324 VanDerWaalsContact C-N 3.33Å; T324-A326 VanDerWaalsContact C-N 3.32Å; T324-A326 PolarHBondContact O-N 3.21Å; T324-G327 PolarHBondContact O-N 2.84Å
325	T	93.2	Very high	91.6	Very high	73 Å²	73	68.8 Å²	68.8	45%	0.448	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-38	178.5	-57.4	0	0	0	0	111.7	I222 V241 Q321 D322 L323 G327	I222-T325 HydrophobicContact CD1-CG2 4.45Å; I222-T325 WeakPolarHBondContact CD1-O 3.34Å; V241-T325 HydrophobicContact CB-CG2 4.49Å; V241-T325 HydrophobicContact CG1-CG2 4.32Å; Q321-T325 WeakPolarHBondContact O-CB 3.4Å; Q321-T325 PolarHBondContact O-N 2.89Å; Q321-T325 PolarHBondContact O-OG1 3.2Å; D322-T325 PolarHBondContact O-N 2.63Å; L323-T325 PolarHBondContact O-N 2.91Å; T325-G327 PolarHBondContact O-N 2.84Å
326	A	94	Very high	91.8	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-71.9	-12.1	175	0	0	0	0	0	113.3	V241 P259 S261 D322 L323 T324 L328	V241-A326 HydrophobicContact CG1-CB 3.99Å; P259-A326 HydrophobicContact CB-CB 3.7Å; S261-A326 WeakPolarHBondContact CA-O 3.19Å; S261-A326 PolarHBondContact OG-O 2.94Å; D322-A326 VanDerWaalsContact O-CB 3.25Å; D322-A326 WeakPolarHBondContact O-CB 3.45Å; D322-A326 PolarHBondContact O-N 3.07Å; L323-A326 PolarHBondContact O-N 2.8Å; T324-A326 VanDerWaalsContact C-N 3.32Å; T324-A326 PolarHBondContact O-N 3.21Å; A326-L328 HydrophobicContact CB-CD1 4.18Å; A326-L328 HydrophobicContact CB-CG 4.14Å
327	G	92.7	Very high	91.8	Very high	57 Å²	57	67.3 Å²	67.3	59%	0.588	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	27.9	-174.8	0	0	0	0	0	113.2	L323 T324 T325	L323-G327 PolarHBondContact O-N 2.86Å; L323-G327 VanDerWaalsContact O-N 3.13Å; T324-G327 PolarHBondContact O-N 2.84Å; T325-G327 PolarHBondContact O-N 2.84Å
328	L	93.3	Very high	91.9	Very high	8 Å²	8	57.7 Å²	57.7	4%	0.042	33%	0.332	C	S	.	.			trans	-102.2	133.5	177.4	-64.3	176.3	0	0	0	110.1	P259 A277 R279 A296 L323 A326	P259-L328 HydrophobicContact CB-CD1 4.19Å; A277-L328 HydrophobicContact CB-CD1 3.84Å; R279-L328 HydrophobicContact CB-CD2 4.39Å; R279-L328 HydrophobicContact CG-CD2 3.43Å; R279-L328 VanDerWaalsContact CG-CD2 3.43Å; R279-L328 HydrophobicContact CG-CG 4.43Å; A296-L328 HydrophobicContact CB-CD2 3.79Å; L323-L328 CarbonylContact C-O 3.53Å; L323-L328 HydrophobicContact CD2-CB 3.95Å; L323-L328 HydrophobicContact CD2-CD1 4.04Å; L323-L328 PolarHBondContact O-N 2.76Å; A326-L328 HydrophobicContact CB-CD1 4.18Å; A326-L328 HydrophobicContact CB-CG 4.14Å
329	S	88.9	Confident	91.9	Very high	52 Å²	52	57.3 Å²	57.3	36%	0.364	33%	0.327	S	S	.	.			trans	-84.2	146.6	173.5	98.8	0	0	0	0	110.5	H294 N331 S332	H294-S329 PolarHBondContact CE1-O 2.92Å; H294-S329 PolarHBondContact NE2-O 2.86Å; S329-N331 VanDerWaalsContact C-N 3.31Å; S329-N331 PolarHBondContact OG-N 3.21Å; S329-S332 WeakPolarHBondContact OG-CB 3.36Å; S329-S332 PolarHBondContact OG-N 3.12Å; S329-S332 PolarHBondContact OG-OG 2.76Å
330	T	82.8	Confident	91.7	Very high	79 Å²	79	56.3 Å²	56.3	49%	0.485	32%	0.321	S	S	.	.	S	Bend	trans	-71	-27.5	174.3	51.9	0	0	0	0	112.4	L323	L323-T330 HydrophobicContact CD1-CG2 4.06Å
