A0A5K4ESD7_SCHMA Loading...

Putative bromodomain-containing protein 3, brd3

AlphaFold DB (A0A5K4EQL3), UniProt , Accession A0A5K4ESD7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 685 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	42	Very low	42.8	Very low	247 Å²	247	144.5 Å²	144.5	100%	1.217	85%	0.845	S	S	*	*				0	167.4	0	-77.6	-177.4	161.2	0	0	108.6
2	S	41	Very low	42.2	Very low	130 Å²	130	142.3 Å²	142.3	91%	0.909	84%	0.843	S	S	*	*			trans	-76.4	167.6	-146.9	-50.9	0	0	0	0	117
3	S	37.6	Very low	42.2	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	84%	0.839	S	S	*	*			trans	-102.1	-160.5	-172.3	52	0	0	0	0	113.2
4	E	49.1	Very low	42	Very low	181 Å²	181	146.3 Å²	146.3	85%	0.846	84%	0.837	S	S	*	*			trans	80.5	109.2	177.7	-51.2	-170.6	148.2	0	0	113.5
5	A	42.9	Very low	41.6	Very low	102 Å²	102	143.6 Å²	143.6	84%	0.843	83%	0.831	S	S	*	*			cis	82.6	112.4	17.7	0	0	0	0	0	116.6
6	N	47.9	Very low	41.3	Very low	168 Å²	168	146.5 Å²	146.5	90%	0.898	83%	0.834	S	S	*	*			trans	-147.7	148.1	151.4	-155.5	-14.1	0	0	0	108.5
7	L	44.2	Very low	41	Very low	150 Å²	150	143.6 Å²	143.6	79%	0.785	82%	0.822	S	S	*	*			trans	-125.7	122.2	-166.4	-95.7	161.2	0	0	0	111.1
8	D	40	Very low	40.7	Very low	149 Å²	149	145.9 Å²	145.9	80%	0.797	82%	0.824	S	S	*	*			trans	-82.6	143.5	158.3	-171.5	7	0	0	0	109.5
9	S	46.4	Very low	40.5	Very low	93 Å²	93	143.3 Å²	143.3	65%	0.65	82%	0.823	S	S	*	*			trans	-160.5	69.5	-177.5	-79.1	0	0	0	0	111.9	N11	S9-N11 PolarHBondContact O-N 3.41Å
10	S	38.8	Very low	40.5	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	83%	0.825	S	S	*	*			trans	-56.5	128.5	160.6	68	0	0	0	0	110.4
11	N	40.9	Very low	40.4	Very low	144 Å²	144	143.9 Å²	143.9	77%	0.77	83%	0.826	S	S	*	*			trans	-135.3	126.6	-176.2	-149.3	-18.8	0	0	0	110.5	S9	S9-N11 PolarHBondContact O-N 3.41Å
12	S	35.5	Very low	40.3	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	81%	0.808	S	S	*	*			trans	-128.4	106.5	-166.6	171	0	0	0	0	111.1
13	I	43	Very low	40.4	Very low	154 Å²	154	139.2 Å²	139.2	79%	0.79	80%	0.8	S	S	*	*			trans	-126.4	148.9	-178.8	-64.3	175.8	0	0	0	110
14	K	38.6	Very low	40.7	Very low	187 Å²	187	140 Å²	140	81%	0.813	81%	0.805	S	S	*	*			trans	-95	157.6	-160.9	-62.3	173.8	177.5	172.8	0	114.7
15	S	36.6	Very low	40.6	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	80%	0.796	S	S	*	*			trans	56.9	120.2	139.2	59.9	0	0	0	0	121.1
16	E	36.4	Very low	41.5	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	79%	0.787	S	S	*	*				-157.7	163.2	102.2	-104.6	-166.1	149.1	0	0	111.7
17	P	37	Very low	42.6	Very low	98 Å²	98	133.7 Å²	133.7	64%	0.636	76%	0.762	S	S	*	*			trans	-98.2	-177.4	-178.1	36.4	-30.4	0	0	0	114.4
18	H	34.6	Very low	44.7	Very low	184 Å²	184	127 Å²	127	85%	0.852	73%	0.728	S	S	*	*			trans	83	100.3	174.9	-56.5	-81.4	0	0	0	119
19	A	37.8	Very low	47.3	Very low	97 Å²	97	120.2 Å²	120.2	80%	0.802	69%	0.692	S	S	*	*			trans	-153.3	106.9	138.4	0	0	0	0	0	109.2	K21	A19-K21 PolarHBondContact O-N 3.12Å
20	A	38.8	Very low	49.7	Very low	104 Å²	104	117.1 Å²	117.1	86%	0.86	67%	0.668	S	S	*	*			trans	-73.1	126.4	178.3	0	0	0	0	0	110.3	S22	A20-S22 PolarHBondContact O-N 3.04Å; A20-S22 VanDerWaalsContact O-N 3.13Å
21	K	40.1	Very low	52.5	Low	194 Å²	194	112.1 Å²	112.1	84%	0.843	63%	0.631	S	S	*	*			trans	-72.2	107.1	175.6	-68.3	174.3	-176	169.3	0	108.8	A19 H23	A19-K21 PolarHBondContact O-N 3.12Å; K21-H23 PolarHBondContact O-N 3.32Å; K21-H23 VanDerWaalsContact O-N 3.09Å
22	S	39.4	Very low	55.2	Low	120 Å²	120	105.5 Å²	105.5	84%	0.839	60%	0.596	S	S	*	*			trans	-61.9	112.3	174.4	-170.2	0	0	0	0	109.5	A20	A20-S22 PolarHBondContact O-N 3.04Å; A20-S22 VanDerWaalsContact O-N 3.13Å
23	H	41.8	Very low	58	Low	160 Å²	160	102.8 Å²	102.8	74%	0.741	57%	0.57	S	S	*	*			trans	-72.4	136.6	162.3	-75.7	-92.1	0	0	0	107.9	K21 S25	K21-H23 PolarHBondContact O-N 3.32Å; K21-H23 VanDerWaalsContact O-N 3.09Å; H23-S25 PolarHBondContact O-N 3.26Å
24	S	44.6	Very low	60.7	Low	122 Å²	122	97.2 Å²	97.2	85%	0.853	54%	0.54	S	S	*	.			trans	-60.7	94.2	162.9	41.8	0	0	0	0	108.4	K26	S24-K26 PolarHBondContact O-N 3.24Å
25	S	47.5	Very low	63.5	Low	94 Å²	94	88.3 Å²	88.3	66%	0.657	50%	0.501	S	S	*	.			trans	-59.4	136.4	173.3	-69.4	0	0	0	0	107.3	H23 I27	H23-S25 PolarHBondContact O-N 3.26Å; S25-I27 VanDerWaalsContact C-N 3.32Å; S25-I27 WeakPolarHBondContact O-CG1 3.49Å; S25-I27 PolarHBondContact O-N 3.39Å
26	K	62.2	Low	66.4	Low	150 Å²	150	86 Å²	86	65%	0.652	48%	0.477	S	S	*	.			trans	-67.5	92.1	-177.2	-59.1	179.9	-176.5	175.4	0	109	S24 K86	S24-K26 PolarHBondContact O-N 3.24Å; K26-K86 HydrophobicContact CB-CB 4.18Å; K26-K86 HydrophobicContact CB-CD 3.62Å; K26-K86 VanDerWaalsContact O-CD 3.28Å; K26-K86 WeakPolarHBondContact O-CD 3.34Å; K26-K86 PolarHBondContact O-NZ 3.16Å
27	I	70.1	Confident	69.2	Low	75 Å²	75	83.7 Å²	83.7	39%	0.385	47%	0.465	S	S	.	.			trans	-66.8	156	-178.3	-47.4	-167.5	0	0	0	108.9	S25 K86 E139	S25-I27 VanDerWaalsContact C-N 3.32Å; S25-I27 WeakPolarHBondContact O-CG1 3.49Å; S25-I27 PolarHBondContact O-N 3.39Å; I27-K86 WeakPolarHBondContact O-CD 3.26Å; I27-E139 HydrophobicContact CG2-CB 4.05Å; I27-E139 VanDerWaalsContact CG2-CD 3.5Å; I27-E139 HydrophobicContact CG2-CG 3.61Å
28	T	88.8	Confident	72.1	Confident	11 Å²	11	81.7 Å²	81.7	7%	0.067	45%	0.447	C	S	.	.			trans	-152.4	151.3	163.7	-167.2	0	0	0	0	107.4	E33 I140	T28-E33 HydrophobicContact CG2-CG 4.18Å; T28-I140 PolarHBondContact O-N 3.4Å
29	T	95	Very high	75.1	Confident	6 Å²	6	73 Å²	73	4%	0.037	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-109.9	164.2	-175.2	64.5	0	0	0	0	111.7	Q31 L32 E33 E137 T138	T29-Q31 PolarHBondContact O-N 2.95Å; T29-L32 HydrophobicContact CG2-CD1 4.33Å; T29-L32 PolarHBondContact O-N 3.26Å; T29-L32 WeakPolarHBondContact OG1-CB 3.42Å; T29-L32 VanDerWaalsContact OG1-CG 3.28Å; T29-L32 WeakPolarHBondContact OG1-CG 3.4Å; T29-L32 PolarHBondContact OG1-N 3.07Å; T29-E33 PolarHBondContact O-N 2.78Å; T29-E137 WeakPolarHBondContact CB-OE1 3.44Å; T29-E137 HydrophobicContact CG2-CG 3.78Å; T29-E137 WeakPolarHBondContact CG2-OE1 3.31Å; T29-E137 PolarHBondContact OG1-OE1 2.97Å; T29-T138 CarbonylContact C-O 3.53Å; T29-T138 WeakPolarHBondContact CA-O 3.33Å; T29-T138 VanDerWaalsContact CB-O 3.32Å; T29-T138 WeakPolarHBondContact CB-O 3.43Å
30	N	95.6	Very high	78	Confident	28 Å²	28	68.5 Å²	68.5	15%	0.15	37%	0.369	C	S	.	.	H	α-helix	trans	-53.8	-40.1	169.4	63.5	-19.6	0	0	0	112.2	Y34 P136 E137 T138 I140	N30-Y34 VanDerWaalsContact O-CB 3.29Å; N30-Y34 WeakPolarHBondContact O-CB 3.47Å; N30-Y34 PolarHBondContact O-N 3.3Å; N30-P136 PolarHBondContact ND2-O 3.37Å; N30-E137 WeakPolarHBondContact OD1-CA 3.25Å; N30-T138 VanDerWaalsContact CG-OG1 3.25Å; N30-T138 PolarHBondContact N-O 3.34Å; N30-T138 PolarHBondContact ND2-OG1 3.07Å; N30-T138 VanDerWaalsContact ND2-OG1 3.15Å; N30-T138 PolarHBondContact OD1-N 3.02Å; N30-T138 PolarHBondContact OD1-O 3.48Å; N30-I140 HydrophobicContact CB-CD1 3.88Å; N30-I140 HydrophobicContact CB-CG1 4.35Å
31	Q	97.6	Very high	80.8	Confident	14 Å²	14	64.6 Å²	64.6	7%	0.065	34%	0.339	C	S	.	.	H	α-helix	trans	-74.7	-38.5	178.7	-65.9	-170.4	-3.6	0	0	112.5	T29 Y34 I35 S91 M133 P134 E137	T29-Q31 PolarHBondContact O-N 2.95Å; Q31-Y34 WeakPolarHBondContact O-CB 3.37Å; Q31-Y34 PolarHBondContact O-N 3.15Å; Q31-I35 WeakPolarHBondContact O-CB 3.49Å; Q31-I35 VanDerWaalsContact O-CG1 3.28Å; Q31-I35 WeakPolarHBondContact O-CG1 3.44Å; Q31-I35 PolarHBondContact O-N 3.16Å; Q31-S91 PolarHBondContact OE1-OG 2.78Å; Q31-M133 HydrophobicContact CB-CG 4.15Å; Q31-M133 HydrophobicContact CB-SD 3.87Å; Q31-M133 HydrophobicContact CG-CE 4.36Å; Q31-M133 HydrophobicContact CG-CG 3.81Å; Q31-M133 HydrophobicContact CG-SD 4.01Å; Q31-P134 VanDerWaalsContact CG-O 3.22Å; Q31-P134 WeakPolarHBondContact CG-O 3.41Å; Q31-P134 PolarHBondContact NE2-O 3.05Å; Q31-E137 HydrophobicContact CB-CG 4.21Å; Q31-E137 HydrophobicContact CG-CB 4.15Å; Q31-E137 HydrophobicContact CG-CG 4.16Å
32	L	97.2	Very high	83.5	Confident	4 Å²	4	60 Å²	60	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-65.4	-43.5	175.6	-76.1	170.4	0	0	0	112.5	T29 Y34 I35 K36 L83 Y88 S90 C94	T29-L32 HydrophobicContact CG2-CD1 4.33Å; T29-L32 PolarHBondContact O-N 3.26Å; T29-L32 WeakPolarHBondContact OG1-CB 3.42Å; T29-L32 VanDerWaalsContact OG1-CG 3.28Å; T29-L32 WeakPolarHBondContact OG1-CG 3.4Å; T29-L32 PolarHBondContact OG1-N 3.07Å; L32-Y34 VanDerWaalsContact C-N 3.32Å; L32-Y34 PolarHBondContact O-N 3.5Å; L32-I35 PolarHBondContact O-N 2.98Å; L32-K36 WeakPolarHBondContact O-CB 3.23Å; L32-K36 PolarHBondContact O-N 3.04Å; L32-L83 HydrophobicContact CB-CD2 4.3Å; L32-L83 HydrophobicContact CD2-CD2 3.75Å; L32-Y88 WeakPolarHBondContact CD1-O 3.22Å; L32-Y88 HydrophobicContact CD2-CD2 4.24Å; L32-Y88 HydrophobicContact CD2-CG 4.29Å; L32-S90 WeakPolarHBondContact CD2-O 3.47Å; L32-C94 HydrophobicContact CD2-CB 3.65Å
33	E	96	Very high	86.3	Confident	61 Å²	61	54.3 Å²	54.3	29%	0.285	28%	0.277	S	S	.	.	H	α-helix	trans	-67.4	-32.1	172.8	-71.5	-66.4	149.5	0	0	111.9	T28 T29 K36 K37	T28-E33 HydrophobicContact CG2-CG 4.18Å; T29-E33 PolarHBondContact O-N 2.78Å; E33-K36 IonicContact OE1-NZ 2.86Å; E33-K36 PolarHBondContact OE1-NZ 3.5Å; E33-K36 WeakPolarHBondContact OE2-CD 3.38Å; E33-K36 IonicContact OE2-NZ 3.37Å; E33-K36 PolarHBondContact OE2-NZ 3.48Å; E33-K37 VanDerWaalsContact O-CB 3.24Å; E33-K37 WeakPolarHBondContact O-CB 3.49Å; E33-K37 PolarHBondContact O-N 3.35Å
34	Y	97.9	Very high	89	Confident	37 Å²	37	49.5 Å²	49.5	15%	0.145	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-52.2	171.5	-175.4	-87.8	0	0	0	112	N30 Q31 L32 K36 K37 E38 V39 R129 F132 M133 P134	N30-Y34 VanDerWaalsContact O-CB 3.29Å; N30-Y34 WeakPolarHBondContact O-CB 3.47Å; N30-Y34 PolarHBondContact O-N 3.3Å; Q31-Y34 WeakPolarHBondContact O-CB 3.37Å; Q31-Y34 PolarHBondContact O-N 3.15Å; L32-Y34 VanDerWaalsContact C-N 3.32Å; L32-Y34 PolarHBondContact O-N 3.5Å; Y34-K36 VanDerWaalsContact C-N 3.31Å; Y34-K36 PolarHBondContact O-N 2.91Å; Y34-K37 PolarHBondContact O-N 3.34Å; Y34-E38 HydrophobicContact CD1-CB 4.44Å; Y34-E38 HydrophobicContact CD2-CB 4.3Å; Y34-E38 HydrophobicContact CD2-CG 4.01Å; Y34-E38 HydrophobicContact CE1-CB 4.01Å; Y34-E38 HydrophobicContact CE2-CB 3.88Å; Y34-E38 HydrophobicContact CE2-CG 3.72Å; Y34-E38 PolarHBondContact O-N 3.29Å; Y34-V39 HydrophobicContact CD1-CG2 4.23Å; Y34-V39 HydrophobicContact CE1-CG2 3.97Å; Y34-R129 PolarHBondContact OH-O 3.5Å; Y34-F132 WeakPolarHBondContact CE2-O 3.46Å; Y34-M133 HydrophobicContact CD1-CB 3.81Å; Y34-M133 HydrophobicContact CD1-CG 3.74Å; Y34-M133 HydrophobicContact CD1-SD 4.4Å; Y34-M133 HydrophobicContact CE1-CB 3.9Å; Y34-M133 HydrophobicContact CE1-CG 4.35Å; Y34-M133 HydrophobicContact CG-CG 4.22Å; Y34-P134 HydrophobicContact CD2-CG 4.3Å
35	I	97.9	Very high	91.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.247	C	C	.	.	I	π-helix	trans	-58	-45.5	178.5	-69.6	163.8	0	0	0	110.2	Q31 L32 K37 V39 V40 L83 L95 L130 M133	Q31-I35 WeakPolarHBondContact O-CB 3.49Å; Q31-I35 VanDerWaalsContact O-CG1 3.28Å; Q31-I35 WeakPolarHBondContact O-CG1 3.44Å; Q31-I35 PolarHBondContact O-N 3.16Å; L32-I35 PolarHBondContact O-N 2.98Å; I35-K37 PolarHBondContact O-N 2.9Å; I35-V39 HydrophobicContact CG1-CG2 4.41Å; I35-V39 HydrophobicContact CG2-CB 4.32Å; I35-V39 CarbonylContact O-C 3.54Å; I35-V39 WeakPolarHBondContact O-CA 3.34Å; I35-V39 WeakPolarHBondContact O-CB 3.43Å; I35-V39 PolarHBondContact O-N 3.03Å; I35-V40 HydrophobicContact CG2-CG2 4.05Å; I35-V40 PolarHBondContact O-N 3.43Å; I35-L83 HydrophobicContact CG2-CD1 4.43Å; I35-L95 HydrophobicContact CD1-CD2 3.86Å; I35-L95 HydrophobicContact CD1-CG 3.94Å; I35-L95 HydrophobicContact CG1-CD2 4.38Å; I35-L130 HydrophobicContact CG1-CD2 4.16Å; I35-M133 HydrophobicContact CD1-SD 3.9Å; I35-M133 HydrophobicContact CG1-SD 3.86Å
36	K	97.4	Very high	93.8	Very high	57 Å²	57	48.6 Å²	48.6	25%	0.248	22%	0.223	C	C	.	.	I	π-helix	trans	-58.1	-45.1	176.5	-177.9	-178	169.3	-156.3	0	113.5	L32 E33 Y34 G41 L83	L32-K36 WeakPolarHBondContact O-CB 3.23Å; L32-K36 PolarHBondContact O-N 3.04Å; E33-K36 IonicContact OE1-NZ 2.86Å; E33-K36 PolarHBondContact OE1-NZ 3.5Å; E33-K36 WeakPolarHBondContact OE2-CD 3.38Å; E33-K36 IonicContact OE2-NZ 3.37Å; E33-K36 PolarHBondContact OE2-NZ 3.48Å; Y34-K36 VanDerWaalsContact C-N 3.31Å; Y34-K36 PolarHBondContact O-N 2.91Å; K36-G41 PolarHBondContact O-N 3.49Å; K36-G41 VanDerWaalsContact O-N 3.13Å; K36-L83 HydrophobicContact CB-CB 4.37Å; K36-L83 HydrophobicContact CB-CD1 3.92Å; K36-L83 HydrophobicContact CB-CD2 4.22Å; K36-L83 HydrophobicContact CB-CG 4.4Å; K36-L83 HydrophobicContact CD-CB 4.25Å; K36-L83 HydrophobicContact CG-CB 4.17Å; K36-L83 HydrophobicContact CG-CD1 4.39Å