331	N	81.6	Confident	91.4	Very high	154 Å²	154	55.7 Å²	55.7	82%	0.824	31%	0.314	S	S	*	.	S	Bend	trans	-91.6	-26.3	-170.5	-61.3	-22.6	0	0	0	113.7	S329	S329-N331 VanDerWaalsContact C-N 3.31Å; S329-N331 PolarHBondContact OG-N 3.21Å
332	S	85.2	Confident	90.9	Very high	54 Å²	54	50.8 Å²	50.8	38%	0.378	29%	0.294	S	S	.	.			trans	-97.5	109.3	178.3	68.9	0	0	0	0	110.3	S329	S329-S332 WeakPolarHBondContact OG-CB 3.36Å; S329-S332 PolarHBondContact OG-N 3.12Å; S329-S332 PolarHBondContact OG-OG 2.76Å
333	N	90.5	Very high	89.9	Confident	39 Å²	39	50.4 Å²	50.4	21%	0.209	29%	0.293	C	S	.	.			trans	-139.8	105.6	179.4	-169	-0.9	0	0	0	112.3	H294 M295 W335 H336	H294-N333 WeakPolarHBondContact CA-OD1 2.96Å; H294-N333 PolarHBondContact ND1-ND2 2.81Å; H294-N333 VanDerWaalsContact ND1-ND2 3.17Å; M295-N333 PolarHBondContact N-OD1 2.85Å; M295-N333 WeakPolarHBondContact O-CA 3.37Å; N333-W335 VanDerWaalsContact ND2-CD1 3.34Å; N333-W335 WeakPolarHBondContact OD1-CB 3.34Å; N333-W335 VanDerWaalsContact OD1-CD1 3.3Å; N333-W335 PolarHBondContact OD1-N 3.33Å; N333-H336 PolarHBondContact O-CE1 3.49Å
334	L	94.1	Very high	88.5	Confident	51 Å²	51	53.2 Å²	53.2	27%	0.267	31%	0.312	S	S	.	.			trans	-98.1	24	-176.3	-59.7	178.2	0	0	0	113.3	M295 R298 H336 E337	M295-L334 HydrophobicContact CB-CB 4.47Å; M295-L334 PolarHBondContact O-N 2.78Å; R298-L334 HydrophobicContact CG-CD1 4.36Å; L334-H336 PolarHBondContact O-N 3.08Å; L334-E337 HydrophobicContact CB-CB 4.47Å; L334-E337 HydrophobicContact CD2-CG 4.39Å; L334-E337 PolarHBondContact O-N 3.39Å
335	W	95.2	Very high	86.9	Confident	31 Å²	31	49.9 Å²	49.9	12%	0.117	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-27.5	-177	68	-87.2	0	0	0	114.6	L293 M295 V309 A310 P311 N333 I357 W363	L293-W335 HydrophobicContact CB-CB 3.86Å; L293-W335 VanDerWaalsContact O-CB 3.22Å; L293-W335 WeakPolarHBondContact O-CB 3.42Å; M295-W335 HydrophobicContact CG-CB 4.39Å; V309-W335 HydrophobicContact CB-CE3 4.37Å; V309-W335 HydrophobicContact CG2-CE3 4.23Å; V309-W335 HydrophobicContact CG2-CZ3 4.1Å; A310-W335 VanDerWaalsContact CA-CZ3 3.48Å; P311-W335 HydrophobicContact CB-CD2 4.22Å; P311-W335 HydrophobicContact CB-CZ2 4.22Å; P311-W335 HydrophobicContact CG-CZ2 4.16Å; N333-W335 VanDerWaalsContact ND2-CD1 3.34Å; N333-W335 WeakPolarHBondContact OD1-CB 3.34Å; N333-W335 VanDerWaalsContact OD1-CD1 3.3Å; N333-W335 PolarHBondContact OD1-N 3.33Å; W335-I357 HydrophobicContact CH2-CG2 3.77Å; W335-I357 HydrophobicContact CZ3-CG1 4.34Å; W335-I357 HydrophobicContact CZ3-CG2 3.93Å; W335-W363 HydrophobicContact CH2-CZ2 4.01Å; W335-W363 HydrophobicContact CZ2-CZ2 4.35Å
336	H	93.6	Very high	85.2	Confident	76 Å²	76	52.4 Å²	52.4	35%	0.352	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-1.2	-177.5	55.6	-81.6	0	0	0	113.5	N333 L334 W355 I357	N333-H336 PolarHBondContact O-CE1 3.49Å; L334-H336 PolarHBondContact O-N 3.08Å; H336-W355 VanDerWaalsContact O-CH2 3.3Å; H336-W355 WeakPolarHBondContact O-CH2 3.37Å; H336-I357 HydrophobicContact CB-CD1 4Å
337	E	92.7	Very high	83.5	Confident	65 Å²	65	56.3 Å²	56.3	30%	0.304	31%	0.306	S	S	.	.			trans	-103	67.4	178.8	-63.3	-164	167.6	0	0	111	R298 P299 L334	R298-E337 VanDerWaalsContact CB-O 3.25Å; R298-E337 WeakPolarHBondContact CB-O 3.46Å; R298-E337 HydrophobicContact CG-CB 3.98Å; R298-E337 WeakPolarHBondContact CG-O 3.5Å; R298-E337 IonicContact CZ-OE2 2.75Å; R298-E337 IonicContact NE-OE2 2.8Å; R298-E337 PolarHBondContact NE-OE2 2.86Å; R298-E337 IonicContact NH2-OE1 3.42Å; R298-E337 IonicContact NH2-OE2 3.74Å; R298-E337 PolarHBondContact NH2-OE2 3.43Å; P299-E337 WeakPolarHBondContact CD-O 3.43Å; L334-E337 HydrophobicContact CB-CB 4.47Å; L334-E337 HydrophobicContact CD2-CG 4.39Å; L334-E337 PolarHBondContact O-N 3.39Å
338	V	93.3	Very high	81.8	Confident	14 Å²	14	57.1 Å²	57.1	9%	0.085	30%	0.297	C	S	.	.			trans	-83.7	123.3	-177	-177	0	0	0	0	111.2	P299 I301 V309 W355	P299-V338 HydrophobicContact CB-CG1 4.3Å; P299-V338 HydrophobicContact CB-CG2 4.15Å; P299-V338 HydrophobicContact CG-CG2 4.22Å; P299-V338 WeakPolarHBondContact O-CA 3.41Å; I301-V338 HydrophobicContact CB-CG1 4.39Å; I301-V338 HydrophobicContact CD1-CG1 4.02Å; I301-V338 HydrophobicContact CG1-CG1 3.94Å; I301-V338 HydrophobicContact CG2-CG1 3.65Å; V309-V338 HydrophobicContact CG1-CG2 4.04Å; V338-W355 HydrophobicContact CB-CD2 3.86Å; V338-W355 HydrophobicContact CB-CE3 4.26Å; V338-W355 HydrophobicContact CB-CG 4.35Å; V338-W355 HydrophobicContact CB-CH2 4.16Å; V338-W355 HydrophobicContact CB-CZ2 3.74Å; V338-W355 HydrophobicContact CB-CZ3 4.4Å; V338-W355 HydrophobicContact CG1-CD2 4.32Å; V338-W355 HydrophobicContact CG1-CG 4.3Å; V338-W355 HydrophobicContact CG2-CD2 4.12Å; V338-W355 HydrophobicContact CG2-CE3 4.05Å; V338-W355 HydrophobicContact CG2-CH2 4.28Å; V338-W355 HydrophobicContact CG2-CZ2 4.34Å; V338-W355 HydrophobicContact CG2-CZ3 4.13Å
339	D	91.9	Very high	80.1	Confident	35 Å²	35	59.5 Å²	59.5	19%	0.187	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	107.5	171.4	-79.5	-45.8	0	0	0	110.4	R298 P299 I300 I301 F341 R346	R298-D339 WeakPolarHBondContact CD-OD2 3.15Å; P299-D339 PolarHBondContact O-N 2.81Å; I300-D339 WeakPolarHBondContact CA-O 3.48Å; I300-D339 HydrophobicContact CG1-CB 4.44Å; I301-D339 PolarHBondContact N-O 2.93Å; D339-F341 HydrophobicContact CB-CD2 4.5Å; D339-F341 HydrophobicContact CB-CE2 3.95Å; D339-R346 IonicContact OD1-CZ 2.73Å; D339-R346 IonicContact OD1-NH2 3.96Å; D339-R346 PolarHBondContact OD1-NH2 3.46Å
340	D	90.4	Very high	79.1	Confident	7 Å²	7	67.4 Å²	67.4	4%	0.037	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	112	176.8	-178.9	8.4	0	0	0	111.7	I301 S342 C343 S352 N354	I301-D340 HydrophobicContact CD1-CB 3.83Å; I301-D340 HydrophobicContact CG1-CB 3.66Å; D340-S342 WeakPolarHBondContact OD1-CA 3.45Å; D340-S342 PolarHBondContact OD1-N 3.35Å; D340-S342 PolarHBondContact OD1-OG 3.04Å; D340-C343 HydrophobicContact CB-CB 4.09Å; D340-C343 VanDerWaalsContact CG-N 3.33Å; D340-C343 PolarHBondContact OD1-N 3.13Å; D340-C343 VanDerWaalsContact OD1-N 3.08Å; D340-C343 WeakPolarHBondContact OD2-CA 3.27Å; D340-C343 WeakPolarHBondContact OD2-CB 3.47Å; D340-C343 PolarHBondContact OD2-N 3.45Å; D340-S352 WeakPolarHBondContact OD2-CB 3.3Å; D340-S352 PolarHBondContact OD2-OG 2.85Å; D340-N354 WeakPolarHBondContact OD2-CB 3.25Å; D340-N354 PolarHBondContact OD2-ND2 2.88Å