37	K	96.5	Very high	95.5	Very high	142 Å²	142	51.1 Å²	51.1	62%	0.617	23%	0.234	S	C	*	.	I	π-helix	trans	-87	-49.8	-173	-174.5	175	170.8	-88.5	0	113.2	E33 Y34 I35 G41	E33-K37 VanDerWaalsContact O-CB 3.24Å; E33-K37 WeakPolarHBondContact O-CB 3.49Å; E33-K37 PolarHBondContact O-N 3.35Å; Y34-K37 PolarHBondContact O-N 3.34Å; I35-K37 PolarHBondContact O-N 2.9Å; K37-G41 WeakPolarHBondContact O-CA 3.41Å
38	E	97.5	Very high	96.7	Very high	56 Å²	56	49.6 Å²	49.6	26%	0.262	23%	0.226	S	C	.	.	I	π-helix	trans	-100.2	-25.5	-169	-58.9	-55.6	150.4	0	0	113.9	Y34 R42 R129	Y34-E38 HydrophobicContact CD1-CB 4.44Å; Y34-E38 HydrophobicContact CD2-CB 4.3Å; Y34-E38 HydrophobicContact CD2-CG 4.01Å; Y34-E38 HydrophobicContact CE1-CB 4.01Å; Y34-E38 HydrophobicContact CE2-CB 3.88Å; Y34-E38 HydrophobicContact CE2-CG 3.72Å; Y34-E38 PolarHBondContact O-N 3.29Å; E38-R42 WeakPolarHBondContact O-CB 3.34Å; E38-R129 WeakPolarHBondContact O-CD 3.45Å; E38-R129 WeakPolarHBondContact O-CG 3.24Å
39	V	98.1	Very high	97.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	23%	0.227	C	C	.	.	I	π-helix	trans	-94.9	-74.9	177	-172	0	0	0	0	109.9	Y34 I35 G41 R42 L43 L98 A126 R129 L130	Y34-V39 HydrophobicContact CD1-CG2 4.23Å; Y34-V39 HydrophobicContact CE1-CG2 3.97Å; I35-V39 HydrophobicContact CG1-CG2 4.41Å; I35-V39 HydrophobicContact CG2-CB 4.32Å; I35-V39 CarbonylContact O-C 3.54Å; I35-V39 WeakPolarHBondContact O-CA 3.34Å; I35-V39 WeakPolarHBondContact O-CB 3.43Å; I35-V39 PolarHBondContact O-N 3.03Å; V39-G41 VanDerWaalsContact C-N 3.32Å; V39-G41 PolarHBondContact O-N 3.19Å; V39-R42 WeakPolarHBondContact O-CA 3.39Å; V39-R42 WeakPolarHBondContact O-CB 3.32Å; V39-R42 PolarHBondContact O-N 3.09Å; V39-L43 HydrophobicContact CG1-CD1 4.46Å; V39-L43 WeakPolarHBondContact O-CG 3.41Å; V39-L43 PolarHBondContact O-N 3.1Å; V39-L98 HydrophobicContact CG1-CD2 3.91Å; V39-A126 HydrophobicContact CG1-CB 4.05Å; V39-R129 HydrophobicContact CG2-CB 3.87Å; V39-L130 HydrophobicContact CG2-CD2 3.8Å; V39-L130 HydrophobicContact CG2-CG 4.13Å
40	V	98.1	Very high	97.2	Very high	2 Å²	2	58 Å²	58	1%	0.012	26%	0.257	C	S	.	.	I	π-helix	trans	-58.6	-43.6	179.6	177.3	0	0	0	0	110.9	I35 R42 L43 F44 I79 K80 L83	I35-V40 HydrophobicContact CG2-CG2 4.05Å; I35-V40 PolarHBondContact O-N 3.43Å; V40-R42 PolarHBondContact O-N 2.98Å; V40-L43 PolarHBondContact O-N 3.29Å; V40-F44 HydrophobicContact CG1-CD2 3.85Å; V40-F44 HydrophobicContact CG1-CE2 3.9Å; V40-F44 WeakPolarHBondContact O-CD2 3.49Å; V40-F44 PolarHBondContact O-N 3.39Å; V40-F44 VanDerWaalsContact O-N 3.1Å; V40-I79 HydrophobicContact CG2-CG2 4.06Å; V40-K80 HydrophobicContact CG1-CB 4.09Å; V40-L83 HydrophobicContact CG2-CD1 4.06Å
41	G	96.9	Very high	97.2	Very high	23 Å²	23	58.1 Å²	58.1	24%	0.237	26%	0.26	C	S	.	.	H	α-helix	trans	-66.1	-17.2	174.9	0	0	0	0	0	115.3	K36 K37 V39 K45	K36-G41 PolarHBondContact O-N 3.49Å; K36-G41 VanDerWaalsContact O-N 3.13Å; K37-G41 WeakPolarHBondContact O-CA 3.41Å; V39-G41 VanDerWaalsContact C-N 3.32Å; V39-G41 PolarHBondContact O-N 3.19Å; G41-K45 VanDerWaalsContact O-CE 3.28Å; G41-K45 WeakPolarHBondContact O-CE 3.28Å
42	R	97.1	Very high	97.3	Very high	97 Å²	97	58.1 Å²	58.1	37%	0.366	26%	0.26	S	S	.	.	H	α-helix	trans	-86.4	-46.7	168.1	176.2	63.2	-164	-139.9	5.8	111.5	E38 V39 V40 F44 K45 E46 I125 R129	E38-R42 WeakPolarHBondContact O-CB 3.34Å; V39-R42 WeakPolarHBondContact O-CA 3.39Å; V39-R42 WeakPolarHBondContact O-CB 3.32Å; V39-R42 PolarHBondContact O-N 3.09Å; V40-R42 PolarHBondContact O-N 2.98Å; R42-F44 VanDerWaalsContact C-N 3.28Å; R42-F44 PolarHBondContact O-N 3.47Å; R42-K45 WeakPolarHBondContact O-CB 3.42Å; R42-K45 PolarHBondContact O-N 3.43Å; R42-E46 IonicContact CZ-OE1 2.68Å; R42-E46 IonicContact NE-OE1 2.75Å; R42-E46 PolarHBondContact NE-OE1 3.19Å; R42-E46 IonicContact NH2-OE1 2.69Å; R42-E46 PolarHBondContact NH2-OE1 3.47Å; R42-I125 HydrophobicContact CG-CG2 3.91Å; R42-R129 HydrophobicContact CG-CG 4.48Å
43	L	98.2	Very high	97.3	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-55.5	-43.7	-179.5	-64.8	174.2	0	0	0	111.6	V39 V40 K45 E46 V49 L76 L98 L122 I125 A126	V39-L43 HydrophobicContact CG1-CD1 4.46Å; V39-L43 WeakPolarHBondContact O-CG 3.41Å; V39-L43 PolarHBondContact O-N 3.1Å; V40-L43 PolarHBondContact O-N 3.29Å; L43-K45 PolarHBondContact O-N 3.19Å; L43-E46 PolarHBondContact O-N 3.47Å; L43-V49 VanDerWaalsContact O-CB 3.31Å; L43-V49 WeakPolarHBondContact O-CB 3.42Å; L43-V49 VanDerWaalsContact O-CG2 3.27Å; L43-V49 WeakPolarHBondContact O-CG2 3.24Å; L43-L76 HydrophobicContact CB-CD1 3.83Å; L43-L76 HydrophobicContact CD1-CD1 4.3Å; L43-L76 HydrophobicContact CD1-CD2 3.84Å; L43-L98 HydrophobicContact CD1-CD1 3.98Å; L43-L122 HydrophobicContact CD2-CB 4.24Å; L43-L122 HydrophobicContact CD2-CD2 3.96Å; L43-L122 VanDerWaalsContact CD2-O 3.22Å; L43-L122 WeakPolarHBondContact CD2-O 3.49Å; L43-I125 HydrophobicContact CD2-CB 4.21Å; L43-I125 HydrophobicContact CD2-CG2 3.99Å; L43-A126 HydrophobicContact CD1-CB 4.22Å; L43-A126 HydrophobicContact CD2-CB 4.32Å
44	F	97.7	Very high	97.3	Very high	59 Å²	59	64.2 Å²	64.2	26%	0.259	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-9.4	175.4	-93.5	-73.4	0	0	0	115.7	V40 R42 T53 L76 K80	V40-F44 HydrophobicContact CG1-CD2 3.85Å; V40-F44 HydrophobicContact CG1-CE2 3.9Å; V40-F44 WeakPolarHBondContact O-CD2 3.49Å; V40-F44 PolarHBondContact O-N 3.39Å; V40-F44 VanDerWaalsContact O-N 3.1Å; R42-F44 VanDerWaalsContact C-N 3.28Å; R42-F44 PolarHBondContact O-N 3.47Å; F44-T53 HydrophobicContact CD1-CG2 4.25Å; F44-T53 HydrophobicContact CE1-CG2 3.89Å; F44-L76 HydrophobicContact CD2-CB 4.36Å; F44-L76 HydrophobicContact CE2-CB 3.59Å; F44-L76 WeakPolarHBondContact CE2-O 3.3Å; F44-L76 HydrophobicContact CZ-CB 3.75Å; F44-K80 HydrophobicContact CD2-CD 3.95Å; F44-K80 HydrophobicContact CE2-CB 4.03Å; F44-K80 HydrophobicContact CE2-CD 3.46Å; F44-K80 VanDerWaalsContact CE2-CD 3.46Å; F44-K80 HydrophobicContact CE2-CG 4.39Å; F44-K80 HydrophobicContact CZ-CD 3.95Å
45	K	97.3	Very high	97.3	Very high	164 Å²	164	66.4 Å²	66.4	71%	0.713	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-11.2	176.4	-61.3	173.3	-178	172.7	0	113.1	G41 R42 L43	G41-K45 VanDerWaalsContact O-CE 3.28Å; G41-K45 WeakPolarHBondContact O-CE 3.28Å; R42-K45 WeakPolarHBondContact O-CB 3.42Å; R42-K45 PolarHBondContact O-N 3.43Å; L43-K45 PolarHBondContact O-N 3.19Å
46	E	97.4	Very high	97.2	Very high	33 Å²	33	68.6 Å²	68.6	15%	0.154	32%	0.32	C	S	.	.	S	Bend	trans	-78.2	131	-179.4	-62.3	-57.3	153.6	0	0	111	R42 L43 I48 V49 L122 I125	R42-E46 IonicContact CZ-OE1 2.68Å; R42-E46 IonicContact NE-OE1 2.75Å; R42-E46 PolarHBondContact NE-OE1 3.19Å; R42-E46 IonicContact NH2-OE1 2.69Å; R42-E46 PolarHBondContact NH2-OE1 3.47Å; L43-E46 PolarHBondContact O-N 3.47Å; E46-I48 HydrophobicContact CB-CG1 4.2Å; E46-I48 PolarHBondContact O-N 2.99Å; E46-V49 VanDerWaalsContact O-CB 3.3Å; E46-V49 WeakPolarHBondContact O-CB 3.45Å; E46-V49 WeakPolarHBondContact O-CG1 3.15Å; E46-V49 PolarHBondContact O-N 3.45Å; E46-L122 HydrophobicContact CB-CD2 3.84Å; E46-L122 HydrophobicContact CG-CD2 4.12Å; E46-I125 HydrophobicContact CG-CD1 3.84Å
47	K	96.7	Very high	97	Very high	203 Å²	203	68.4 Å²	68.4	88%	0.883	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-56.3	-27.9	-177.5	-65.7	-173	177.5	-174.5	0	113.7
48	I	95.5	Very high	96.8	Very high	43 Å²	43	64.6 Å²	64.6	22%	0.221	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-84.9	-0.5	-179.7	57.8	167.7	0	0	0	114.3	E46 W50 P51 M118 K121 L122	E46-I48 HydrophobicContact CB-CG1 4.2Å; E46-I48 PolarHBondContact O-N 2.99Å; I48-W50 PolarHBondContact O-N 3.15Å; I48-P51 WeakPolarHBondContact O-CD 3.29Å; I48-M118 HydrophobicContact CB-CB 4.3Å; I48-M118 HydrophobicContact CB-CE 4.02Å; I48-M118 HydrophobicContact CB-CG 4.04Å; I48-M118 HydrophobicContact CG2-CG 4.19Å; I48-M118 WeakPolarHBondContact O-CE 3.22Å; I48-K121 HydrophobicContact CD1-CB 3.76Å; I48-K121 HydrophobicContact CD1-CD 3.86Å; I48-K121 HydrophobicContact CD1-CG 3.73Å; I48-L122 HydrophobicContact CD1-CD2 4.29Å; I48-L122 HydrophobicContact CD1-CG 3.88Å; I48-L122 HydrophobicContact CG1-CD1 4.42Å; I48-L122 HydrophobicContact CG1-CD2 4.05Å; I48-L122 HydrophobicContact CG1-CG 4.03Å
49	V	97.9	Very high	96.6	Very high	12 Å²	12	69.5 Å²	69.5	7%	0.073	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-68.8	-20	-174.4	74.9	0	0	0	0	113.9	L43 E46 P51 F52 T53 L76 L122	L43-V49 VanDerWaalsContact O-CB 3.31Å; L43-V49 WeakPolarHBondContact O-CB 3.42Å; L43-V49 VanDerWaalsContact O-CG2 3.27Å; L43-V49 WeakPolarHBondContact O-CG2 3.24Å; E46-V49 VanDerWaalsContact O-CB 3.3Å; E46-V49 WeakPolarHBondContact O-CB 3.45Å; E46-V49 WeakPolarHBondContact O-CG1 3.15Å; E46-V49 PolarHBondContact O-N 3.45Å; V49-P51 WeakPolarHBondContact O-CD 3.3Å; V49-P51 VanDerWaalsContact O-N 3.12Å; V49-F52 WeakPolarHBondContact O-CB 3.28Å; V49-F52 PolarHBondContact O-N 2.96Å; V49-T53 HydrophobicContact CB-CG2 4.44Å; V49-T53 HydrophobicContact CG1-CG2 3.82Å; V49-T53 HydrophobicContact CG2-CG2 4.12Å; V49-L76 HydrophobicContact CG2-CD1 3.38Å; V49-L122 HydrophobicContact CB-CD2 4.22Å; V49-L122 HydrophobicContact CG2-CD2 4.31Å
50	W	95.9	Very high	96.3	Very high	180 Å²	180	78.7 Å²	78.7	68%	0.682	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-51.7	-39.4	-163.7	69	-96.4	0	0	0	116.6	I48 F52 T53 M118	I48-W50 PolarHBondContact O-N 3.15Å; W50-F52 PolarHBondContact O-N 2.99Å; W50-T53 PolarHBondContact O-N 3.5Å; W50-T53 PolarHBondContact O-OG1 3.07Å; W50-M118 HydrophobicContact CZ2-CE 4.4Å
51	P	96.8	Very high	96	Very high	32 Å²	32	83.2 Å²	83.2	21%	0.208	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-65.4	-23.8	178.9	-17.6	32	0	0	0	113.3	I48 V49 V115 M118	I48-P51 WeakPolarHBondContact O-CD 3.29Å; V49-P51 WeakPolarHBondContact O-CD 3.3Å; V49-P51 VanDerWaalsContact O-N 3.12Å; P51-V115 HydrophobicContact CB-CG2 4.06Å; P51-V115 HydrophobicContact CG-CG2 4.29Å; P51-M118 HydrophobicContact CG-CE 3.44Å; P51-M118 VanDerWaalsContact CG-CE 3.44Å; P51-M118 HydrophobicContact CG-SD 4.47Å
52	F	98.3	Very high	95.8	Very high	13 Å²	13	88.4 Å²	88.4	6%	0.057	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-100.1	4.6	-173.4	-52	-81.4	0	0	0	112.8	V49 W50 L76 M101 C105 V115 M118 A119 L122	V49-F52 WeakPolarHBondContact O-CB 3.28Å; V49-F52 PolarHBondContact O-N 2.96Å; W50-F52 PolarHBondContact O-N 2.99Å; F52-L76 HydrophobicContact CB-CD1 4.37Å; F52-L76 WeakPolarHBondContact O-CB 3.43Å; F52-L76 PolarHBondContact O-N 3.3Å; F52-M101 HydrophobicContact CB-CE 4.29Å; F52-M101 HydrophobicContact CB-SD 3.85Å; F52-M101 HydrophobicContact CD1-CE 4.37Å; F52-M101 HydrophobicContact CD1-CG 4.11Å; F52-M101 HydrophobicContact CD1-SD 4.23Å; F52-M101 HydrophobicContact CG-SD 4.46Å; F52-C105 HydrophobicContact CE1-CB 4.02Å; F52-V115 HydrophobicContact CE1-CG2 4.49Å; F52-V115 HydrophobicContact CE2-CG2 4.35Å; F52-V115 HydrophobicContact CZ-CG2 3.77Å; F52-M118 HydrophobicContact CE2-CB 4.16Å; F52-A119 HydrophobicContact CE1-CB 4.12Å; F52-A119 HydrophobicContact CZ-CB 3.72Å; F52-L122 HydrophobicContact CD2-CD1 3.33Å; F52-L122 HydrophobicContact CE2-CD1 3.61Å; F52-L122 HydrophobicContact CG-CD1 4.19Å
53	T	97.9	Very high	95.4	Very high	37 Å²	37	86.1 Å²	86.1	23%	0.227	40%	0.404	C	S	.	.	S	Bend	trans	-84.8	-13.6	-174.6	57.7	0	0	0	0	115.2	F44 V49 W50 G77	F44-T53 HydrophobicContact CD1-CG2 4.25Å; F44-T53 HydrophobicContact CE1-CG2 3.89Å; V49-T53 HydrophobicContact CB-CG2 4.44Å; V49-T53 HydrophobicContact CG1-CG2 3.82Å; V49-T53 HydrophobicContact CG2-CG2 4.12Å; W50-T53 PolarHBondContact O-N 3.5Å; W50-T53 PolarHBondContact O-OG1 3.07Å; T53-G77 PolarHBondContact O-N 2.98Å
54	K	96.5	Very high	95.1	Very high	156 Å²	156	89.6 Å²	89.6	68%	0.678	43%	0.427	S	S	*	.	S	Bend	trans	-150.1	160.6	-175.3	-65	-172.8	-179.3	-176.8	0	109.6	D75	K54-D75 VanDerWaalsContact C-CB 3.45Å; K54-D75 VanDerWaalsContact CA-OD1 3.24Å; K54-D75 WeakPolarHBondContact CA-OD1 3.48Å; K54-D75 PolarHBondContact N-OD1 3.28Å; K54-D75 WeakPolarHBondContact O-CB 3.49Å