341	F	87.5	Confident	78.8	Confident	98 Å²	98	68.8 Å²	68.8	43%	0.43	35%	0.348	S	S	.	.	S	Bend	trans	-85.4	-16.5	177.6	-74.4	-102	0	0	0	112.8	I300 I301 D339	I300-F341 HydrophobicContact CB-CE2 4.45Å; I300-F341 HydrophobicContact CD1-CE2 4.46Å; I300-F341 HydrophobicContact CG1-CE2 4.18Å; I300-F341 HydrophobicContact CG2-CD2 3.63Å; I300-F341 HydrophobicContact CG2-CE2 3.62Å; I301-F341 PolarHBondContact O-N 3.17Å; D339-F341 HydrophobicContact CB-CD2 4.5Å; D339-F341 HydrophobicContact CB-CE2 3.95Å
342	S	83.2	Confident	78.9	Confident	33 Å²	33	62.5 Å²	62.5	23%	0.231	32%	0.316	C	S	.	.	S	Bend	trans	-91.2	0	172.6	42.5	0	0	0	0	114.4	Q303 D340 P344 N354	Q303-S342 PolarHBondContact N-OG 2.72Å; D340-S342 WeakPolarHBondContact OD1-CA 3.45Å; D340-S342 PolarHBondContact OD1-N 3.35Å; D340-S342 PolarHBondContact OD1-OG 3.04Å; S342-P344 WeakPolarHBondContact O-CD 3.45Å; S342-N354 PolarHBondContact O-ND2 3.31Å
343	C	75.1	Confident	79	Confident	15 Å²	15	64.1 Å²	64.1	10%	0.101	33%	0.326	C	S	.	.			trans	-58.4	113.1	179.6	-175.9	0	0	0	0	109.8	D340 N345 R346 T349	D340-C343 HydrophobicContact CB-CB 4.09Å; D340-C343 VanDerWaalsContact CG-N 3.33Å; D340-C343 PolarHBondContact OD1-N 3.13Å; D340-C343 VanDerWaalsContact OD1-N 3.08Å; D340-C343 WeakPolarHBondContact OD2-CA 3.27Å; D340-C343 WeakPolarHBondContact OD2-CB 3.47Å; D340-C343 PolarHBondContact OD2-N 3.45Å; C343-N345 PolarHBondContact O-N 2.87Å; C343-R346 HydrophobicContact CB-CB 4.22Å; C343-R346 PolarHBondContact O-N 3.3Å; C343-R346 VanDerWaalsContact O-N 3.1Å; C343-T349 PolarHBondContact SG-OG1 3.13Å; C343-T349 VanDerWaalsContact SG-OG1 3.34Å
344	P	64.1	Low	79	Confident	69 Å²	69	63.3 Å²	63.3	45%	0.448	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	119.5	176.5	-20.3	32.4	0	0	0	107.8	S342 P353	S342-P344 WeakPolarHBondContact O-CD 3.45Å; P344-P353 HydrophobicContact CG-CG 4.4Å
345	N	61.1	Low	79	Confident	37 Å²	37	63.3 Å²	63.3	20%	0.198	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	54.2	-175.3	-50.5	-51.7	0	0	0	114.1	T68 C343 R347 L348 T349	T68-N345 VanDerWaalsContact CB-OD1 3.23Å; T68-N345 WeakPolarHBondContact CB-OD1 3.46Å; T68-N345 WeakPolarHBondContact CG2-ND2 3.42Å; T68-N345 WeakPolarHBondContact CG2-OD1 3.44Å; T68-N345 PolarHBondContact OG1-OD1 3.04Å; C343-N345 PolarHBondContact O-N 2.87Å; N345-R347 PolarHBondContact O-N 2.67Å; N345-L348 HydrophobicContact CB-CB 3.85Å; N345-L348 HydrophobicContact CB-CD1 3.8Å; N345-L348 HydrophobicContact CB-CG 4.27Å; N345-L348 PolarHBondContact O-N 2.87Å; N345-T349 PolarHBondContact O-N 2.83Å; N345-T349 PolarHBondContact O-OG1 3.38Å
346	R	57.9	Low	78.9	Confident	126 Å²	126	64.7 Å²	64.7	48%	0.475	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.3	-26	165.1	-170	176.9	179.4	177.9	5.4	113.4	D339 C343	D339-R346 IonicContact OD1-CZ 2.73Å; D339-R346 IonicContact OD1-NH2 3.96Å; D339-R346 PolarHBondContact OD1-NH2 3.46Å; C343-R346 HydrophobicContact CB-CB 4.22Å; C343-R346 PolarHBondContact O-N 3.3Å; C343-R346 VanDerWaalsContact O-N 3.1Å
347	R	58	Low	79.1	Confident	83 Å²	83	65 Å²	65	31%	0.313	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-31.9	175.6	-60.7	177.5	-65.4	-141.8	0.9	115.1	L64 D124 N345	L64-R347 VanDerWaalsContact CD1-CD 3.46Å; D124-R347 VanDerWaalsContact CB-NH1 3.3Å; D124-R347 WeakPolarHBondContact OD1-CD 3.35Å; D124-R347 IonicContact OD1-CZ 3.81Å; D124-R347 IonicContact OD1-NE 2.68Å; D124-R347 IonicContact OD1-NH1 2.73Å; D124-R347 PolarHBondContact OD1-NH1 2.99Å; N345-R347 PolarHBondContact O-N 2.67Å
348	L	56.5	Low	79.2	Confident	73 Å²	73	62.4 Å²	62.4	38%	0.382	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-29.1	-174.6	-70	151.7	0	0	0	112.9	Q65 N345	Q65-L348 HydrophobicContact CB-CD1 3.79Å; Q65-L348 HydrophobicContact CB-CD2 4.42Å; Q65-L348 HydrophobicContact CG-CD1 4.1Å; N345-L348 HydrophobicContact CB-CB 3.85Å; N345-L348 HydrophobicContact CB-CD1 3.8Å; N345-L348 HydrophobicContact CB-CG 4.27Å; N345-L348 PolarHBondContact O-N 2.87Å
349	T	59.4	Low	79.3	Confident	59 Å²	59	65.4 Å²	65.4	36%	0.362	34%	0.342	S	S	.	.			trans	-98.7	129.7	-175.3	57.7	0	0	0	0	111.5	C343 N345 T351	C343-T349 PolarHBondContact SG-OG1 3.13Å; C343-T349 VanDerWaalsContact SG-OG1 3.34Å; N345-T349 PolarHBondContact O-N 2.83Å; N345-T349 PolarHBondContact O-OG1 3.38Å; T349-T351 VanDerWaalsContact C-N 3.28Å; T349-T351 PolarHBondContact O-N 3.18Å
350	K	66.1	Low	79.3	Confident	217 Å²	217	70.6 Å²	70.6	94%	0.943	37%	0.366	S	S	*	.	S	Bend	trans	-70	-25.1	173.3	-70.8	-176.7	179.3	178.7	0	113.3
351	T	76.4	Confident	79.4	Confident	109 Å²	109	76.1 Å²	76.1	67%	0.669	40%	0.4	S	S	*	.	S	Bend	trans	-129	141	-173.7	53.4	0	0	0	0	110.2	T349	T349-T351 VanDerWaalsContact C-N 3.28Å; T349-T351 PolarHBondContact O-N 3.18Å
352	S	84.6	Confident	79.6	Confident	21 Å²	21	75.4 Å²	75.4	15%	0.147	40%	0.4	C	S	.	.			trans	-74.4	138.1	173.1	166	0	0	0	0	110.7	D340 N354 W355	D340-S352 WeakPolarHBondContact OD2-CB 3.3Å; D340-S352 PolarHBondContact OD2-OG 2.85Å; S352-N354 VanDerWaalsContact C-N 3.26Å; S352-N354 WeakPolarHBondContact OG-CB 3.38Å; S352-N354 PolarHBondContact OG-N 3.37Å; S352-W355 VanDerWaalsContact CB-CD1 3.41Å; S352-W355 VanDerWaalsContact OG-CD1 3.29Å
353	P	86.5	Confident	80.1	Confident	89 Å²	89	76.2 Å²	76.2	58%	0.578	40%	0.398	S	S	*	.	S	Bend	trans	-78.3	-11.5	169	33.1	-34.6	0	0	0	113	P344	P344-P353 HydrophobicContact CG-CG 4.4Å
354	N	91.1	Very high	80.7	Confident	21 Å²	21	79.9 Å²	79.9	11%	0.112	42%	0.424	C	S	.	.	S	Bend	trans	-90.3	-16.8	-170.6	-63.2	-37.6	0	0	0	113.3	I301 C304 N306 L307 D340 S342 S352	I301-N354 HydrophobicContact CD1-CB 4.34Å; C304-N354 VanDerWaalsContact O-CB 3.26Å; C304-N354 WeakPolarHBondContact O-CB 3.1Å; C304-N354 PolarHBondContact O-OD1 2.82Å; N306-N354 PolarHBondContact N-O 2.85Å; N306-N354 VanDerWaalsContact N-O 3.1Å; L307-N354 PolarHBondContact N-O 2.77Å; D340-N354 WeakPolarHBondContact OD2-CB 3.25Å; D340-N354 PolarHBondContact OD2-ND2 2.88Å; S342-N354 PolarHBondContact O-ND2 3.31Å; S352-N354 VanDerWaalsContact C-N 3.26Å; S352-N354 WeakPolarHBondContact OG-CB 3.38Å; S352-N354 PolarHBondContact OG-N 3.37Å