55	P	97.3	Very high	94.7	Very high	83 Å²	83	90.2 Å²	90.2	54%	0.539	43%	0.433	S	S	.	.			trans	-53.7	146.2	172.1	-26.1	33.5	0	0	0	112.6	D57 D75	P55-D57 PolarHBondContact O-N 3.17Å; P55-D75 WeakPolarHBondContact CD-OD2 3.46Å; P55-D75 WeakPolarHBondContact CG-OD2 3.46Å; P55-D75 VanDerWaalsContact N-CG 3.35Å
56	V	95.6	Very high	94.5	Very high	46 Å²	46	83.2 Å²	83.2	28%	0.279	40%	0.402	S	S	.	.			trans	-68.7	106.1	179.1	178.3	0	0	0	0	110.2	H58 L61 L63 Y66	V56-H58 PolarHBondContact O-N 3.49Å; V56-L61 HydrophobicContact CG1-CD1 4.04Å; V56-L63 HydrophobicContact CG1-CD1 4.34Å; V56-Y66 HydrophobicContact CB-CD1 4.36Å; V56-Y66 HydrophobicContact CB-CE1 3.78Å; V56-Y66 HydrophobicContact CB-CE2 4.2Å; V56-Y66 HydrophobicContact CG1-CD1 4.2Å; V56-Y66 HydrophobicContact CG1-CD2 4.09Å; V56-Y66 HydrophobicContact CG1-CE1 4.06Å; V56-Y66 HydrophobicContact CG1-CE2 3.93Å; V56-Y66 HydrophobicContact CG1-CG 4.24Å; V56-Y66 HydrophobicContact CG2-CE1 4.28Å; V56-Y66 HydrophobicContact CG2-CE2 4.14Å; V56-Y66 WeakPolarHBondContact CG2-OH 3.43Å
57	D	94.7	Very high	94.2	Very high	54 Å²	54	84.6 Å²	84.6	29%	0.289	42%	0.415	S	S	.	.			trans	-71.3	77.1	172.6	-175.9	-11.4	0	0	0	110.3	P55 Q59 R60 L61	P55-D57 PolarHBondContact O-N 3.17Å; D57-Q59 PolarHBondContact O-N 2.97Å; D57-R60 HydrophobicContact CB-CB 4.35Å; D57-R60 PolarHBondContact O-N 2.9Å; D57-R60 VanDerWaalsContact OD1-CB 3.23Å; D57-R60 WeakPolarHBondContact OD1-CB 3.29Å; D57-R60 PolarHBondContact OD1-N 3.24Å; D57-R60 WeakPolarHBondContact OD2-CB 3.45Å; D57-R60 WeakPolarHBondContact OD2-CD 3.4Å; D57-R60 IonicContact OD2-CZ 2.68Å; D57-R60 IonicContact OD2-NE 3.14Å; D57-R60 PolarHBondContact OD2-NE 3.37Å; D57-R60 IonicContact OD2-NH1 2.67Å; D57-R60 IonicContact OD2-NH2 2.66Å; D57-R60 PolarHBondContact OD2-NH2 2.7Å; D57-L61 WeakPolarHBondContact O-CB 3.36Å; D57-L61 VanDerWaalsContact O-CG 3.27Å; D57-L61 WeakPolarHBondContact O-CG 3.32Å; D57-L61 PolarHBondContact O-N 2.86Å
58	H	92.4	Very high	94	Very high	61 Å²	61	80.8 Å²	80.8	28%	0.282	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.8	-176.2	70.3	85.8	0	0	0	113.3	V56 N62 L63 Y66	V56-H58 PolarHBondContact O-N 3.49Å; H58-N62 PolarHBondContact O-N 3.32Å; H58-L63 HydrophobicContact CB-CB 4.13Å; H58-L63 PolarHBondContact O-N 3.42Å; H58-Y66 HydrophobicContact CB-CD1 4.27Å; H58-Y66 HydrophobicContact CB-CG 4.28Å
59	Q	92	Very high	93.6	Very high	159 Å²	159	81 Å²	81	74%	0.743	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-56.9	173	-68.4	-177.1	-35.8	0	0	110.1	D57 L61 N62	D57-Q59 PolarHBondContact O-N 2.97Å; Q59-L61 VanDerWaalsContact C-N 3.29Å; Q59-L61 PolarHBondContact O-N 3.48Å; Q59-N62 PolarHBondContact O-N 3.35Å
60	R	92.8	Very high	93.3	Very high	194 Å²	194	80.6 Å²	80.6	73%	0.732	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.1	179.1	-175	-176.9	60.1	-173.3	-10.9	113.2	D57 N62	D57-R60 HydrophobicContact CB-CB 4.35Å; D57-R60 PolarHBondContact O-N 2.9Å; D57-R60 VanDerWaalsContact OD1-CB 3.23Å; D57-R60 WeakPolarHBondContact OD1-CB 3.29Å; D57-R60 PolarHBondContact OD1-N 3.24Å; D57-R60 WeakPolarHBondContact OD2-CB 3.45Å; D57-R60 WeakPolarHBondContact OD2-CD 3.4Å; D57-R60 IonicContact OD2-CZ 2.68Å; D57-R60 IonicContact OD2-NE 3.14Å; D57-R60 PolarHBondContact OD2-NE 3.37Å; D57-R60 IonicContact OD2-NH1 2.67Å; D57-R60 IonicContact OD2-NH2 2.66Å; D57-R60 PolarHBondContact OD2-NH2 2.7Å; R60-N62 VanDerWaalsContact C-N 3.29Å
61	L	91.6	Very high	93.2	Very high	97 Å²	97	79.1 Å²	79.1	51%	0.508	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-6.7	175.5	-65.3	172.1	0	0	0	113.4	V56 D57 Q59 L63	V56-L61 HydrophobicContact CG1-CD1 4.04Å; D57-L61 WeakPolarHBondContact O-CB 3.36Å; D57-L61 VanDerWaalsContact O-CG 3.27Å; D57-L61 WeakPolarHBondContact O-CG 3.32Å; D57-L61 PolarHBondContact O-N 2.86Å; Q59-L61 VanDerWaalsContact C-N 3.29Å; Q59-L61 PolarHBondContact O-N 3.48Å; L61-L63 HydrophobicContact CB-CD1 3.77Å; L61-L63 HydrophobicContact CB-CG 3.76Å; L61-L63 HydrophobicContact CD1-CD1 4.07Å
62	N	91.8	Very high	92.9	Very high	132 Å²	132	84.2 Å²	84.2	71%	0.706	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	54.2	-174.9	-168	89.4	0	0	0	112.5	H58 Q59 R60 P64	H58-N62 PolarHBondContact O-N 3.32Å; Q59-N62 PolarHBondContact O-N 3.35Å; R60-N62 VanDerWaalsContact C-N 3.29Å; N62-P64 VanDerWaalsContact O-CD 3.26Å; N62-P64 WeakPolarHBondContact O-CD 3.42Å
63	L	89.4	Confident	92.8	Very high	49 Å²	49	86.9 Å²	86.9	26%	0.257	43%	0.434	S	S	.	.			trans	-115.8	65.8	179.4	-56.2	178	0	0	0	110.2	V56 H58 L61 D65 Y66 F108	V56-L63 HydrophobicContact CG1-CD1 4.34Å; H58-L63 HydrophobicContact CB-CB 4.13Å; H58-L63 PolarHBondContact O-N 3.42Å; L61-L63 HydrophobicContact CB-CD1 3.77Å; L61-L63 HydrophobicContact CB-CG 3.76Å; L61-L63 HydrophobicContact CD1-CD1 4.07Å; L63-D65 PolarHBondContact O-N 2.89Å; L63-D65 VanDerWaalsContact O-N 3.08Å; L63-Y66 WeakPolarHBondContact O-CB 3.44Å; L63-Y66 PolarHBondContact O-N 2.92Å; L63-F108 HydrophobicContact CB-CZ 4.07Å; L63-F108 HydrophobicContact CD1-CE1 3.94Å; L63-F108 HydrophobicContact CD1-CZ 4.28Å; L63-F108 HydrophobicContact CD2-CE1 4.03Å; L63-F108 HydrophobicContact CD2-CZ 4.09Å; L63-F108 HydrophobicContact CG-CE1 4.4Å; L63-F108 HydrophobicContact CG-CZ 4.37Å
64	P	91.2	Very high	92.8	Very high	75 Å²	75	86 Å²	86	49%	0.487	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.9	-170.5	26.8	-36.5	0	0	0	114.2	N62 K68	N62-P64 VanDerWaalsContact O-CD 3.26Å; N62-P64 WeakPolarHBondContact O-CD 3.42Å; P64-K68 WeakPolarHBondContact O-CE 3.07Å
65	D	89.2	Confident	92.9	Very high	72 Å²	72	78.8 Å²	78.8	39%	0.385	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-7.4	178.4	-58.6	-61.4	0	0	0	113.9	L63 K68 I69	L63-D65 PolarHBondContact O-N 2.89Å; L63-D65 VanDerWaalsContact O-N 3.08Å; D65-K68 HydrophobicContact CB-CD 4.49Å; D65-K68 WeakPolarHBondContact O-CA 3.39Å; D65-K68 WeakPolarHBondContact O-CB 3.18Å; D65-K68 PolarHBondContact O-N 3.2Å; D65-K68 WeakPolarHBondContact OD1-CD 3.31Å; D65-K68 WeakPolarHBondContact OD1-CE 3.38Å; D65-K68 IonicContact OD1-NZ 3.1Å; D65-K68 PolarHBondContact OD1-NZ 3.49Å; D65-I69 HydrophobicContact CB-CD1 4.06Å; D65-I69 WeakPolarHBondContact O-CG1 3.41Å; D65-I69 PolarHBondContact O-N 2.94Å
66	Y	93	Very high	93	Very high	16 Å²	16	74.8 Å²	74.8	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-54.7	-53.1	177.5	-172.8	-86	0	0	0	113	V56 H58 L63 K68 I69 I70 P73 F108	V56-Y66 HydrophobicContact CB-CD1 4.36Å; V56-Y66 HydrophobicContact CB-CE1 3.78Å; V56-Y66 HydrophobicContact CB-CE2 4.2Å; V56-Y66 HydrophobicContact CG1-CD1 4.2Å; V56-Y66 HydrophobicContact CG1-CD2 4.09Å; V56-Y66 HydrophobicContact CG1-CE1 4.06Å; V56-Y66 HydrophobicContact CG1-CE2 3.93Å; V56-Y66 HydrophobicContact CG1-CG 4.24Å; V56-Y66 HydrophobicContact CG2-CE1 4.28Å; V56-Y66 HydrophobicContact CG2-CE2 4.14Å; V56-Y66 WeakPolarHBondContact CG2-OH 3.43Å; H58-Y66 HydrophobicContact CB-CD1 4.27Å; H58-Y66 HydrophobicContact CB-CG 4.28Å; L63-Y66 WeakPolarHBondContact O-CB 3.44Å; L63-Y66 PolarHBondContact O-N 2.92Å; Y66-K68 PolarHBondContact O-N 3.39Å; Y66-I69 PolarHBondContact O-N 2.98Å; Y66-I70 HydrophobicContact CD1-CB 4.39Å; Y66-I70 HydrophobicContact CD2-CG1 4.13Å; Y66-I70 HydrophobicContact CE1-CB 4Å; Y66-I70 HydrophobicContact CE1-CG1 4.26Å; Y66-I70 HydrophobicContact CE1-CG2 4.11Å; Y66-I70 HydrophobicContact CE2-CB 4.41Å; Y66-I70 HydrophobicContact CE2-CG1 3.76Å; Y66-I70 WeakPolarHBondContact O-CB 3.12Å; Y66-I70 PolarHBondContact O-N 3.24Å; Y66-P73 HydrophobicContact CE1-CB 4.45Å; Y66-P73 HydrophobicContact CE1-CG 4.45Å; Y66-F108 HydrophobicContact CD2-CB 4.39Å; Y66-F108 AromaticContact CD2-CD1 3.92Å; Y66-F108 HydrophobicContact CD2-CD1 3.92Å; Y66-F108 AromaticContact CD2-CD2 3.66Å; Y66-F108 HydrophobicContact CD2-CD2 3.66Å; Y66-F108 HydrophobicContact CD2-CE1 4.09Å; Y66-F108 AromaticContact CD2-CE2 3.85Å; Y66-F108 HydrophobicContact CD2-CE2 3.85Å; Y66-F108 AromaticContact CD2-CG 3.71Å; Y66-F108 HydrophobicContact CD2-CG 3.71Å; Y66-F108 HydrophobicContact CD2-CZ 4.06Å; Y66-F108 HydrophobicContact CE2-CB 4.35Å; Y66-F108 HydrophobicContact CE2-CD1 4.39Å; Y66-F108 HydrophobicContact CE2-CD2 4.4Å; Y66-F108 HydrophobicContact CE2-CG 4.12Å; Y66-F108 HydrophobicContact CG-CD2 4.4Å; Y66-F108 HydrophobicContact CG-CE2 4.3Å
67	P	92.2	Very high	93.1	Very high	63 Å²	63	73.8 Å²	73.8	41%	0.409	37%	0.37	S	S	.	.	H	α-helix	trans	-69.6	-12.5	176.5	30.1	-37.9	0	0	0	113.9
68	K	91.8	Very high	93.2	Very high	123 Å²	123	73.2 Å²	73.2	54%	0.535	37%	0.368	S	S	.	.	H	α-helix	trans	-82.1	-39.7	174.5	-52.1	-178.3	-162	162	0	111	P64 D65 Y66 K71	P64-K68 WeakPolarHBondContact O-CE 3.07Å; D65-K68 HydrophobicContact CB-CD 4.49Å; D65-K68 WeakPolarHBondContact O-CA 3.39Å; D65-K68 WeakPolarHBondContact O-CB 3.18Å; D65-K68 PolarHBondContact O-N 3.2Å; D65-K68 WeakPolarHBondContact OD1-CD 3.31Å; D65-K68 WeakPolarHBondContact OD1-CE 3.38Å; D65-K68 IonicContact OD1-NZ 3.1Å; D65-K68 PolarHBondContact OD1-NZ 3.49Å; Y66-K68 PolarHBondContact O-N 3.39Å; K68-K71 PolarHBondContact O-NZ 3.14Å
69	I	87.7	Confident	93.5	Very high	46 Å²	46	70.3 Å²	70.3	24%	0.236	36%	0.355	C	S	.	.	H	α-helix	trans	-84.5	-50.1	-176.9	-64.2	169.4	0	0	0	111	D65 Y66 K71 I107 F108 M616	D65-I69 HydrophobicContact CB-CD1 4.06Å; D65-I69 WeakPolarHBondContact O-CG1 3.41Å; D65-I69 PolarHBondContact O-N 2.94Å; Y66-I69 PolarHBondContact O-N 2.98Å; I69-K71 PolarHBondContact O-N 3.09Å; I69-I107 HydrophobicContact CG2-CG2 3.87Å; I69-F108 HydrophobicContact CB-CD2 4.42Å; I69-F108 HydrophobicContact CD1-CD2 4.13Å; I69-F108 HydrophobicContact CD1-CE2 4.1Å; I69-F108 HydrophobicContact CG2-CD2 4.43Å; I69-M616 HydrophobicContact CG2-CE 4.24Å
70	I	92.1	Very high	93.8	Very high	4 Å²	4	67.3 Å²	67.3	2%	0.021	34%	0.339	C	S	.	.			trans	-90.2	106.4	-175.9	-60.2	-54.7	0	0	0	110.4	Y66 P73 N104 I107 F108	Y66-I70 HydrophobicContact CD1-CB 4.39Å; Y66-I70 HydrophobicContact CD2-CG1 4.13Å; Y66-I70 HydrophobicContact CE1-CB 4Å; Y66-I70 HydrophobicContact CE1-CG1 4.26Å; Y66-I70 HydrophobicContact CE1-CG2 4.11Å; Y66-I70 HydrophobicContact CE2-CB 4.41Å; Y66-I70 HydrophobicContact CE2-CG1 3.76Å; Y66-I70 WeakPolarHBondContact O-CB 3.12Å; Y66-I70 PolarHBondContact O-N 3.24Å; I70-P73 HydrophobicContact CG2-CG 4.17Å; I70-N104 HydrophobicContact CD1-CB 4.05Å; I70-N104 WeakPolarHBondContact CD1-O 3.34Å; I70-N104 HydrophobicContact CG2-CB 4.11Å; I70-N104 WeakPolarHBondContact CG2-OD1 3.39Å; I70-I107 HydrophobicContact CD1-CB 4Å; I70-I107 HydrophobicContact CD1-CG2 3.72Å; I70-F108 HydrophobicContact CD1-CB 4.21Å; I70-F108 HydrophobicContact CG1-CB 4.26Å
71	K	92.1	Very high	94	Very high	149 Å²	149	62.9 Å²	62.9	65%	0.648	33%	0.327	S	S	*	.	S	Bend	trans	-78.1	-29.3	-177.3	-56	-50.7	-169.9	-172.4	0	114.1	K68 I69	K68-K71 PolarHBondContact O-NZ 3.14Å; I69-K71 PolarHBondContact O-N 3.09Å
72	H	91.9	Very high	94.2	Very high	140 Å²	140	61.8 Å²	61.8	65%	0.648	32%	0.316	S	S	*	.	S	Bend	trans	-127.8	74.5	-178.7	-56.7	-65.1	0	0	0	111	M74 T100 N104	H72-M74 PolarHBondContact O-N 2.88Å; H72-T100 HydrophobicContact CB-CG2 4.21Å; H72-N104 PolarHBondContact O-ND2 3.25Å
73	P	96.5	Very high	94.4	Very high	69 Å²	69	55.8 Å²	55.8	45%	0.448	28%	0.284	S	S	.	.			trans	-55.9	133.3	175.9	-23	33.6	0	0	0	111.3	Y66 I70	Y66-P73 HydrophobicContact CE1-CB 4.45Å; Y66-P73 HydrophobicContact CE1-CG 4.45Å; I70-P73 HydrophobicContact CG2-CG 4.17Å
74	M	97.9	Very high	94.6	Very high	17 Å²	17	57.5 Å²	57.5	8%	0.084	29%	0.293	C	S	.	.			trans	-148.3	149.2	-176.6	-168.7	49.9	55.7	0	0	111.3	H72 T78 I79 D97 T100 M101	H72-M74 PolarHBondContact O-N 2.88Å; M74-T78 HydrophobicContact CE-CG2 4.12Å; M74-T78 HydrophobicContact SD-CG2 3.69Å; M74-I79 HydrophobicContact CG-CD1 4Å; M74-I79 HydrophobicContact CG-CG1 4.07Å; M74-I79 HydrophobicContact SD-CD1 4.32Å; M74-I79 HydrophobicContact SD-CG1 3.73Å; M74-D97 HydrophobicContact CE-CB 4.39Å; M74-D97 VanDerWaalsContact CE-OD1 3.31Å; M74-D97 WeakPolarHBondContact CE-OD1 3.5Å; M74-D97 HydrophobicContact CG-CB 3.93Å; M74-D97 VanDerWaalsContact CG-O 3.31Å; M74-D97 WeakPolarHBondContact CG-O 3.45Å; M74-D97 HydrophobicContact SD-CB 4.05Å; M74-T100 HydrophobicContact CB-CG2 4.43Å; M74-M101 HydrophobicContact CB-CB 4.26Å; M74-M101 HydrophobicContact CG-CB 4.31Å; M74-M101 WeakPolarHBondContact O-CG 3.26Å