355	W	94.2	Very high	82	Confident	51 Å²	51	79.1 Å²	79.1	19%	0.193	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	154.3	177.4	72.7	-86.7	0	0	0	113.2	I301 L307 V309 H336 V338 S352 I357	I301-W355 HydrophobicContact CD1-CB 4.1Å; I301-W355 HydrophobicContact CD1-CG 4.09Å; L307-W355 HydrophobicContact CB-CB 3.9Å; L307-W355 CarbonylContact O-C 3.58Å; L307-W355 WeakPolarHBondContact O-CA 3.45Å; V309-W355 HydrophobicContact CG2-CE3 3.71Å; V309-W355 HydrophobicContact CG2-CZ3 3.72Å; H336-W355 VanDerWaalsContact O-CH2 3.3Å; H336-W355 WeakPolarHBondContact O-CH2 3.37Å; V338-W355 HydrophobicContact CB-CD2 3.86Å; V338-W355 HydrophobicContact CB-CE3 4.26Å; V338-W355 HydrophobicContact CB-CG 4.35Å; V338-W355 HydrophobicContact CB-CH2 4.16Å; V338-W355 HydrophobicContact CB-CZ2 3.74Å; V338-W355 HydrophobicContact CB-CZ3 4.4Å; V338-W355 HydrophobicContact CG1-CD2 4.32Å; V338-W355 HydrophobicContact CG1-CG 4.3Å; V338-W355 HydrophobicContact CG2-CD2 4.12Å; V338-W355 HydrophobicContact CG2-CE3 4.05Å; V338-W355 HydrophobicContact CG2-CH2 4.28Å; V338-W355 HydrophobicContact CG2-CZ2 4.34Å; V338-W355 HydrophobicContact CG2-CZ3 4.13Å; S352-W355 VanDerWaalsContact CB-CD1 3.41Å; S352-W355 VanDerWaalsContact OG-CD1 3.29Å; W355-I357 HydrophobicContact CZ3-CG1 3.98Å
356	C	94.1	Very high	83.4	Confident	61 Å²	61	77.4 Å²	77.4	41%	0.412	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	163.8	172.4	66.6	0	0	0	0	111.9	L307 K308 V309	L307-C356 PolarHBondContact O-N 3.42Å; K308-C356 CarbonylContact C-O 3.53Å; K308-C356 VanDerWaalsContact CA-O 3.31Å; K308-C356 WeakPolarHBondContact CA-O 3.37Å; V309-C356 PolarHBondContact N-O 2.89Å
357	I	96.3	Very high	84.7	Confident	83 Å²	83	73.4 Å²	73.4	43%	0.426	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.8	173.2	-61.7	174.5	0	0	0	108.6	V309 W335 H336 W355	V309-I357 HydrophobicContact CG2-CG1 3.95Å; V309-I357 CarbonylContact O-C 3.54Å; V309-I357 WeakPolarHBondContact O-CA 3.5Å; W335-I357 HydrophobicContact CH2-CG2 3.77Å; W335-I357 HydrophobicContact CZ3-CG1 4.34Å; W335-I357 HydrophobicContact CZ3-CG2 3.93Å; H336-I357 HydrophobicContact CB-CD1 4Å; W355-I357 HydrophobicContact CZ3-CG1 3.98Å
358	I	95.4	Very high	85.7	Confident	9 Å²	9	71.5 Å²	71.5	5%	0.046	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-64	138.2	172.7	-62.4	176.2	0	0	0	108.5	R290 K308 V309 A310 D362 W363 L366	R290-I358 HydrophobicContact CB-CD1 4.15Å; R290-I358 HydrophobicContact CG-CD1 4.4Å; K308-I358 HydrophobicContact CB-CD1 3.78Å; K308-I358 HydrophobicContact CB-CG1 3.41Å; K308-I358 VanDerWaalsContact CB-CG1 3.41Å; K308-I358 HydrophobicContact CD-CG1 4.42Å; V309-I358 PolarHBondContact O-N 3.23Å; A310-I358 HydrophobicContact CB-CB 4.25Å; A310-I358 HydrophobicContact CB-CD1 3.97Å; A310-I358 HydrophobicContact CB-CG1 4.42Å; I358-D362 HydrophobicContact CG2-CB 3.64Å; I358-W363 PolarHBondContact O-NE1 3.49Å; I358-L366 HydrophobicContact CD1-CD1 3.88Å
359	P	95.2	Very high	86.4	Confident	77 Å²	77	74.9 Å²	74.9	50%	0.5	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-55.1	140.7	171.3	-25.5	35.4	0	0	0	112	V361 D362 W363	P359-V361 HydrophobicContact CB-CG2 3.96Å; P359-V361 PolarHBondContact O-N 2.85Å; P359-V361 VanDerWaalsContact O-N 3.12Å; P359-D362 PolarHBondContact O-N 3.38Å; P359-W363 VanDerWaalsContact O-CD1 3.32Å
360	E	92.7	Very high	86.3	Confident	145 Å²	145	82 Å²	82	68%	0.678	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-55.5	-35	-175.6	-178.9	170.6	-173.9	0	0	113.6	D362 W363	E360-D362 PolarHBondContact O-N 2.75Å; E360-D362 VanDerWaalsContact O-N 3.16Å; E360-W363 HydrophobicContact CB-CD2 4.29Å; E360-W363 HydrophobicContact CB-CE3 4.36Å; E360-W363 HydrophobicContact CB-CH2 4.22Å; E360-W363 HydrophobicContact CB-CZ2 4.14Å; E360-W363 HydrophobicContact CB-CZ3 4.33Å; E360-W363 HydrophobicContact CG-CD2 4.2Å; E360-W363 HydrophobicContact CG-CE3 3.81Å; E360-W363 HydrophobicContact CG-CH2 4.05Å; E360-W363 HydrophobicContact CG-CZ2 4.42Å; E360-W363 HydrophobicContact CG-CZ3 3.72Å; E360-W363 PolarHBondContact O-N 3.33Å
361	V	91.7	Very high	85.2	Confident	123 Å²	123	82.5 Å²	82.5	75%	0.745	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.5	176.3	-63.9	0	0	0	0	113.5	P359	P359-V361 HydrophobicContact CB-CG2 3.96Å; P359-V361 PolarHBondContact O-N 2.85Å; P359-V361 VanDerWaalsContact O-N 3.12Å
362	D	91.9	Very high	85.6	Confident	83 Å²	83	81.2 Å²	81.2	44%	0.444	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-100.3	-4.2	-175.1	-66.3	-33.3	0	0	0	112.9	I358 P359 E360 S364 S365	I358-D362 HydrophobicContact CG2-CB 3.64Å; P359-D362 PolarHBondContact O-N 3.38Å; E360-D362 PolarHBondContact O-N 2.75Å; E360-D362 VanDerWaalsContact O-N 3.16Å; D362-S364 PolarHBondContact O-N 3.39Å; D362-S365 VanDerWaalsContact O-CB 3.28Å; D362-S365 WeakPolarHBondContact O-CB 3.33Å; D362-S365 PolarHBondContact O-N 2.98Å; D362-S365 PolarHBondContact O-OG 3.17Å
363	W	93.1	Very high	85.7	Confident	50 Å²	50	84.4 Å²	84.4	19%	0.189	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-59.2	-37.8	-178.8	-69.9	-5.8	0	0	0	112.4	A310 P311 Q313 W335 I358 P359 E360 S365 L366	A310-W363 HydrophobicContact CB-CG 4.19Å; P311-W363 VanDerWaalsContact CD-CE2 3.47Å; P311-W363 HydrophobicContact CG-CD2 3.73Å; P311-W363 HydrophobicContact CG-CE3 3.52Å; P311-W363 HydrophobicContact CG-CG 4.45Å; P311-W363 HydrophobicContact CG-CH2 4.05Å; P311-W363 HydrophobicContact CG-CZ2 4.22Å; P311-W363 HydrophobicContact CG-CZ3 3.7Å; Q313-W363 HydrophobicContact CG-CB 4.45Å; W335-W363 HydrophobicContact CH2-CZ2 4.01Å; W335-W363 HydrophobicContact CZ2-CZ2 4.35Å; I358-W363 PolarHBondContact O-NE1 3.49Å; P359-W363 VanDerWaalsContact O-CD1 3.32Å; E360-W363 HydrophobicContact CB-CD2 4.29Å; E360-W363 HydrophobicContact CB-CE3 4.36Å; E360-W363 HydrophobicContact CB-CH2 4.22Å; E360-W363 HydrophobicContact CB-CZ2 4.14Å; E360-W363 HydrophobicContact CB-CZ3 4.33Å; E360-W363 HydrophobicContact CG-CD2 4.2Å; E360-W363 HydrophobicContact CG-CE3 3.81Å; E360-W363 HydrophobicContact CG-CH2 4.05Å; E360-W363 HydrophobicContact CG-CZ2 4.42Å; E360-W363 HydrophobicContact CG-CZ3 3.72Å; E360-W363 PolarHBondContact O-N 3.33Å; W363-S365 PolarHBondContact O-N 3.45Å; W363-L366 PolarHBondContact O-N 3.22Å; W363-L366 VanDerWaalsContact O-N 3.1Å