75	D	98.6	Very high	94.7	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.027	30%	0.297	C	S	.	.			trans	-154.8	159.4	-176.7	73.2	98	0	0	0	111.7	K54 P55 G77 T78 I79	K54-D75 VanDerWaalsContact C-CB 3.45Å; K54-D75 VanDerWaalsContact CA-OD1 3.24Å; K54-D75 WeakPolarHBondContact CA-OD1 3.48Å; K54-D75 PolarHBondContact N-OD1 3.28Å; K54-D75 WeakPolarHBondContact O-CB 3.49Å; P55-D75 WeakPolarHBondContact CD-OD2 3.46Å; P55-D75 WeakPolarHBondContact CG-OD2 3.46Å; P55-D75 VanDerWaalsContact N-CG 3.35Å; D75-G77 PolarHBondContact O-N 3.01Å; D75-G77 WeakPolarHBondContact OD1-CA 3.34Å; D75-G77 PolarHBondContact OD1-N 3.3Å; D75-T78 PolarHBondContact O-N 3.25Å; D75-T78 PolarHBondContact OD1-N 3.45Å; D75-T78 WeakPolarHBondContact OD2-CB 3.35Å; D75-T78 PolarHBondContact OD2-OG1 3.46Å; D75-I79 WeakPolarHBondContact O-CG1 3.28Å; D75-I79 PolarHBondContact O-N 3.3Å
76	L	98.4	Very high	94.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-25.6	-179.2	-66.5	174.4	0	0	0	113.5	L43 F44 V49 F52 I79 K80 L98 M101	L43-L76 HydrophobicContact CB-CD1 3.83Å; L43-L76 HydrophobicContact CD1-CD1 4.3Å; L43-L76 HydrophobicContact CD1-CD2 3.84Å; F44-L76 HydrophobicContact CD2-CB 4.36Å; F44-L76 HydrophobicContact CE2-CB 3.59Å; F44-L76 WeakPolarHBondContact CE2-O 3.3Å; F44-L76 HydrophobicContact CZ-CB 3.75Å; V49-L76 HydrophobicContact CG2-CD1 3.38Å; F52-L76 HydrophobicContact CB-CD1 4.37Å; F52-L76 WeakPolarHBondContact O-CB 3.43Å; F52-L76 PolarHBondContact O-N 3.3Å; L76-I79 HydrophobicContact CD2-CD1 4.39Å; L76-K80 WeakPolarHBondContact O-CB 3.42Å; L76-K80 PolarHBondContact O-N 3.47Å; L76-L98 HydrophobicContact CD2-CD1 3.73Å; L76-M101 HydrophobicContact CD1-CE 4.49Å; L76-M101 HydrophobicContact CD2-CE 3.87Å; L76-M101 HydrophobicContact CD2-SD 3.99Å; L76-M101 HydrophobicContact CG-CE 3.93Å; L76-M101 HydrophobicContact CG-SD 3.66Å
77	G	97.6	Very high	94.8	Very high	25 Å²	25	62.9 Å²	62.9	26%	0.258	31%	0.311	S	S	.	.	H	α-helix	trans	-66.4	-48.6	173.5	0	0	0	0	0	111.2	T53 D75 K80 Q81	T53-G77 PolarHBondContact O-N 2.98Å; D75-G77 PolarHBondContact O-N 3.01Å; D75-G77 WeakPolarHBondContact OD1-CA 3.34Å; D75-G77 PolarHBondContact OD1-N 3.3Å; G77-K80 PolarHBondContact O-N 3.44Å; G77-Q81 WeakPolarHBondContact O-CB 3.19Å; G77-Q81 PolarHBondContact O-N 3.07Å
78	T	98.2	Very high	94.9	Very high	42 Å²	42	60.2 Å²	60.2	26%	0.258	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-48.3	173.4	-64	0	0	0	0	111.7	M74 D75 K80 Q81 R82	M74-T78 HydrophobicContact CE-CG2 4.12Å; M74-T78 HydrophobicContact SD-CG2 3.69Å; D75-T78 PolarHBondContact O-N 3.25Å; D75-T78 PolarHBondContact OD1-N 3.45Å; D75-T78 WeakPolarHBondContact OD2-CB 3.35Å; D75-T78 PolarHBondContact OD2-OG1 3.46Å; T78-K80 PolarHBondContact O-N 3.18Å; T78-Q81 PolarHBondContact O-N 2.92Å; T78-Q81 VanDerWaalsContact O-N 3.17Å; T78-R82 HydrophobicContact CG2-CG 4.46Å; T78-R82 WeakPolarHBondContact O-CG 3.36Å; T78-R82 PolarHBondContact O-N 3.46Å
79	I	98.2	Very high	94.8	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-47.1	178.7	-64.8	164.2	0	0	0	111.2	V40 M74 D75 L76 Q81 R82 L83 Y88 D97 L98	V40-I79 HydrophobicContact CG2-CG2 4.06Å; M74-I79 HydrophobicContact CG-CD1 4Å; M74-I79 HydrophobicContact CG-CG1 4.07Å; M74-I79 HydrophobicContact SD-CD1 4.32Å; M74-I79 HydrophobicContact SD-CG1 3.73Å; D75-I79 WeakPolarHBondContact O-CG1 3.28Å; D75-I79 PolarHBondContact O-N 3.3Å; L76-I79 HydrophobicContact CD2-CD1 4.39Å; I79-Q81 VanDerWaalsContact C-N 3.28Å; I79-Q81 PolarHBondContact O-N 3.04Å; I79-R82 PolarHBondContact O-N 3.1Å; I79-L83 HydrophobicContact CG2-CD1 3.99Å; I79-L83 WeakPolarHBondContact O-CG 3.49Å; I79-L83 PolarHBondContact O-N 2.89Å; I79-Y88 HydrophobicContact CG2-CE2 4.46Å; I79-D97 HydrophobicContact CD1-CB 4.19Å; I79-D97 HydrophobicContact CG1-CB 3.92Å; I79-L98 HydrophobicContact CD1-CB 4.23Å; I79-L98 HydrophobicContact CD1-CD1 4.23Å
80	K	97.8	Very high	95	Very high	95 Å²	95	60.5 Å²	60.5	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-36.7	176.9	-179.2	174	176.3	-179.3	0	112.1	V40 F44 L76 G77 T78 N84	V40-K80 HydrophobicContact CG1-CB 4.09Å; F44-K80 HydrophobicContact CD2-CD 3.95Å; F44-K80 HydrophobicContact CE2-CB 4.03Å; F44-K80 HydrophobicContact CE2-CD 3.46Å; F44-K80 VanDerWaalsContact CE2-CD 3.46Å; F44-K80 HydrophobicContact CE2-CG 4.39Å; F44-K80 HydrophobicContact CZ-CD 3.95Å; L76-K80 WeakPolarHBondContact O-CB 3.42Å; L76-K80 PolarHBondContact O-N 3.47Å; G77-K80 PolarHBondContact O-N 3.44Å; T78-K80 PolarHBondContact O-N 3.18Å; K80-N84 WeakPolarHBondContact O-CB 3.33Å; K80-N84 PolarHBondContact O-N 3.39Å; K80-N84 PolarHBondContact O-ND2 3.02Å
81	Q	96.5	Very high	95.2	Very high	101 Å²	101	60.9 Å²	60.9	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-71.3	-41.6	175.6	-173.5	61.7	7.7	0	0	112	G77 T78 I79 L83 N84 L85	G77-Q81 WeakPolarHBondContact O-CB 3.19Å; G77-Q81 PolarHBondContact O-N 3.07Å; T78-Q81 PolarHBondContact O-N 2.92Å; T78-Q81 VanDerWaalsContact O-N 3.17Å; I79-Q81 VanDerWaalsContact C-N 3.28Å; I79-Q81 PolarHBondContact O-N 3.04Å; Q81-L83 PolarHBondContact O-N 3.21Å; Q81-N84 PolarHBondContact O-N 3.17Å; Q81-L85 HydrophobicContact CG-CD1 4.03Å; Q81-L85 HydrophobicContact CG-CG 4.42Å; Q81-L85 WeakPolarHBondContact O-CB 3.32Å; Q81-L85 WeakPolarHBondContact O-CG 3.14Å; Q81-L85 PolarHBondContact O-N 3.43Å
82	R	96.9	Very high	95.3	Very high	74 Å²	74	56.9 Å²	56.9	28%	0.279	29%	0.292	S	S	.	.	H	α-helix	trans	-58.6	-45.6	173.1	-75.1	178	176.2	-162.9	-2.8	111.4	T78 I79 L85 K86 F87 Y88 D97	T78-R82 HydrophobicContact CG2-CG 4.46Å; T78-R82 WeakPolarHBondContact O-CG 3.36Å; T78-R82 PolarHBondContact O-N 3.46Å; I79-R82 PolarHBondContact O-N 3.1Å; R82-L85 PolarHBondContact O-N 3.49Å; R82-K86 PolarHBondContact O-N 3.48Å; R82-K86 VanDerWaalsContact O-N 3.12Å; R82-F87 HydrophobicContact CB-CB 3.83Å; R82-F87 HydrophobicContact CB-CD1 3.97Å; R82-F87 HydrophobicContact CB-CG 4.12Å; R82-F87 HydrophobicContact CG-CB 4.12Å; R82-F87 HydrophobicContact CG-CD1 3.71Å; R82-F87 HydrophobicContact CG-CE1 4.29Å; R82-F87 HydrophobicContact CG-CG 3.91Å; R82-F87 VanDerWaalsContact O-CB 3.31Å; R82-F87 WeakPolarHBondContact O-CB 3.48Å; R82-F87 PolarHBondContact O-N 2.92Å; R82-Y88 HydrophobicContact CB-CD2 4.06Å; R82-Y88 HydrophobicContact CB-CE1 4.33Å; R82-Y88 HydrophobicContact CB-CE2 3.33Å; R82-Y88 VanDerWaalsContact CD-OH 3.22Å; R82-Y88 WeakPolarHBondContact CD-OH 3.45Å; R82-Y88 HydrophobicContact CG-CE2 4.47Å; R82-D97 WeakPolarHBondContact CD-OD2 3.28Å; R82-D97 IonicContact CZ-OD2 3.66Å; R82-D97 IonicContact NE-OD2 2.7Å; R82-D97 VanDerWaalsContact NH1-CG 3.3Å; R82-D97 IonicContact NH1-OD1 2.89Å; R82-D97 PolarHBondContact NH1-OD1 3.15Å; R82-D97 IonicContact NH1-OD2 3.81Å; R82-D97 PolarHBondContact NH1-OD2 2.91Å
83	L	95.6	Very high	95.4	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.037	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-44.1	173.2	-76.3	162.5	0	0	0	113.1	L32 I35 K36 V40 I79 Q81 K86 Y88	L32-L83 HydrophobicContact CB-CD2 4.3Å; L32-L83 HydrophobicContact CD2-CD2 3.75Å; I35-L83 HydrophobicContact CG2-CD1 4.43Å; K36-L83 HydrophobicContact CB-CB 4.37Å; K36-L83 HydrophobicContact CB-CD1 3.92Å; K36-L83 HydrophobicContact CB-CD2 4.22Å; K36-L83 HydrophobicContact CB-CG 4.4Å; K36-L83 HydrophobicContact CD-CB 4.25Å; K36-L83 HydrophobicContact CG-CB 4.17Å; K36-L83 HydrophobicContact CG-CD1 4.39Å; V40-L83 HydrophobicContact CG2-CD1 4.06Å; I79-L83 HydrophobicContact CG2-CD1 3.99Å; I79-L83 WeakPolarHBondContact O-CG 3.49Å; I79-L83 PolarHBondContact O-N 2.89Å; Q81-L83 PolarHBondContact O-N 3.21Å; L83-K86 PolarHBondContact O-N 2.89Å; L83-Y88 HydrophobicContact CD2-CD2 3.85Å; L83-Y88 HydrophobicContact CD2-CE2 4.24Å; L83-Y88 HydrophobicContact CG-CD2 3.94Å; L83-Y88 HydrophobicContact CG-CE2 3.86Å
84	N	93.6	Very high	95.5	Very high	85 Å²	85	50.5 Å²	50.5	46%	0.455	26%	0.257	S	S	.	.	H	α-helix	trans	-67	-34.8	178.4	-74.9	-24.2	0	0	0	113.2	K80 Q81 K86	K80-N84 WeakPolarHBondContact O-CB 3.33Å; K80-N84 PolarHBondContact O-N 3.39Å; K80-N84 PolarHBondContact O-ND2 3.02Å; Q81-N84 PolarHBondContact O-N 3.17Å; N84-K86 VanDerWaalsContact C-N 3.27Å
85	L	92.5	Very high	95.4	Very high	109 Å²	109	50.4 Å²	50.4	57%	0.571	26%	0.256	S	S	*	.	H	α-helix	trans	-78.9	-9.2	176.9	-69.1	176.5	0	0	0	113.5	Q81 R82	Q81-L85 HydrophobicContact CG-CD1 4.03Å; Q81-L85 HydrophobicContact CG-CG 4.42Å; Q81-L85 WeakPolarHBondContact O-CB 3.32Å; Q81-L85 WeakPolarHBondContact O-CG 3.14Å; Q81-L85 PolarHBondContact O-N 3.43Å; R82-L85 PolarHBondContact O-N 3.49Å
86	K	91.7	Very high	95.2	Very high	60 Å²	60	53.9 Å²	53.9	26%	0.261	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	50.8	-169.4	-60.7	178.7	158.7	-153.5	0	111.8	K26 I27 R82 L83 N84	K26-K86 HydrophobicContact CB-CB 4.18Å; K26-K86 HydrophobicContact CB-CD 3.62Å; K26-K86 VanDerWaalsContact O-CD 3.28Å; K26-K86 WeakPolarHBondContact O-CD 3.34Å; K26-K86 PolarHBondContact O-NZ 3.16Å; I27-K86 WeakPolarHBondContact O-CD 3.26Å; R82-K86 PolarHBondContact O-N 3.48Å; R82-K86 VanDerWaalsContact O-N 3.12Å; L83-K86 PolarHBondContact O-N 2.89Å; N84-K86 VanDerWaalsContact C-N 3.27Å
87	F	92.5	Very high	95.2	Very high	107 Å²	107	54.9 Å²	54.9	47%	0.469	28%	0.281	S	S	.	.			trans	-79	-31.7	178	177.3	-91.1	0	0	0	112.8	R82	R82-F87 HydrophobicContact CB-CB 3.83Å; R82-F87 HydrophobicContact CB-CD1 3.97Å; R82-F87 HydrophobicContact CB-CG 4.12Å; R82-F87 HydrophobicContact CG-CB 4.12Å; R82-F87 HydrophobicContact CG-CD1 3.71Å; R82-F87 HydrophobicContact CG-CE1 4.29Å; R82-F87 HydrophobicContact CG-CG 3.91Å; R82-F87 VanDerWaalsContact O-CB 3.31Å; R82-F87 WeakPolarHBondContact O-CB 3.48Å; R82-F87 PolarHBondContact O-N 2.92Å
88	Y	94	Very high	95.2	Very high	6 Å²	6	53.7 Å²	53.7	2%	0.024	27%	0.268	C	S	.	.			trans	-86.5	140.2	178	-54.3	-67.6	0	0	0	111.4	L32 I79 R82 L83 E93 C94 D97	L32-Y88 WeakPolarHBondContact CD1-O 3.22Å; L32-Y88 HydrophobicContact CD2-CD2 4.24Å; L32-Y88 HydrophobicContact CD2-CG 4.29Å; I79-Y88 HydrophobicContact CG2-CE2 4.46Å; R82-Y88 HydrophobicContact CB-CD2 4.06Å; R82-Y88 HydrophobicContact CB-CE1 4.33Å; R82-Y88 HydrophobicContact CB-CE2 3.33Å; R82-Y88 VanDerWaalsContact CD-OH 3.22Å; R82-Y88 WeakPolarHBondContact CD-OH 3.45Å; R82-Y88 HydrophobicContact CG-CE2 4.47Å; L83-Y88 HydrophobicContact CD2-CD2 3.85Å; L83-Y88 HydrophobicContact CD2-CE2 4.24Å; L83-Y88 HydrophobicContact CG-CD2 3.94Å; L83-Y88 HydrophobicContact CG-CE2 3.86Å; Y88-E93 VanDerWaalsContact CA-OE2 3.22Å; Y88-E93 WeakPolarHBondContact CA-OE2 3.37Å; Y88-E93 HydrophobicContact CD1-CB 3.69Å; Y88-E93 HydrophobicContact CE1-CB 4.44Å; Y88-E93 HydrophobicContact CG-CB 4.49Å; Y88-C94 HydrophobicContact CD1-CB 4.11Å; Y88-C94 HydrophobicContact CD2-CB 3.7Å; Y88-C94 HydrophobicContact CE1-CB 4.22Å; Y88-C94 HydrophobicContact CE2-CB 3.83Å; Y88-C94 VanDerWaalsContact CE2-SG 3.56Å; Y88-C94 HydrophobicContact CG-CB 3.84Å; Y88-D97 WeakPolarHBondContact CE1-OD2 3.26Å; Y88-D97 VanDerWaalsContact CZ-OD2 3.25Å; Y88-D97 PolarHBondContact OH-OD2 2.69Å
89	H	89.8	Confident	95.2	Very high	140 Å²	140	53.3 Å²	53.3	65%	0.648	26%	0.263	S	S	*	.	S	Bend	trans	-92.1	-32.6	176.8	-49.3	93.1	0	0	0	112.1	E93	H89-E93 IonicContact CE1-OE1 2.65Å; H89-E93 IonicContact CG-OE1 2.69Å; H89-E93 IonicContact CG-OE2 2.61Å; H89-E93 PolarHBondContact N-OE2 3.13Å; H89-E93 IonicContact ND1-OE1 2.66Å; H89-E93 PolarHBondContact ND1-OE1 2.68Å; H89-E93 IonicContact ND1-OE2 3.6Å; H89-E93 PolarHBondContact ND1-OE2 2.75Å; H89-E93 VanDerWaalsContact ND1-OE2 3.14Å
90	S	93.8	Very high	95.1	Very high	36 Å²	36	54.6 Å²	54.6	25%	0.252	27%	0.271	S	S	.	.	S	Bend	trans	-137.9	164.9	-179.8	68.4	0	0	0	0	111.9	L32 S92 E93 E137	L32-S90 WeakPolarHBondContact CD2-O 3.47Å; S90-S92 PolarHBondContact O-N 3.09Å; S90-E93 PolarHBondContact O-N 3.42Å; S90-E137 WeakPolarHBondContact CB-OE2 3.44Å
91	S	95.3	Very high	95.1	Very high	11 Å²	11	50.4 Å²	50.4	8%	0.077	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-36.4	175.9	71.2	0	0	0	0	112.1	Q31 E93 C94 L95 E137	Q31-S91 PolarHBondContact OE1-OG 2.78Å; S91-E93 PolarHBondContact O-N 3.22Å; S91-C94 PolarHBondContact O-N 2.65Å; S91-C94 VanDerWaalsContact O-N 3.11Å; S91-L95 WeakPolarHBondContact O-CG 3.4Å; S91-L95 PolarHBondContact O-N 3.45Å; S91-E137 WeakPolarHBondContact CB-OE1 3.44Å; S91-E137 PolarHBondContact N-OE1 3.28Å; S91-E137 PolarHBondContact N-OE2 3.37Å; S91-E137 VanDerWaalsContact N-OE2 3.08Å; S91-E137 PolarHBondContact OG-OE2 3.38Å
92	S	93.3	Very high	95.1	Very high	66 Å²	66	45.6 Å²	45.6	46%	0.462	23%	0.23	S	C	.	.	H	α-helix	trans	-56.7	-48.5	-178.8	-161.4	0	0	0	0	112.1	S90 C94 L95 D96	S90-S92 PolarHBondContact O-N 3.09Å; S92-C94 PolarHBondContact O-N 2.74Å; S92-L95 PolarHBondContact O-N 2.78Å; S92-L95 VanDerWaalsContact O-N 3.09Å; S92-D96 PolarHBondContact O-N 3.02Å
93	E	95.4	Very high	94.9	Very high	75 Å²	75	47 Å²	47	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-58.9	-37.1	178.8	-62.2	178.4	156.6	0	0	112.1	Y88 H89 S90 S91 D97	Y88-E93 VanDerWaalsContact CA-OE2 3.22Å; Y88-E93 WeakPolarHBondContact CA-OE2 3.37Å; Y88-E93 HydrophobicContact CD1-CB 3.69Å; Y88-E93 HydrophobicContact CE1-CB 4.44Å; Y88-E93 HydrophobicContact CG-CB 4.49Å; H89-E93 IonicContact CE1-OE1 2.65Å; H89-E93 IonicContact CG-OE1 2.69Å; H89-E93 IonicContact CG-OE2 2.61Å; H89-E93 PolarHBondContact N-OE2 3.13Å; H89-E93 IonicContact ND1-OE1 2.66Å; H89-E93 PolarHBondContact ND1-OE1 2.68Å; H89-E93 IonicContact ND1-OE2 3.6Å; H89-E93 PolarHBondContact ND1-OE2 2.75Å; H89-E93 VanDerWaalsContact ND1-OE2 3.14Å; S90-E93 PolarHBondContact O-N 3.42Å; S91-E93 PolarHBondContact O-N 3.22Å; E93-D97 PolarHBondContact O-N 3.04Å
94	C	97.5	Very high	94.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-75.7	-32.6	177.9	-172.3	0	0	0	0	112.7	L32 Y88 S91 S92 L98	L32-C94 HydrophobicContact CD2-CB 3.65Å; Y88-C94 HydrophobicContact CD1-CB 4.11Å; Y88-C94 HydrophobicContact CD2-CB 3.7Å; Y88-C94 HydrophobicContact CE1-CB 4.22Å; Y88-C94 HydrophobicContact CE2-CB 3.83Å; Y88-C94 VanDerWaalsContact CE2-SG 3.56Å; Y88-C94 HydrophobicContact CG-CB 3.84Å; S91-C94 PolarHBondContact O-N 2.65Å; S91-C94 VanDerWaalsContact O-N 3.11Å; S92-C94 PolarHBondContact O-N 2.74Å; C94-L98 WeakPolarHBondContact O-CB 3.32Å; C94-L98 PolarHBondContact O-N 3.34Å; C94-L98 VanDerWaalsContact O-N 3.15Å
95	L	97.1	Very high	95	Very high	14 Å²	14	43.6 Å²	43.6	7%	0.073	22%	0.218	C	C	.	.	H	α-helix	trans	-72.3	-36.4	174.6	-68.7	178	0	0	0	111.3	I35 S91 S92 L98 F99 L130 M133	I35-L95 HydrophobicContact CD1-CD2 3.86Å; I35-L95 HydrophobicContact CD1-CG 3.94Å; I35-L95 HydrophobicContact CG1-CD2 4.38Å; S91-L95 WeakPolarHBondContact O-CG 3.4Å; S91-L95 PolarHBondContact O-N 3.45Å; S92-L95 PolarHBondContact O-N 2.78Å; S92-L95 VanDerWaalsContact O-N 3.09Å; L95-L98 HydrophobicContact CD2-CD2 4.25Å; L95-L98 PolarHBondContact O-N 2.85Å; L95-F99 HydrophobicContact CB-CD2 4.31Å; L95-F99 HydrophobicContact CB-CE2 4.31Å; L95-F99 HydrophobicContact CD2-CE2 4.25Å; L95-F99 WeakPolarHBondContact O-CD2 3.38Å; L95-F99 PolarHBondContact O-N 2.84Å; L95-L130 HydrophobicContact CD2-CD1 3.75Å; L95-L130 HydrophobicContact CD2-CD2 3.69Å; L95-L130 HydrophobicContact CD2-CG 4.39Å; L95-M133 HydrophobicContact CD1-CE 4.37Å
96	D	94.4	Very high	95.1	Very high	78 Å²	78	38.9 Å²	38.9	42%	0.417	19%	0.193	S	C	.	.	H	α-helix	trans	-64.1	-43.4	176.1	-91.8	-52.4	0	0	0	112.2	S92 T100 R103	S92-D96 PolarHBondContact O-N 3.02Å; D96-T100 WeakPolarHBondContact O-CB 3.46Å; D96-T100 PolarHBondContact O-N 3.41Å; D96-T100 PolarHBondContact O-OG1 3.38Å; D96-R103 PolarHBondContact O-NH2 3.36Å; D96-R103 IonicContact OD1-NH2 2.8Å; D96-R103 PolarHBondContact OD1-NH2 2.88Å
97	D	97.8	Very high	95	Very high	22 Å²	22	38.3 Å²	38.3	12%	0.118	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-45.7	170	-86.4	-16.1	0	0	0	111.5	M74 I79 R82 Y88 E93 F99 T100 M101	M74-D97 HydrophobicContact CE-CB 4.39Å; M74-D97 VanDerWaalsContact CE-OD1 3.31Å; M74-D97 WeakPolarHBondContact CE-OD1 3.5Å; M74-D97 HydrophobicContact CG-CB 3.93Å; M74-D97 VanDerWaalsContact CG-O 3.31Å; M74-D97 WeakPolarHBondContact CG-O 3.45Å; M74-D97 HydrophobicContact SD-CB 4.05Å; I79-D97 HydrophobicContact CD1-CB 4.19Å; I79-D97 HydrophobicContact CG1-CB 3.92Å; R82-D97 WeakPolarHBondContact CD-OD2 3.28Å; R82-D97 IonicContact CZ-OD2 3.66Å; R82-D97 IonicContact NE-OD2 2.7Å; R82-D97 VanDerWaalsContact NH1-CG 3.3Å; R82-D97 IonicContact NH1-OD1 2.89Å; R82-D97 PolarHBondContact NH1-OD1 3.15Å; R82-D97 IonicContact NH1-OD2 3.81Å; R82-D97 PolarHBondContact NH1-OD2 2.91Å; Y88-D97 WeakPolarHBondContact CE1-OD2 3.26Å; Y88-D97 VanDerWaalsContact CZ-OD2 3.25Å; Y88-D97 PolarHBondContact OH-OD2 2.69Å; E93-D97 PolarHBondContact O-N 3.04Å; D97-F99 PolarHBondContact O-N 2.66Å; D97-T100 PolarHBondContact O-N 3.32Å; D97-M101 PolarHBondContact O-N 2.79Å
98	L	98	Very high	95	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-44.8	-178	-179.4	63.1	0	0	0	112.5	V39 L43 L76 I79 C94 L95 M101 F102 A126	V39-L98 HydrophobicContact CG1-CD2 3.91Å; L43-L98 HydrophobicContact CD1-CD1 3.98Å; L76-L98 HydrophobicContact CD2-CD1 3.73Å; I79-L98 HydrophobicContact CD1-CB 4.23Å; I79-L98 HydrophobicContact CD1-CD1 4.23Å; C94-L98 WeakPolarHBondContact O-CB 3.32Å; C94-L98 PolarHBondContact O-N 3.34Å; C94-L98 VanDerWaalsContact O-N 3.15Å; L95-L98 HydrophobicContact CD2-CD2 4.25Å; L95-L98 PolarHBondContact O-N 2.85Å; L98-M101 HydrophobicContact CD1-CE 4.19Å; L98-M101 WeakPolarHBondContact O-CB 3.37Å; L98-F102 HydrophobicContact CD1-CE2 4.13Å; L98-F102 HydrophobicContact CG-CE2 4.28Å; L98-F102 VanDerWaalsContact O-CD2 3.23Å; L98-F102 WeakPolarHBondContact O-CD2 3.49Å; L98-A126 HydrophobicContact CD2-CB 4.45Å
99	F	96.8	Very high	94.8	Very high	34 Å²	34	37 Å²	37	15%	0.149	19%	0.188	C	C	.	.	H	α-helix	trans	-78.8	-24.5	175.4	-67.2	-63.4	0	0	0	112.4	L95 D97 M101 F102 R103 E123 R127 L130	L95-F99 HydrophobicContact CB-CD2 4.31Å; L95-F99 HydrophobicContact CB-CE2 4.31Å; L95-F99 HydrophobicContact CD2-CE2 4.25Å; L95-F99 WeakPolarHBondContact O-CD2 3.38Å; L95-F99 PolarHBondContact O-N 2.84Å; D97-F99 PolarHBondContact O-N 2.66Å; F99-M101 VanDerWaalsContact C-N 3.34Å; F99-F102 HydrophobicContact CD1-CD2 4.15Å; F99-F102 PolarHBondContact O-N 2.92Å; F99-R103 WeakPolarHBondContact O-CB 3.24Å; F99-R103 WeakPolarHBondContact O-CG 3.34Å; F99-R103 PolarHBondContact O-N 3.19Å; F99-R103 PolarHBondContact O-NE 3.34Å; F99-E123 HydrophobicContact CD1-CG 4.38Å; F99-E123 HydrophobicContact CE1-CG 4.11Å; F99-R127 HydrophobicContact CE1-CG 4.17Å; F99-R127 HydrophobicContact CZ-CG 4.3Å; F99-L130 HydrophobicContact CE2-CD1 4.22Å; F99-L130 HydrophobicContact CZ-CD1 3.86Å
100	T	96.3	Very high	94.6	Very high	27 Å²	27	36.8 Å²	36.8	17%	0.166	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-39.1	169.9	-65.7	0	0	0	0	111.7	H72 M74 D96 D97 F102 R103 N104	H72-T100 HydrophobicContact CB-CG2 4.21Å; M74-T100 HydrophobicContact CB-CG2 4.43Å; D96-T100 WeakPolarHBondContact O-CB 3.46Å; D96-T100 PolarHBondContact O-N 3.41Å; D96-T100 PolarHBondContact O-OG1 3.38Å; D97-T100 PolarHBondContact O-N 3.32Å; T100-F102 PolarHBondContact O-N 3.47Å; T100-R103 PolarHBondContact O-N 3.06Å; T100-R103 PolarHBondContact OG1-NH2 2.91Å; T100-R103 VanDerWaalsContact OG1-NH2 3.11Å; T100-N104 VanDerWaalsContact O-CB 3.29Å; T100-N104 WeakPolarHBondContact O-CB 3.3Å; T100-N104 PolarHBondContact O-N 3.15Å; T100-N104 PolarHBondContact O-ND2 3.01Å; T100-N104 VanDerWaalsContact O-ND2 3.16Å
101	M	97.7	Very high	94.1	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.03	20%	0.195	C	C	.	.	H	α-helix	trans	-56.5	-45.3	172.3	179.9	-170.7	75.7	0	0	112.6	F52 M74 L76 D97 L98 F99 C105	F52-M101 HydrophobicContact CB-CE 4.29Å; F52-M101 HydrophobicContact CB-SD 3.85Å; F52-M101 HydrophobicContact CD1-CE 4.37Å; F52-M101 HydrophobicContact CD1-CG 4.11Å; F52-M101 HydrophobicContact CD1-SD 4.23Å; F52-M101 HydrophobicContact CG-SD 4.46Å; M74-M101 HydrophobicContact CB-CB 4.26Å; M74-M101 HydrophobicContact CG-CB 4.31Å; M74-M101 WeakPolarHBondContact O-CG 3.26Å; L76-M101 HydrophobicContact CD1-CE 4.49Å; L76-M101 HydrophobicContact CD2-CE 3.87Å; L76-M101 HydrophobicContact CD2-SD 3.99Å; L76-M101 HydrophobicContact CG-CE 3.93Å; L76-M101 HydrophobicContact CG-SD 3.66Å; D97-M101 PolarHBondContact O-N 2.79Å; L98-M101 HydrophobicContact CD1-CE 4.19Å; L98-M101 WeakPolarHBondContact O-CB 3.37Å; F99-M101 VanDerWaalsContact C-N 3.34Å; M101-C105 PolarHBondContact O-N 3.26Å
102	F	96.9	Very high	93.4	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-70.2	-47.1	176.5	-62.7	-58.5	0	0	0	112	L98 F99 T100 N104 C105 Y106 A119 L122 E123 A126	L98-F102 HydrophobicContact CD1-CE2 4.13Å; L98-F102 HydrophobicContact CG-CE2 4.28Å; L98-F102 VanDerWaalsContact O-CD2 3.23Å; L98-F102 WeakPolarHBondContact O-CD2 3.49Å; F99-F102 HydrophobicContact CD1-CD2 4.15Å; F99-F102 PolarHBondContact O-N 2.92Å; T100-F102 PolarHBondContact O-N 3.47Å; F102-N104 VanDerWaalsContact C-N 3.31Å; F102-N104 PolarHBondContact O-N 3.02Å; F102-C105 VanDerWaalsContact O-CB 3.3Å; F102-C105 WeakPolarHBondContact O-CB 3.22Å; F102-C105 PolarHBondContact O-N 3.5Å; F102-Y106 HydrophobicContact CB-CE2 3.94Å; F102-Y106 WeakPolarHBondContact O-CD2 3.12Å; F102-Y106 PolarHBondContact O-N 3.36Å; F102-Y106 VanDerWaalsContact O-N 3.1Å; F102-A119 HydrophobicContact CD1-CB 4.12Å; F102-L122 HydrophobicContact CE1-CB 3.7Å; F102-L122 HydrophobicContact CZ-CB 3.96Å; F102-E123 HydrophobicContact CD1-CB 4.05Å; F102-E123 HydrophobicContact CD2-CB 3.92Å; F102-E123 HydrophobicContact CD2-CG 3.8Å; F102-E123 HydrophobicContact CE1-CB 4.07Å; F102-E123 HydrophobicContact CE2-CB 3.94Å; F102-E123 HydrophobicContact CE2-CG 4.06Å; F102-E123 HydrophobicContact CG-CB 3.98Å; F102-E123 HydrophobicContact CG-CG 4.16Å; F102-E123 HydrophobicContact CZ-CB 4.02Å; F102-A126 HydrophobicContact CE2-CB 4.43Å
103	R	93.4	Very high	93.1	Very high	103 Å²	103	41.4 Å²	41.4	39%	0.389	22%	0.223	S	C	.	.	H	α-helix	trans	-52.4	-46.9	174.9	-73.2	178.9	-74.7	-154.6	3.4	111.4	D96 F99 T100 C105 Y106 I107	D96-R103 PolarHBondContact O-NH2 3.36Å; D96-R103 IonicContact OD1-NH2 2.8Å; D96-R103 PolarHBondContact OD1-NH2 2.88Å; F99-R103 WeakPolarHBondContact O-CB 3.24Å; F99-R103 WeakPolarHBondContact O-CG 3.34Å; F99-R103 PolarHBondContact O-N 3.19Å; F99-R103 PolarHBondContact O-NE 3.34Å; T100-R103 PolarHBondContact O-N 3.06Å; T100-R103 PolarHBondContact OG1-NH2 2.91Å; T100-R103 VanDerWaalsContact OG1-NH2 3.11Å; R103-C105 VanDerWaalsContact C-N 3.32Å; R103-C105 PolarHBondContact O-N 2.9Å; R103-Y106 PolarHBondContact O-N 3.17Å; R103-I107 WeakPolarHBondContact O-CB 3.27Å; R103-I107 WeakPolarHBondContact O-CD1 3.31Å; R103-I107 WeakPolarHBondContact O-CG1 3.13Å; R103-I107 PolarHBondContact O-N 3.31Å
104	N	95.6	Very high	93	Very high	12 Å²	12	44.3 Å²	44.3	6%	0.064	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-42.1	176	-72.6	-24.3	0	0	0	112.9	I70 H72 T100 F102 I107 F108	I70-N104 HydrophobicContact CD1-CB 4.05Å; I70-N104 WeakPolarHBondContact CD1-O 3.34Å; I70-N104 HydrophobicContact CG2-CB 4.11Å; I70-N104 WeakPolarHBondContact CG2-OD1 3.39Å; H72-N104 PolarHBondContact O-ND2 3.25Å; T100-N104 VanDerWaalsContact O-CB 3.29Å; T100-N104 WeakPolarHBondContact O-CB 3.3Å; T100-N104 PolarHBondContact O-N 3.15Å; T100-N104 PolarHBondContact O-ND2 3.01Å; T100-N104 VanDerWaalsContact O-ND2 3.16Å; F102-N104 VanDerWaalsContact C-N 3.31Å; F102-N104 PolarHBondContact O-N 3.02Å; N104-I107 PolarHBondContact O-N 2.9Å; N104-F108 PolarHBondContact O-N 3.27Å; N104-F108 VanDerWaalsContact O-N 3.07Å
105	C	95.7	Very high	92.8	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-45.7	178	-174.2	0	0	0	0	111.2	F52 M101 F102 R103 N109 A119	F52-C105 HydrophobicContact CE1-CB 4.02Å; M101-C105 PolarHBondContact O-N 3.26Å; F102-C105 VanDerWaalsContact O-CB 3.3Å; F102-C105 WeakPolarHBondContact O-CB 3.22Å; F102-C105 PolarHBondContact O-N 3.5Å; R103-C105 VanDerWaalsContact C-N 3.32Å; R103-C105 PolarHBondContact O-N 2.9Å; C105-N109 WeakPolarHBondContact O-CB 3.42Å; C105-N109 PolarHBondContact O-N 2.91Å; C105-N109 PolarHBondContact O-ND2 3.36Å; C105-A119 HydrophobicContact CB-CB 4.2Å