364	S	88.7	Confident	85.6	Confident	91 Å²	91	84.1 Å²	84.1	64%	0.636	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-59.9	-20	177.6	-58.1	0	0	0	0	113.5	D362 L366 C367	D362-S364 PolarHBondContact O-N 3.39Å; S364-L366 PolarHBondContact O-N 3.11Å; S364-C367 WeakPolarHBondContact O-CB 3.47Å; S364-C367 PolarHBondContact O-N 2.81Å
365	S	90.6	Very high	85.3	Confident	54 Å²	54	87.8 Å²	87.8	38%	0.378	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-72.4	-9	178.1	75.4	0	0	0	0	114.2	R290 D362 W363	R290-S365 PolarHBondContact NH1-OG 2.92Å; D362-S365 VanDerWaalsContact O-CB 3.28Å; D362-S365 WeakPolarHBondContact O-CB 3.33Å; D362-S365 PolarHBondContact O-N 2.98Å; D362-S365 PolarHBondContact O-OG 3.17Å; W363-S365 PolarHBondContact O-N 3.45Å
366	L	90.3	Very high	84.7	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-92.2	2.1	172.7	-75.3	171.3	0	0	0	113	Y256 D273 V275 R290 A310 I358 W363 S364	Y256-L366 VanDerWaalsContact CE1-O 3.26Å; Y256-L366 WeakPolarHBondContact CE1-O 3.45Å; D273-L366 HydrophobicContact CB-CD2 4.03Å; V275-L366 HydrophobicContact CG2-CB 4.12Å; V275-L366 HydrophobicContact CG2-CD2 4.1Å; R290-L366 HydrophobicContact CB-CD2 3.79Å; A310-L366 HydrophobicContact CB-CD1 3.67Å; I358-L366 HydrophobicContact CD1-CD1 3.88Å; W363-L366 PolarHBondContact O-N 3.22Å; W363-L366 VanDerWaalsContact O-N 3.1Å; S364-L366 PolarHBondContact O-N 3.11Å
367	C	85.2	Confident	84.1	Confident	43 Å²	43	92.1 Å²	92.1	29%	0.291	50%	0.5	S	S	.	.	S	Bend	trans	-78.2	145.7	169.4	-66.8	0	0	0	0	110.3	Q313 S364	Q313-C367 VanDerWaalsContact CB-SG 3.58Å; S364-C367 WeakPolarHBondContact O-CB 3.47Å; S364-C367 PolarHBondContact O-N 2.81Å
368	P	80.4	Confident	83.2	Confident	42 Å²	42	92.7 Å²	92.7	27%	0.273	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-58.6	141.9	164.2	25.2	-31.5	0	0	0	108.4	Y256 L314 K370	Y256-P368 HydrophobicContact CD2-CB 4.11Å; Y256-P368 HydrophobicContact CE1-CB 4.44Å; Y256-P368 HydrophobicContact CE2-CB 3.96Å; Y256-P368 HydrophobicContact CG-CB 4.39Å; L314-P368 HydrophobicContact CD2-CG 3.85Å; P368-K370 PolarHBondContact O-N 3.08Å; P368-K370 VanDerWaalsContact O-N 3.13Å
369	N	69.7	Low	82.3	Confident	145 Å²	145	99.2 Å²	99.2	78%	0.775	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-56.8	123.2	173.6	-71.9	-25.8	0	0	0	108.1	N371	N369-N371 PolarHBondContact O-N 3.29Å
370	K	58.2	Low	81.2	Confident	208 Å²	208	101 Å²	101	90%	0.904	54%	0.544	S	S	*	.			trans	-64.2	105.6	168.6	-68.9	-176.8	179.8	179.1	0	106.5	P368	P368-K370 PolarHBondContact O-N 3.08Å; P368-K370 VanDerWaalsContact O-N 3.13Å
371	N	42.4	Very low	80.2	Confident	228 Å²	228	97 Å²	97	100%	1.219	53%	0.532	S	S	*	.			trans	-64.7	0	162.7	-84	-18.7	0	0	0	110.2	N369	N369-N371 PolarHBondContact O-N 3.29Å

Retrieved 371 of 371 residues in 72.7 ms (Link to these results)

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