106	Y	94.3	Very high	92.6	Very high	10 Å²	10	45.8 Å²	45.8	4%	0.039	25%	0.251	C	S	.	.	H	α-helix	trans	-72.7	-33.3	179.9	-50	-44.1	0	0	0	113.1	F102 R103 V116 A119 M120 E123 K619 L623	F102-Y106 HydrophobicContact CB-CE2 3.94Å; F102-Y106 WeakPolarHBondContact O-CD2 3.12Å; F102-Y106 PolarHBondContact O-N 3.36Å; F102-Y106 VanDerWaalsContact O-N 3.1Å; R103-Y106 PolarHBondContact O-N 3.17Å; Y106-V116 HydrophobicContact CD1-CG1 3.95Å; Y106-V116 HydrophobicContact CD1-CG2 4.47Å; Y106-V116 HydrophobicContact CE1-CG1 4.13Å; Y106-A119 HydrophobicContact CD1-CB 4.42Å; Y106-A119 HydrophobicContact CE1-CB 3.56Å; Y106-M120 HydrophobicContact CE1-CG 3.9Å; Y106-M120 WeakPolarHBondContact OH-CA 3.28Å; Y106-M120 PolarHBondContact OH-N 3.37Å; Y106-E123 VanDerWaalsContact CE2-OE2 3.22Å; Y106-E123 WeakPolarHBondContact CE2-OE2 3.38Å; Y106-E123 PolarHBondContact OH-OE2 2.95Å; Y106-K619 WeakPolarHBondContact O-CE 3.36Å; Y106-K619 PolarHBondContact O-NZ 2.99Å; Y106-L623 VanDerWaalsContact CB-CD1 3.41Å; Y106-L623 HydrophobicContact CD1-CD2 4.47Å; Y106-L623 HydrophobicContact CD2-CD2 4.32Å; Y106-L623 HydrophobicContact CG-CD1 4.41Å; Y106-L623 HydrophobicContact CG-CD2 3.94Å
107	I	89.8	Confident	92.4	Very high	48 Å²	48	45 Å²	45	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-50.1	174.5	-72.4	163.8	0	0	0	110.4	I69 I70 R103 N104 M616 K619	I69-I107 HydrophobicContact CG2-CG2 3.87Å; I70-I107 HydrophobicContact CD1-CB 4Å; I70-I107 HydrophobicContact CD1-CG2 3.72Å; R103-I107 WeakPolarHBondContact O-CB 3.27Å; R103-I107 WeakPolarHBondContact O-CD1 3.31Å; R103-I107 WeakPolarHBondContact O-CG1 3.13Å; R103-I107 PolarHBondContact O-N 3.31Å; N104-I107 PolarHBondContact O-N 2.9Å; I107-M616 HydrophobicContact CG2-CE 3.69Å; I107-K619 PolarHBondContact O-NZ 2.91Å
108	F	91.9	Very high	92.3	Very high	50 Å²	50	45.2 Å²	45.2	22%	0.219	26%	0.255	C	S	.	.	H	α-helix	trans	-78.4	-46.8	-173.7	-171.2	-97.1	0	0	0	113.8	L63 Y66 I69 I70 N104	L63-F108 HydrophobicContact CB-CZ 4.07Å; L63-F108 HydrophobicContact CD1-CE1 3.94Å; L63-F108 HydrophobicContact CD1-CZ 4.28Å; L63-F108 HydrophobicContact CD2-CE1 4.03Å; L63-F108 HydrophobicContact CD2-CZ 4.09Å; L63-F108 HydrophobicContact CG-CE1 4.4Å; L63-F108 HydrophobicContact CG-CZ 4.37Å; Y66-F108 HydrophobicContact CD2-CB 4.39Å; Y66-F108 AromaticContact CD2-CD1 3.92Å; Y66-F108 HydrophobicContact CD2-CD1 3.92Å; Y66-F108 AromaticContact CD2-CD2 3.66Å; Y66-F108 HydrophobicContact CD2-CD2 3.66Å; Y66-F108 HydrophobicContact CD2-CE1 4.09Å; Y66-F108 AromaticContact CD2-CE2 3.85Å; Y66-F108 HydrophobicContact CD2-CE2 3.85Å; Y66-F108 AromaticContact CD2-CG 3.71Å; Y66-F108 HydrophobicContact CD2-CG 3.71Å; Y66-F108 HydrophobicContact CD2-CZ 4.06Å; Y66-F108 HydrophobicContact CE2-CB 4.35Å; Y66-F108 HydrophobicContact CE2-CD1 4.39Å; Y66-F108 HydrophobicContact CE2-CD2 4.4Å; Y66-F108 HydrophobicContact CE2-CG 4.12Å; Y66-F108 HydrophobicContact CG-CD2 4.4Å; Y66-F108 HydrophobicContact CG-CE2 4.3Å; I69-F108 HydrophobicContact CB-CD2 4.42Å; I69-F108 HydrophobicContact CD1-CD2 4.13Å; I69-F108 HydrophobicContact CD1-CE2 4.1Å; I69-F108 HydrophobicContact CG2-CD2 4.43Å; I70-F108 HydrophobicContact CD1-CB 4.21Å; I70-F108 HydrophobicContact CG1-CB 4.26Å; N104-F108 PolarHBondContact O-N 3.27Å; N104-F108 VanDerWaalsContact O-N 3.07Å
109	N	90.5	Very high	92.2	Very high	36 Å²	36	45.2 Å²	45.2	19%	0.193	26%	0.255	C	S	.	.	S	Bend	trans	-87.1	166.1	-173.9	-55.4	-75.1	0	0	0	111.7	C105 D113 V115 V116 K619	C105-N109 WeakPolarHBondContact O-CB 3.42Å; C105-N109 PolarHBondContact O-N 2.91Å; C105-N109 PolarHBondContact O-ND2 3.36Å; N109-D113 HydrophobicContact CB-CB 4.38Å; N109-D113 WeakPolarHBondContact CB-OD2 3.43Å; N109-V115 HydrophobicContact CB-CG1 3.92Å; N109-V115 VanDerWaalsContact CG-CG1 3.44Å; N109-V116 HydrophobicContact CB-CG2 3.67Å; N109-K619 PolarHBondContact O-NZ 3.12Å
110	K	85.4	Confident	92	Very high	134 Å²	134	47.3 Å²	47.3	58%	0.583	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-90.6	148.7	178.5	-68.8	176.5	177.4	-69.5	0	111.3	G112 D113 V116	K110-G112 PolarHBondContact O-N 2.93Å; K110-D113 PolarHBondContact N-OD2 3.34Å; K110-D113 WeakPolarHBondContact O-CB 3.48Å; K110-D113 PolarHBondContact O-N 2.98Å; K110-D113 VanDerWaalsContact O-N 3.08Å; K110-V116 WeakPolarHBondContact O-CG2 3.22Å
111	P	82.2	Confident	91.9	Very high	70 Å²	70	52.1 Å²	52.1	46%	0.455	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	127.3	162.5	-22.8	33.9	0	0	0	109.7
112	G	81	Confident	91.9	Very high	77 Å²	77	51.8 Å²	51.8	79%	0.794	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	100	-14	-175.1	0	0	0	0	0	115.8	K110	K110-G112 PolarHBondContact O-N 2.93Å
113	D	88.4	Confident	91.9	Very high	64 Å²	64	52.1 Å²	52.1	34%	0.342	29%	0.285	S	S	.	.			trans	-68.5	137.9	171	-67.5	-26	0	0	0	110.2	N109 K110 V115 V116 A117	N109-D113 HydrophobicContact CB-CB 4.38Å; N109-D113 WeakPolarHBondContact CB-OD2 3.43Å; K110-D113 PolarHBondContact N-OD2 3.34Å; K110-D113 WeakPolarHBondContact O-CB 3.48Å; K110-D113 PolarHBondContact O-N 2.98Å; K110-D113 VanDerWaalsContact O-N 3.08Å; D113-V115 HydrophobicContact CB-CG1 4.22Å; D113-V115 PolarHBondContact O-N 3.29Å; D113-V115 VanDerWaalsContact O-N 3.08Å; D113-V116 HydrophobicContact CB-CG2 4.39Å; D113-V116 WeakPolarHBondContact O-CA 3.42Å; D113-V116 WeakPolarHBondContact O-CB 2.91Å; D113-V116 PolarHBondContact O-N 3.3Å; D113-A117 PolarHBondContact O-N 2.69Å
114	D	92.5	Very high	91.9	Very high	135 Å²	135	50.1 Å²	50.1	72%	0.722	28%	0.28	S	S	*	.	H	α-helix	trans	-50.4	-40.6	-179	-72	-45.5	0	0	0	112.8	V116 A117 M118	D114-V116 PolarHBondContact O-N 3.13Å; D114-A117 PolarHBondContact O-N 3.1Å; D114-A117 VanDerWaalsContact O-N 3.14Å; D114-M118 HydrophobicContact CB-SD 4.46Å; D114-M118 WeakPolarHBondContact O-CB 3.4Å; D114-M118 WeakPolarHBondContact O-CG 3.26Å; D114-M118 PolarHBondContact O-N 2.95Å
115	V	93.5	Very high	91.9	Very high	34 Å²	34	51 Å²	51	21%	0.206	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-28.2	-180	71.8	0	0	0	0	112.6	P51 F52 N109 D113 A119	P51-V115 HydrophobicContact CB-CG2 4.06Å; P51-V115 HydrophobicContact CG-CG2 4.29Å; F52-V115 HydrophobicContact CE1-CG2 4.49Å; F52-V115 HydrophobicContact CE2-CG2 4.35Å; F52-V115 HydrophobicContact CZ-CG2 3.77Å; N109-V115 HydrophobicContact CB-CG1 3.92Å; N109-V115 VanDerWaalsContact CG-CG1 3.44Å; D113-V115 HydrophobicContact CB-CG1 4.22Å; D113-V115 PolarHBondContact O-N 3.29Å; D113-V115 VanDerWaalsContact O-N 3.08Å; V115-A119 WeakPolarHBondContact O-CB 3.34Å; V115-A119 PolarHBondContact O-N 3.46Å
116	V	92.3	Very high	91.9	Very high	11 Å²	11	50.6 Å²	50.6	7%	0.067	28%	0.282	C	S	.	.	H	α-helix	trans	-73.2	-43.5	173.1	172.5	0	0	0	0	110.7	Y106 N109 K110 D113 D114 M118 A119 M120	Y106-V116 HydrophobicContact CD1-CG1 3.95Å; Y106-V116 HydrophobicContact CD1-CG2 4.47Å; Y106-V116 HydrophobicContact CE1-CG1 4.13Å; N109-V116 HydrophobicContact CB-CG2 3.67Å; K110-V116 WeakPolarHBondContact O-CG2 3.22Å; D113-V116 HydrophobicContact CB-CG2 4.39Å; D113-V116 WeakPolarHBondContact O-CA 3.42Å; D113-V116 WeakPolarHBondContact O-CB 2.91Å; D113-V116 PolarHBondContact O-N 3.3Å; D114-V116 PolarHBondContact O-N 3.13Å; V116-M118 VanDerWaalsContact C-N 3.28Å; V116-M118 PolarHBondContact O-N 2.79Å; V116-A119 WeakPolarHBondContact O-CB 3.49Å; V116-A119 PolarHBondContact O-N 3.22Å; V116-M120 HydrophobicContact CG1-CG 4.48Å; V116-M120 HydrophobicContact CG1-SD 4.16Å; V116-M120 WeakPolarHBondContact O-CG 3.43Å; V116-M120 PolarHBondContact O-N 3.3Å
117	A	90.2	Very high	91.9	Very high	61 Å²	61	54.4 Å²	54.4	50%	0.504	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-37.1	174	0	0	0	0	0	112	D113 D114 K121	D113-A117 PolarHBondContact O-N 2.69Å; D114-A117 PolarHBondContact O-N 3.1Å; D114-A117 VanDerWaalsContact O-N 3.14Å; A117-K121 WeakPolarHBondContact O-CB 3.26Å; A117-K121 PolarHBondContact O-N 2.74Å; A117-K121 VanDerWaalsContact O-N 3.13Å
118	M	95.8	Very high	92.1	Very high	27 Å²	27	55.4 Å²	55.4	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-66.4	-43.6	173.5	-65.8	163.9	67.9	0	0	111.7	I48 W50 P51 F52 D114 V116 K121 L122	I48-M118 HydrophobicContact CB-CB 4.3Å; I48-M118 HydrophobicContact CB-CE 4.02Å; I48-M118 HydrophobicContact CB-CG 4.04Å; I48-M118 HydrophobicContact CG2-CG 4.19Å; I48-M118 WeakPolarHBondContact O-CE 3.22Å; W50-M118 HydrophobicContact CZ2-CE 4.4Å; P51-M118 HydrophobicContact CG-CE 3.44Å; P51-M118 VanDerWaalsContact CG-CE 3.44Å; P51-M118 HydrophobicContact CG-SD 4.47Å; F52-M118 HydrophobicContact CE2-CB 4.16Å; D114-M118 HydrophobicContact CB-SD 4.46Å; D114-M118 WeakPolarHBondContact O-CB 3.4Å; D114-M118 WeakPolarHBondContact O-CG 3.26Å; D114-M118 PolarHBondContact O-N 2.95Å; V116-M118 VanDerWaalsContact C-N 3.28Å; V116-M118 PolarHBondContact O-N 2.79Å; M118-K121 PolarHBondContact O-N 3.18Å; M118-L122 WeakPolarHBondContact O-CB 3.4Å; M118-L122 WeakPolarHBondContact O-CD1 3.35Å; M118-L122 VanDerWaalsContact O-CG 3.27Å; M118-L122 WeakPolarHBondContact O-CG 3.48Å; M118-L122 PolarHBondContact O-N 2.8Å
119	A	95.8	Very high	92.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-51.9	173.9	0	0	0	0	0	111.8	F52 F102 C105 Y106 V115 V116 K121 L122 E123	F52-A119 HydrophobicContact CE1-CB 4.12Å; F52-A119 HydrophobicContact CZ-CB 3.72Å; F102-A119 HydrophobicContact CD1-CB 4.12Å; C105-A119 HydrophobicContact CB-CB 4.2Å; Y106-A119 HydrophobicContact CD1-CB 4.42Å; Y106-A119 HydrophobicContact CE1-CB 3.56Å; V115-A119 WeakPolarHBondContact O-CB 3.34Å; V115-A119 PolarHBondContact O-N 3.46Å; V116-A119 WeakPolarHBondContact O-CB 3.49Å; V116-A119 PolarHBondContact O-N 3.22Å; A119-K121 VanDerWaalsContact C-N 3.3Å; A119-K121 PolarHBondContact O-N 3.46Å; A119-L122 PolarHBondContact O-N 3.5Å; A119-L122 VanDerWaalsContact O-N 3.16Å; A119-E123 WeakPolarHBondContact O-CB 3.49Å; A119-E123 PolarHBondContact O-N 3.02Å
120	M	92	Very high	92.6	Very high	78 Å²	78	56.4 Å²	56.4	38%	0.384	30%	0.301	S	S	.	.	H	α-helix	trans	-56.6	-43.1	179.5	-70.1	172.8	75.8	0	0	112.1	Y106 V116 E123 Q124 I630	Y106-M120 HydrophobicContact CE1-CG 3.9Å; Y106-M120 WeakPolarHBondContact OH-CA 3.28Å; Y106-M120 PolarHBondContact OH-N 3.37Å; V116-M120 HydrophobicContact CG1-CG 4.48Å; V116-M120 HydrophobicContact CG1-SD 4.16Å; V116-M120 WeakPolarHBondContact O-CG 3.43Å; V116-M120 PolarHBondContact O-N 3.3Å; M120-E123 PolarHBondContact O-N 2.96Å; M120-Q124 PolarHBondContact O-N 2.98Å; M120-I630 HydrophobicContact CE-CD1 3.84Å
121	K	94.9	Very high	93	Very high	128 Å²	128	54.2 Å²	54.2	56%	0.557	29%	0.291	S	S	*	.	H	α-helix	trans	-69.9	-37.5	178.9	-177	164.3	174	171.2	0	112.9	I48 A117 M118 A119 I125	I48-K121 HydrophobicContact CD1-CB 3.76Å; I48-K121 HydrophobicContact CD1-CD 3.86Å; I48-K121 HydrophobicContact CD1-CG 3.73Å; A117-K121 WeakPolarHBondContact O-CB 3.26Å; A117-K121 PolarHBondContact O-N 2.74Å; A117-K121 VanDerWaalsContact O-N 3.13Å; M118-K121 PolarHBondContact O-N 3.18Å; A119-K121 VanDerWaalsContact C-N 3.3Å; A119-K121 PolarHBondContact O-N 3.46Å; K121-I125 HydrophobicContact CG-CD1 4.29Å; K121-I125 WeakPolarHBondContact O-CD1 3.26Å; K121-I125 VanDerWaalsContact O-CG1 3.26Å; K121-I125 WeakPolarHBondContact O-CG1 3.47Å; K121-I125 PolarHBondContact O-N 2.81Å; K121-I125 VanDerWaalsContact O-N 3.16Å
122	L	97.9	Very high	93.5	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-68.4	-39.2	173.2	-73	164.8	0	0	0	111.6	L43 E46 I48 V49 F52 F102 M118 A119 I125 A126	L43-L122 HydrophobicContact CD2-CB 4.24Å; L43-L122 HydrophobicContact CD2-CD2 3.96Å; L43-L122 VanDerWaalsContact CD2-O 3.22Å; L43-L122 WeakPolarHBondContact CD2-O 3.49Å; E46-L122 HydrophobicContact CB-CD2 3.84Å; E46-L122 HydrophobicContact CG-CD2 4.12Å; I48-L122 HydrophobicContact CD1-CD2 4.29Å; I48-L122 HydrophobicContact CD1-CG 3.88Å; I48-L122 HydrophobicContact CG1-CD1 4.42Å; I48-L122 HydrophobicContact CG1-CD2 4.05Å; I48-L122 HydrophobicContact CG1-CG 4.03Å; V49-L122 HydrophobicContact CB-CD2 4.22Å; V49-L122 HydrophobicContact CG2-CD2 4.31Å; F52-L122 HydrophobicContact CD2-CD1 3.33Å; F52-L122 HydrophobicContact CE2-CD1 3.61Å; F52-L122 HydrophobicContact CG-CD1 4.19Å; F102-L122 HydrophobicContact CE1-CB 3.7Å; F102-L122 HydrophobicContact CZ-CB 3.96Å; M118-L122 WeakPolarHBondContact O-CB 3.4Å; M118-L122 WeakPolarHBondContact O-CD1 3.35Å; M118-L122 VanDerWaalsContact O-CG 3.27Å; M118-L122 WeakPolarHBondContact O-CG 3.48Å; M118-L122 PolarHBondContact O-N 2.8Å; A119-L122 PolarHBondContact O-N 3.5Å; A119-L122 VanDerWaalsContact O-N 3.16Å; L122-I125 PolarHBondContact O-N 3.24Å; L122-A126 PolarHBondContact O-N 3.1Å
123	E	96.7	Very high	94.2	Very high	7 Å²	7	55 Å²	55	3%	0.033	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-41.7	177.1	-170.8	177	171	0	0	111.4	F99 F102 Y106 A119 M120 I125 A126 R127 L627	F99-E123 HydrophobicContact CD1-CG 4.38Å; F99-E123 HydrophobicContact CE1-CG 4.11Å; F102-E123 HydrophobicContact CD1-CB 4.05Å; F102-E123 HydrophobicContact CD2-CB 3.92Å; F102-E123 HydrophobicContact CD2-CG 3.8Å; F102-E123 HydrophobicContact CE1-CB 4.07Å; F102-E123 HydrophobicContact CE2-CB 3.94Å; F102-E123 HydrophobicContact CE2-CG 4.06Å; F102-E123 HydrophobicContact CG-CB 3.98Å; F102-E123 HydrophobicContact CG-CG 4.16Å; F102-E123 HydrophobicContact CZ-CB 4.02Å; Y106-E123 VanDerWaalsContact CE2-OE2 3.22Å; Y106-E123 WeakPolarHBondContact CE2-OE2 3.38Å; Y106-E123 PolarHBondContact OH-OE2 2.95Å; A119-E123 WeakPolarHBondContact O-CB 3.49Å; A119-E123 PolarHBondContact O-N 3.02Å; M120-E123 PolarHBondContact O-N 2.96Å; E123-I125 VanDerWaalsContact C-N 3.33Å; E123-I125 PolarHBondContact O-N 2.84Å; E123-A126 WeakPolarHBondContact O-CB 3.4Å; E123-A126 PolarHBondContact O-N 3.14Å; E123-A126 VanDerWaalsContact O-N 3.17Å; E123-R127 HydrophobicContact CG-CG 4.45Å; E123-R127 WeakPolarHBondContact O-CB 3.25Å; E123-R127 WeakPolarHBondContact O-CG 3.47Å; E123-R127 PolarHBondContact O-N 3.37Å; E123-R127 IonicContact OE1-CZ 2.72Å; E123-R127 IonicContact OE1-NE 2.98Å; E123-R127 PolarHBondContact OE1-NE 2.53Å; E123-R127 IonicContact OE1-NH2 3.27Å; E123-R127 PolarHBondContact OE1-NH2 2.84Å; E123-L627 WeakPolarHBondContact OE1-CD2 3.28Å
124	Q	93.7	Very high	94.4	Very high	62 Å²	62	54.7 Å²	54.7	29%	0.29	27%	0.268	S	S	.	.	H	α-helix	trans	-57.6	-47.5	171.2	-170.7	64.1	22.9	0	0	110.7	M120 A126 R127 E128	M120-Q124 PolarHBondContact O-N 2.98Å; Q124-A126 VanDerWaalsContact C-N 3.26Å; Q124-A126 PolarHBondContact O-N 3.44Å; Q124-R127 PolarHBondContact O-N 3.04Å; Q124-E128 HydrophobicContact CG-CG 4.27Å; Q124-E128 PolarHBondContact NE2-OE1 3.26Å; Q124-E128 WeakPolarHBondContact O-CB 3.45Å; Q124-E128 VanDerWaalsContact O-CG 3.28Å; Q124-E128 WeakPolarHBondContact O-CG 3.46Å; Q124-E128 PolarHBondContact O-N 3.22Å
125	I	95.3	Very high	94.3	Very high	31 Å²	31	53.5 Å²	53.5	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-34.3	178.6	-68	165	0	0	0	111.7	R42 L43 E46 K121 L122 E123 R129	R42-I125 HydrophobicContact CG-CG2 3.91Å; L43-I125 HydrophobicContact CD2-CB 4.21Å; L43-I125 HydrophobicContact CD2-CG2 3.99Å; E46-I125 HydrophobicContact CG-CD1 3.84Å; K121-I125 HydrophobicContact CG-CD1 4.29Å; K121-I125 WeakPolarHBondContact O-CD1 3.26Å; K121-I125 VanDerWaalsContact O-CG1 3.26Å; K121-I125 WeakPolarHBondContact O-CG1 3.47Å; K121-I125 PolarHBondContact O-N 2.81Å; K121-I125 VanDerWaalsContact O-N 3.16Å; L122-I125 PolarHBondContact O-N 3.24Å; E123-I125 VanDerWaalsContact C-N 3.33Å; E123-I125 PolarHBondContact O-N 2.84Å; I125-R129 VanDerWaalsContact O-CG 3.26Å; I125-R129 WeakPolarHBondContact O-CG 3.15Å; I125-R129 PolarHBondContact O-N 2.82Å
126	A	96.9	Very high	94.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-50	172.9	0	0	0	0	0	111.7	V39 L43 L98 F102 L122 E123 Q124 E128 R129 L130	V39-A126 HydrophobicContact CG1-CB 4.05Å; L43-A126 HydrophobicContact CD1-CB 4.22Å; L43-A126 HydrophobicContact CD2-CB 4.32Å; L98-A126 HydrophobicContact CD2-CB 4.45Å; F102-A126 HydrophobicContact CE2-CB 4.43Å; L122-A126 PolarHBondContact O-N 3.1Å; E123-A126 WeakPolarHBondContact O-CB 3.4Å; E123-A126 PolarHBondContact O-N 3.14Å; E123-A126 VanDerWaalsContact O-N 3.17Å; Q124-A126 VanDerWaalsContact C-N 3.26Å; Q124-A126 PolarHBondContact O-N 3.44Å; A126-E128 PolarHBondContact O-N 2.76Å; A126-R129 PolarHBondContact O-N 3.07Å; A126-R129 VanDerWaalsContact O-N 3.11Å; A126-L130 WeakPolarHBondContact O-CG 3.15Å; A126-L130 PolarHBondContact O-N 3.05Å
127	R	93.4	Very high	94.3	Very high	90 Å²	90	59 Å²	59	34%	0.34	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-42.1	178.7	-70.3	174.7	180	-82.8	-0.9	111.8	F99 E123 Q124 R129 L130 K131	F99-R127 HydrophobicContact CE1-CG 4.17Å; F99-R127 HydrophobicContact CZ-CG 4.3Å; E123-R127 HydrophobicContact CG-CG 4.45Å; E123-R127 WeakPolarHBondContact O-CB 3.25Å; E123-R127 WeakPolarHBondContact O-CG 3.47Å; E123-R127 PolarHBondContact O-N 3.37Å; E123-R127 IonicContact OE1-CZ 2.72Å; E123-R127 IonicContact OE1-NE 2.98Å; E123-R127 PolarHBondContact OE1-NE 2.53Å; E123-R127 IonicContact OE1-NH2 3.27Å; E123-R127 PolarHBondContact OE1-NH2 2.84Å; Q124-R127 PolarHBondContact O-N 3.04Å; R127-R129 VanDerWaalsContact C-N 3.3Å; R127-R129 PolarHBondContact O-N 3.43Å; R127-L130 PolarHBondContact O-N 3.06Å; R127-K131 WeakPolarHBondContact O-CG 3.36Å; R127-K131 PolarHBondContact O-N 3.28Å
128	E	94.3	Very high	94.4	Very high	68 Å²	68	59.4 Å²	59.4	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-57	-38.7	172.4	-74.5	-55.3	133.8	0	0	113.2	Q124 A126 K131 F132	Q124-E128 HydrophobicContact CG-CG 4.27Å; Q124-E128 PolarHBondContact NE2-OE1 3.26Å; Q124-E128 WeakPolarHBondContact O-CB 3.45Å; Q124-E128 VanDerWaalsContact O-CG 3.28Å; Q124-E128 WeakPolarHBondContact O-CG 3.46Å; Q124-E128 PolarHBondContact O-N 3.22Å; A126-E128 PolarHBondContact O-N 2.76Å; E128-K131 WeakPolarHBondContact OE1-CE 3.41Å; E128-K131 IonicContact OE1-NZ 3.54Å; E128-K131 PolarHBondContact OE1-NZ 3.45Å; E128-K131 VanDerWaalsContact OE2-CE 3.28Å; E128-K131 WeakPolarHBondContact OE2-CE 3.26Å; E128-K131 IonicContact OE2-NZ 2.88Å; E128-K131 PolarHBondContact OE2-NZ 2.9Å; E128-F132 WeakPolarHBondContact O-CD2 3.37Å; E128-F132 WeakPolarHBondContact O-CE2 3.47Å
129	R	96.4	Very high	94.1	Very high	87 Å²	87	64.8 Å²	64.8	33%	0.328	32%	0.318	S	S	.	.	H	α-helix	trans	-73.8	-40.8	177.4	-67.8	-74.3	149.9	179	-13	111.7	Y34 E38 V39 R42 I125 A126 R127 K131 F132	Y34-R129 PolarHBondContact OH-O 3.5Å; E38-R129 WeakPolarHBondContact O-CD 3.45Å; E38-R129 WeakPolarHBondContact O-CG 3.24Å; V39-R129 HydrophobicContact CG2-CB 3.87Å; R42-R129 HydrophobicContact CG-CG 4.48Å; I125-R129 VanDerWaalsContact O-CG 3.26Å; I125-R129 WeakPolarHBondContact O-CG 3.15Å; I125-R129 PolarHBondContact O-N 2.82Å; A126-R129 PolarHBondContact O-N 3.07Å; A126-R129 VanDerWaalsContact O-N 3.11Å; R127-R129 VanDerWaalsContact C-N 3.3Å; R127-R129 PolarHBondContact O-N 3.43Å; R129-K131 PolarHBondContact O-N 3.4Å; R129-K131 VanDerWaalsContact O-N 3.17Å; R129-F132 PolarHBondContact O-N 3.02Å; R129-F132 VanDerWaalsContact O-N 3.08Å
130	L	96	Very high	93.7	Very high	21 Å²	21	68.3 Å²	68.3	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-22.5	-177.5	-69.8	166.9	0	0	0	113.9	I35 V39 L95 F99 A126 R127 F132 M133	I35-L130 HydrophobicContact CG1-CD2 4.16Å; V39-L130 HydrophobicContact CG2-CD2 3.8Å; V39-L130 HydrophobicContact CG2-CG 4.13Å; L95-L130 HydrophobicContact CD2-CD1 3.75Å; L95-L130 HydrophobicContact CD2-CD2 3.69Å; L95-L130 HydrophobicContact CD2-CG 4.39Å; F99-L130 HydrophobicContact CE2-CD1 4.22Å; F99-L130 HydrophobicContact CZ-CD1 3.86Å; A126-L130 WeakPolarHBondContact O-CG 3.15Å; A126-L130 PolarHBondContact O-N 3.05Å; R127-L130 PolarHBondContact O-N 3.06Å; L130-F132 PolarHBondContact O-N 3.31Å; L130-F132 VanDerWaalsContact O-N 3.14Å; L130-M133 HydrophobicContact CD2-CE 4.39Å; L130-M133 HydrophobicContact CD2-SD 3.86Å; L130-M133 VanDerWaalsContact O-CB 3.26Å; L130-M133 WeakPolarHBondContact O-CB 3.44Å; L130-M133 PolarHBondContact O-N 2.9Å; L130-M133 VanDerWaalsContact O-N 3.1Å
131	K	93.2	Very high	92.6	Very high	87 Å²	87	69.6 Å²	69.6	38%	0.378	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.2	170.4	-58.3	178.7	-177.3	-178.6	0	114	R127 E128 R129 L633	R127-K131 WeakPolarHBondContact O-CG 3.36Å; R127-K131 PolarHBondContact O-N 3.28Å; E128-K131 WeakPolarHBondContact OE1-CE 3.41Å; E128-K131 IonicContact OE1-NZ 3.54Å; E128-K131 PolarHBondContact OE1-NZ 3.45Å; E128-K131 VanDerWaalsContact OE2-CE 3.28Å; E128-K131 WeakPolarHBondContact OE2-CE 3.26Å; E128-K131 IonicContact OE2-NZ 2.88Å; E128-K131 PolarHBondContact OE2-NZ 2.9Å; R129-K131 PolarHBondContact O-N 3.4Å; R129-K131 VanDerWaalsContact O-N 3.17Å; K131-L633 HydrophobicContact CD-CD1 4.48Å; K131-L633 HydrophobicContact CD-CD2 3.54Å; K131-L633 HydrophobicContact CG-CD2 3.89Å
132	F	93.8	Very high	90.9	Very high	149 Å²	149	68 Å²	68	65%	0.654	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	17.4	-175.6	-51.5	-87.1	0	0	0	112.1	Y34 E128 R129 L130	Y34-F132 WeakPolarHBondContact CE2-O 3.46Å; E128-F132 WeakPolarHBondContact O-CD2 3.37Å; E128-F132 WeakPolarHBondContact O-CE2 3.47Å; R129-F132 PolarHBondContact O-N 3.02Å; R129-F132 VanDerWaalsContact O-N 3.08Å; L130-F132 PolarHBondContact O-N 3.31Å; L130-F132 VanDerWaalsContact O-N 3.14Å
133	M	94.7	Very high	88.5	Confident	16 Å²	16	76.5 Å²	76.5	8%	0.079	39%	0.394	C	S	.	.			trans	-72.5	127.1	176.2	-174.3	166.9	72	0	0	110.3	Q31 Y34 I35 L95 L130	Q31-M133 HydrophobicContact CB-CG 4.15Å; Q31-M133 HydrophobicContact CB-SD 3.87Å; Q31-M133 HydrophobicContact CG-CE 4.36Å; Q31-M133 HydrophobicContact CG-CG 3.81Å; Q31-M133 HydrophobicContact CG-SD 4.01Å; Y34-M133 HydrophobicContact CD1-CB 3.81Å; Y34-M133 HydrophobicContact CD1-CG 3.74Å; Y34-M133 HydrophobicContact CD1-SD 4.4Å; Y34-M133 HydrophobicContact CE1-CB 3.9Å; Y34-M133 HydrophobicContact CE1-CG 4.35Å; Y34-M133 HydrophobicContact CG-CG 4.22Å; I35-M133 HydrophobicContact CD1-SD 3.9Å; I35-M133 HydrophobicContact CG1-SD 3.86Å; L95-M133 HydrophobicContact CD1-CE 4.37Å; L130-M133 HydrophobicContact CD2-CE 4.39Å; L130-M133 HydrophobicContact CD2-SD 3.86Å; L130-M133 VanDerWaalsContact O-CB 3.26Å; L130-M133 WeakPolarHBondContact O-CB 3.44Å; L130-M133 PolarHBondContact O-N 2.9Å; L130-M133 VanDerWaalsContact O-N 3.1Å
134	P	93	Very high	86	Confident	57 Å²	57	85.6 Å²	85.6	37%	0.37	43%	0.434	S	S	.	.			trans	-61.5	137.8	-177.7	-25.4	34.6	0	0	0	113.4	Q31 Y34	Q31-P134 VanDerWaalsContact CG-O 3.22Å; Q31-P134 WeakPolarHBondContact CG-O 3.41Å; Q31-P134 PolarHBondContact NE2-O 3.05Å; Y34-P134 HydrophobicContact CD2-CG 4.3Å
135	T	90	Very high	83.3	Confident	110 Å²	110	88.4 Å²	88.4	68%	0.675	46%	0.455	S	S	*	.	S	Bend	trans	-122.1	150.4	173.2	52.2	0	0	0	0	110.6
136	P	92.3	Very high	80.6	Confident	97 Å²	97	92.8 Å²	92.8	63%	0.63	49%	0.485	S	S	*	.	S	Bend	cis	-69.2	173.3	-9.4	32.3	-36.6	0	0	0	112.5	N30 T138	N30-P136 PolarHBondContact ND2-O 3.37Å; P136-T138 HydrophobicContact CG-CG2 4.21Å
137	E	94.3	Very high	78	Confident	63 Å²	63	102.1 Å²	102.1	29%	0.294	53%	0.526	S	S	.	.			trans	-69.9	132.4	167.8	-171.6	159.7	-148.1	0	0	110	T29 N30 Q31 S90 S91	T29-E137 WeakPolarHBondContact CB-OE1 3.44Å; T29-E137 HydrophobicContact CG2-CG 3.78Å; T29-E137 WeakPolarHBondContact CG2-OE1 3.31Å; T29-E137 PolarHBondContact OG1-OE1 2.97Å; N30-E137 WeakPolarHBondContact OD1-CA 3.25Å; Q31-E137 HydrophobicContact CB-CG 4.21Å; Q31-E137 HydrophobicContact CG-CB 4.15Å; Q31-E137 HydrophobicContact CG-CG 4.16Å; S90-E137 WeakPolarHBondContact CB-OE2 3.44Å; S91-E137 WeakPolarHBondContact CB-OE1 3.44Å; S91-E137 PolarHBondContact N-OE1 3.28Å; S91-E137 PolarHBondContact N-OE2 3.37Å; S91-E137 VanDerWaalsContact N-OE2 3.08Å; S91-E137 PolarHBondContact OG-OE2 3.38Å
138	T	91.7	Very high	75.3	Confident	69 Å²	69	103.1 Å²	103.1	42%	0.423	55%	0.547	S	S	.	.			trans	-142.2	143	-177.4	52.7	0	0	0	0	111.3	T29 N30 P136	T29-T138 CarbonylContact C-O 3.53Å; T29-T138 WeakPolarHBondContact CA-O 3.33Å; T29-T138 VanDerWaalsContact CB-O 3.32Å; T29-T138 WeakPolarHBondContact CB-O 3.43Å; N30-T138 VanDerWaalsContact CG-OG1 3.25Å; N30-T138 PolarHBondContact N-O 3.34Å; N30-T138 PolarHBondContact ND2-OG1 3.07Å; N30-T138 VanDerWaalsContact ND2-OG1 3.15Å; N30-T138 PolarHBondContact OD1-N 3.02Å; N30-T138 PolarHBondContact OD1-O 3.48Å; P136-T138 HydrophobicContact CG-CG2 4.21Å
139	E	91	Very high	72.9	Confident	140 Å²	140	107.4 Å²	107.4	65%	0.654	57%	0.57	S	S	*	*	B	Isolated β-bridge	trans	-69.8	135.3	176.6	-60.8	-170.4	-175.8	0	0	112.1	I27	I27-E139 HydrophobicContact CG2-CB 4.05Å; I27-E139 VanDerWaalsContact CG2-CD 3.5Å; I27-E139 HydrophobicContact CG2-CG 3.61Å
140	I	87.3	Confident	70.3	Confident	75 Å²	75	113 Å²	113	39%	0.385	59%	0.591	S	S	.	*			trans	-109	109.7	173.5	-62.1	-177.2	0	0	0	109.8	T28 N30	T28-I140 PolarHBondContact O-N 3.4Å; N30-I140 HydrophobicContact CB-CD1 3.88Å; N30-I140 HydrophobicContact CB-CG1 4.35Å
141	C	67.8	Low	68	Low	105 Å²	105	118.2 Å²	118.2	71%	0.709	63%	0.626	S	S	*	*			trans	-70.8	127.8	163.2	-174.8	0	0	0	0	109.6	Q143	C141-Q143 PolarHBondContact O-N 2.89Å
142	P	60.3	Low	65.6	Low	95 Å²	95	121.7 Å²	121.7	62%	0.617	65%	0.648	S	S	*	*			trans	-71.4	91.4	-177.9	29	-35.1	0	0	0	111.3	K144	P142-K144 PolarHBondContact O-N 3.25Å; P142-K144 VanDerWaalsContact O-N 3.14Å
143	Q	47.7	Very low	63.1	Low	177 Å²	177	118.1 Å²	118.1	83%	0.827	65%	0.653	S	S	*	*			trans	-61.5	115.6	175.1	-68.3	-163.1	4	0	0	110.7	C141 T145	C141-Q143 PolarHBondContact O-N 2.89Å; Q143-T145 PolarHBondContact O-N 3.18Å
144	K	42.7	Very low	60.7	Low	199 Å²	199	121.9 Å²	121.9	87%	0.865	69%	0.686	S	S	*	*			trans	-71.9	95.8	168.7	-67.5	175.2	-178.8	172	0	108.3	P142 P146	P142-K144 PolarHBondContact O-N 3.25Å; P142-K144 VanDerWaalsContact O-N 3.14Å; K144-P146 VanDerWaalsContact O-CD 3.23Å; K144-P146 WeakPolarHBondContact O-CD 3.27Å
145	T	37	Very low	58.3	Low	120 Å²	120	124.3 Å²	124.3	74%	0.736	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-59.3	118.9	173.1	43.8	0	0	0	0	110	Q143 K147	Q143-T145 PolarHBondContact O-N 3.18Å; T145-K147 PolarHBondContact O-N 3.48Å
146	P	39.6	Very low	56	Low	123 Å²	123	126.2 Å²	126.2	80%	0.799	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-64.2	130.9	171.6	-18.7	33	0	0	0	108.6	K144 S148	K144-P146 VanDerWaalsContact O-CD 3.23Å; K144-P146 WeakPolarHBondContact O-CD 3.27Å; P146-S148 PolarHBondContact O-N 3.48Å
147	K	42.4	Very low	53.7	Low	197 Å²	197	130.8 Å²	130.8	86%	0.857	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-65.2	137.5	175.1	-69.6	-176.3	177.5	-177.3	0	109.3	T145 I149	T145-K147 PolarHBondContact O-N 3.48Å; K147-I149 PolarHBondContact O-N 3.22Å
148	S	35.8	Very low	51.2	Low	110 Å²	110	132.9 Å²	132.9	77%	0.769	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-48.3	125.3	-179.4	-179.1	0	0	0	0	112.4	P146	P146-S148 PolarHBondContact O-N 3.48Å
149	I	43.8	Very low	49.3	Very low	158 Å²	158	137.9 Å²	137.9	81%	0.81	76%	0.755	S	S	*	*			trans	-121	127.4	161	-62.2	178.7	0	0	0	105.7	K147	K147-I149 PolarHBondContact O-N 3.22Å
150	R	41.2	Very low	47.2	Very low	205 Å²	205	136.5 Å²	136.5	77%	0.774	76%	0.758	S	S	*	*			trans	-83.8	138.6	179	-56.1	179.7	-174.2	-164.4	1.1	109.5
151	P	49.6	Very low	44.9	Very low	131 Å²	131	138.6 Å²	138.6	85%	0.851	78%	0.777	S	S	*	*			trans	-62	143.4	158.3	-17.3	31.6	0	0	0	109.9
152	I	42.4	Very low	44.2	Very low	160 Å²	160	141.8 Å²	141.8	82%	0.821	79%	0.785	S	S	*	*			trans	-132.8	128.4	177.4	-66.9	178.7	0	0	0	108.7
153	G	41	Very low	43.6	Very low	74 Å²	74	145.9 Å²	145.9	76%	0.763	80%	0.796	S	S	*	*			trans	81	152.3	175.4	0	0	0	0	0	114.4
154	A	43.9	Very low	43.6	Very low	95 Å²	95	142.9 Å²	142.9	79%	0.785	79%	0.792	S	S	*	*			cis	-158.6	-177.7	-5.3	0	0	0	0	0	109.3
155	P	41.5	Very low	43.6	Very low	108 Å²	108	140.5 Å²	140.5	70%	0.701	79%	0.787	S	S	*	*				-136.1	-175	-77.9	42.7	-27.1	0	0	0	114.5
156	L	43	Very low	44.1	Very low	149 Å²	149	142.5 Å²	142.5	78%	0.78	79%	0.788	S	S	*	*			trans	68.3	104.1	160.5	-60.1	173.7	0	0	0	119.6
157	Q	44.1	Very low	44.1	Very low	194 Å²	194	142.7 Å²	142.7	91%	0.907	79%	0.787	S	S	*	*				164	143.7	120.5	-89.5	178	17.5	0	0	109.5
158	V	42.3	Very low	44.1	Very low	106 Å²	106	137.7 Å²	137.7	64%	0.642	78%	0.782	S	S	*	*			cis	177.1	138.6	-49.8	145.2	0	0	0	0	106.1
159	H	49.9	Very low	44.3	Very low	175 Å²	175	136.6 Å²	136.6	81%	0.81	78%	0.78	S	S	*	*			trans	79.9	151.6	169.3	-79.2	-38.8	0	0	0	119.5
160	P	46.8	Very low	44.1	Very low	111 Å²	111	134.1 Å²	134.1	72%	0.721	78%	0.777	S	S	*	*				-134.2	-165.8	-111.9	48.8	-31.3	0	0	0	114.3
161	P	40.8	Very low	44.1	Very low	118 Å²	118	130 Å²	130	77%	0.766	77%	0.774	S	S	*	*			trans	-100.1	175.6	-159.2	41.1	-37.6	0	0	0	116.1
162	I	52.4	Low	43.6	Very low	173 Å²	173	129.7 Å²	129.7	89%	0.887	77%	0.766	S	S	*	*			trans	-131	143	165.2	-63	-179.2	0	0	0	108.9
163	E	46.9	Very low	43.5	Very low	181 Å²	181	129.5 Å²	129.5	85%	0.846	76%	0.761	S	S	*	*			trans	-100.3	171.5	-174.4	-101.4	-166.5	171.7	0	0	114
164	P	47.4	Very low	43.6	Very low	114 Å²	114	131 Å²	131	74%	0.74	76%	0.755	S	S	*	*			trans	-96.7	173.6	-156.8	38.8	-38.9	0	0	0	116
165	I	44.3	Very low	43.4	Very low	149 Å²	149	135.3 Å²	135.3	76%	0.764	76%	0.759	S	S	*	*			trans	-129.1	126.3	173.5	-79.9	179.4	0	0	0	110.3
166	H	47.1	Very low	43.3	Very low	161 Å²	161	134 Å²	134	75%	0.745	77%	0.765	S	S	*	*			trans	19.5	147.2	140.5	-48.2	-79	0	0	0	120.2
167	T	40.3	Very low	43.4	Very low	128 Å²	128	134.3 Å²	134.3	79%	0.785	77%	0.767	S	S	*	*			cis	-164.4	169.9	21.8	-16.8	0	0	0	0	113.3
168	A	40.9	Very low	43.2	Very low	91 Å²	91	132.7 Å²	132.7	75%	0.752	76%	0.764	S	S	*	*			trans	4	152.1	141.7	0	0	0	0	0	121.1
169	A	39.9	Very low	43.2	Very low	87 Å²	87	130.9 Å²	130.9	72%	0.719	77%	0.767	S	S	*	*			cis	-168.6	-175.3	-3.2	0	0	0	0	0	111.6
170	S	39.8	Very low	42.8	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	77%	0.77	S	S	*	*			trans	17.8	145.2	144.2	-53.3	0	0	0	0	120.9
171	T	42	Very low	42.5	Very low	118 Å²	118	127.7 Å²	127.7	72%	0.724	77%	0.773	S	S	*	*			cis	-163	168.8	20.9	-11.9	0	0	0	0	112.7
172	N	37.9	Very low	42.4	Very low	125 Å²	125	128.4 Å²	128.4	67%	0.668	78%	0.775	S	S	*	*			trans	-11.7	146.8	154.5	-47.3	-9	0	0	0	117.4
173	H	42.3	Very low	41.9	Very low	156 Å²	156	125.3 Å²	125.3	72%	0.722	77%	0.768	S	S	*	*				-171	163.8	67.6	-99.9	-83.3	0	0	0	113.2
174	T	41.7	Very low	41.7	Very low	105 Å²	105	122.8 Å²	122.8	64%	0.644	77%	0.765	S	S	*	*			trans	25	147.5	146.5	60.6	0	0	0	0	121.2
175	E	41.1	Very low	41.6	Very low	185 Å²	185	123.1 Å²	123.1	86%	0.864	76%	0.761	S	S	*	*			cis	-170.4	-176.9	-1.8	-110.2	170	177.4	0	0	106
176	G	39.6	Very low	41.6	Very low	80 Å²	80	123.2 Å²	123.2	83%	0.825	76%	0.758	S	S	*	*			trans	122.8	96.9	159.5	0	0	0	0	0	117.5
177	L	44.9	Very low	41.5	Very low	157 Å²	157	120.5 Å²	120.5	82%	0.822	75%	0.753	S	S	*	*			trans	-44.2	156	166.5	-61.3	159.2	0	0	0	116.8
178	N	40.1	Very low	41.6	Very low	159 Å²	159	119.9 Å²	119.9	85%	0.85	75%	0.749	S	S	*	*			trans	52.3	130.9	148.9	-61.6	-8.9	0	0	0	118.8
179	G	41.6	Very low	42	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	75%	0.753	S	S	*	*			cis	126.3	115.9	37.1	0	0	0	0	0	110.3
180	S	41.3	Very low	42.5	Very low	125 Å²	125	123.9 Å²	123.9	87%	0.874	75%	0.75	S	S	*	*			trans	70.9	101.9	157	-60.5	0	0	0	0	121.8
181	A	39.8	Very low	42.7	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	75%	0.754	S	S	*	*				105.8	164.6	108	0	0	0	0	0	121.2
182	V	40.3	Very low	42.9	Very low	132 Å²	132	132.6 Å²	132.6	80%	0.8	76%	0.759	S	S	*	*			trans	82	83.4	171.3	-161.2	0	0	0	0	118
183	S	40.5	Very low	43.4	Very low	108 Å²	108	132 Å²	132	76%	0.755	76%	0.762	S	S	*	*				17.8	143.4	125.5	-44.4	0	0	0	0	121.8
184	V	43.8	Very low	43.4	Very low	128 Å²	128	129.5 Å²	129.5	78%	0.776	76%	0.762	S	S	*	*				174.5	149	105.1	152	0	0	0	0	113.4
185	D	43.7	Very low	43.5	Very low	122 Å²	122	130.6 Å²	130.6	65%	0.652	77%	0.768	S	S	*	*			trans	96.2	117.7	153.2	-95.6	3.7	0	0	0	126.3
186	Q	45.8	Very low	43.4	Very low	151 Å²	151	127.1 Å²	127.1	71%	0.706	76%	0.76	S	S	*	*				54.3	152.4	127.3	-70.3	-178.8	73.5	0	0	121.7
187	T	43.8	Very low	43.4	Very low	103 Å²	103	127.9 Å²	127.9	63%	0.632	75%	0.753	S	S	*	*			cis	-156.9	152	24.5	-21.1	0	0	0	0	114.1
188	T	43.8	Very low	43.1	Very low	116 Å²	116	126 Å²	126	71%	0.712	75%	0.748	S	S	*	*			trans	60.2	151	150.6	54.9	0	0	0	0	121.8
189	L	48.4	Very low	43.1	Very low	159 Å²	159	123.2 Å²	123.2	83%	0.832	74%	0.741	S	S	*	*			cis	-160	179.4	-11.9	-101.4	173.7	0	0	0	109.1
190	P	51.4	Low	43	Very low	102 Å²	102	126.8 Å²	126.8	66%	0.662	75%	0.749	S	S	*	*			trans	-134.2	-174.6	-144.2	45.9	-30	0	0	0	117.6
191	F	44	Very low	42.8	Very low	189 Å²	189	130.6 Å²	130.6	83%	0.829	75%	0.75	S	S	*	*			trans	165.6	152.6	143.5	-107.4	-127.5	0	0	0	108.6
192	R	45	Very low	42.6	Very low	219 Å²	219	136.6 Å²	136.6	83%	0.826	76%	0.758	S	S	*	*			cis	-160	152.5	-17.6	-178.2	174.2	-178.4	-126.6	1.3	108.4
193	P	48.7	Very low	42.5	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	76%	0.755	S	S	*	*			trans	-119.3	-160.5	-161.6	44.2	-34	0	0	0	116.5
194	S	41.8	Very low	42.5	Very low	105 Å²	105	135 Å²	135	73%	0.734	76%	0.758	S	S	*	*			trans	99.5	147.6	161.5	-62.6	0	0	0	0	118.1
195	V	43.7	Very low	42.2	Very low	127 Å²	127	138.5 Å²	138.5	77%	0.77	76%	0.763	S	S	*	*			cis	-155.6	162.2	4.3	-115.9	0	0	0	0	115.1
196	T	40.4	Very low	42.1	Very low	113 Å²	113	142.5 Å²	142.5	69%	0.693	78%	0.775	S	S	*	*			trans	-15.5	140.4	154.4	46.5	0	0	0	0	119
197	S	39	Very low	41.7	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	78%	0.783	S	S	*	*				74	158.4	58.4	82.9	0	0	0	0	115
198	T	38.4	Very low	41.8	Very low	118 Å²	118	145.1 Å²	145.1	72%	0.724	79%	0.789	S	S	*	*			cis	-165.1	143.9	28.6	-29.5	0	0	0	0	115.3
199	S	39.2	Very low	41.7	Very low	100 Å²	100	147 Å²	147	70%	0.699	79%	0.794	S	S	*	*			trans	69.1	147.6	149	71	0	0	0	0	125.9
200	T	39.4	Very low	41.4	Very low	143 Å²	143	143.6 Å²	143.6	88%	0.877	78%	0.784	S	S	*	*			trans	110.9	156.8	150.3	73.5	0	0	0	0	121.8
201	K	38.4	Very low	41.1	Very low	205 Å²	205	144 Å²	144	89%	0.891	79%	0.785	S	S	*	*			trans	-84.5	151.6	-159	-52.6	157.1	-179	170.9	0	113.7
202	K	35.7	Very low	41.3	Very low	220 Å²	220	142.2 Å²	142.2	96%	0.957	78%	0.782	S	S	*	*				161.4	173.4	108.7	-149.4	165.3	-176.4	-178.9	0	110.6
203	A	37.5	Very low	41.3	Very low	87 Å²	87	137.9 Å²	137.9	72%	0.719	78%	0.776	S	S	*	*			trans	-120.7	158	-171.6	0	0	0	0	0	113.8
204	S	40.3	Very low	41.1	Very low	119 Å²	119	141.2 Å²	141.2	83%	0.832	78%	0.781	S	S	*	*			trans	168.6	107.2	132.9	-76.7	0	0	0	0	117.7
205	K	37	Very low	41.4	Very low	203 Å²	203	143.1 Å²	143.1	88%	0.883	78%	0.782	S	S	*	*				34.2	103.9	123.7	-167.6	179.7	-174.6	176.3	0	122.3
206	K	41.5	Very low	41.7	Very low	206 Å²	206	142.1 Å²	142.1	90%	0.896	78%	0.779	S	S	*	*			trans	179.2	145.4	141.5	-102	176.3	177.8	-176.3	0	107.9
207	K	38	Very low	41.8	Very low	200 Å²	200	142.4 Å²	142.4	87%	0.87	79%	0.786	S	S	*	*			cis	106.2	90.3	10.3	-159.6	-158.1	175.6	-168.7	0	116.6
208	S	46.7	Very low	41.9	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	79%	0.792	S	S	*	*			trans	-160.6	135.5	150.5	47.8	0	0	0	0	107
209	D	41.5	Very low	42.3	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	79%	0.788	S	S	*	*				64	136.8	70.9	-97.4	-19.8	0	0	0	114.2
210	S	42.5	Very low	42.4	Very low	87 Å²	87	147 Å²	147	61%	0.608	79%	0.794	S	S	*	*			cis	-158.8	171.9	2.8	62.4	0	0	0	0	113.3
211	T	44	Very low	42.9	Very low	112 Å²	112	145 Å²	145	69%	0.687	79%	0.786	S	S	*	*			trans	58.7	118.5	149.9	44.5	0	0	0	0	120.3
212	I	49.6	Very low	43.2	Very low	151 Å²	151	144.3 Å²	144.3	77%	0.774	78%	0.78	S	S	*	*				81.2	137.2	69.9	-76.8	175.1	0	0	0	112.9
213	D	44.6	Very low	43.9	Very low	128 Å²	128	141.1 Å²	141.1	68%	0.684	77%	0.773	S	S	*	*			cis	-109.9	-108.3	5.7	-156.9	-106.4	0	0	0	114.9
214	E	44.9	Very low	44.1	Very low	181 Å²	181	143.3 Å²	143.3	85%	0.846	77%	0.773	S	S	*	*			cis	-153.1	159.6	1.2	-163.5	174.4	78.5	0	0	112.2
215	L	47.8	Very low	44.6	Very low	145 Å²	145	144.5 Å²	144.5	76%	0.759	77%	0.769	S	S	*	*			trans	-156.1	-178.9	-165.7	-86.1	164.1	0	0	0	110.6
216	P	50.2	Low	44.8	Very low	106 Å²	106	139.4 Å²	139.4	69%	0.688	76%	0.759	S	S	*	*			cis	-132.4	-173.4	-38.9	39.1	-23.7	0	0	0	112.5
217	S	42.4	Very low	45	Very low	120 Å²	120	140.6 Å²	140.6	84%	0.839	76%	0.758	S	S	*	*			trans	-167.1	151.6	136.9	-87.1	0	0	0	0	114.2
218	T	39.9	Very low	45.3	Very low	132 Å²	132	137.5 Å²	137.5	81%	0.81	75%	0.751	S	S	*	*			trans	-124.8	-151.1	-175.5	50	0	0	0	0	108.1
219	P	46.5	Very low	45.1	Very low	97 Å²	97	141.4 Å²	141.4	63%	0.63	75%	0.749	S	S	*	*			cis	-146.8	-169.1	-1.7	43.7	-21.9	0	0	0	118.1
220	Q	42.6	Very low	45.2	Very low	180 Å²	180	143.5 Å²	143.5	84%	0.841	75%	0.745	S	S	*	*			trans	75.7	119	143.8	-84.1	163.2	-9.7	0	0	123.3
221	S	48.9	Very low	45.3	Very low	101 Å²	101	147.7 Å²	147.7	71%	0.706	76%	0.755	S	S	*	*				-151.8	157.6	118.7	-163.6	0	0	0	0	110.8
222	Y	44.2	Very low	45.6	Very low	191 Å²	191	150 Å²	150	75%	0.749	76%	0.762	S	S	*	*			trans	-90.7	165	-173.3	34.8	-89.6	0	0	0	111.1
223	D	51.6	Low	45.6	Very low	154 Å²	154	151.5 Å²	151.5	82%	0.824	76%	0.763	S	S	*	*				-156.3	178.4	61.6	-122.6	-37.1	0	0	0	116.2
224	D	40.5	Very low	45.9	Very low	132 Å²	132	154.6 Å²	154.6	71%	0.706	77%	0.77	S	S	*	*			trans	-104.3	-177.5	-159.5	-172.8	29.3	0	0	0	116.7
225	L	51.6	Low	45.6	Very low	144 Å²	144	152.4 Å²	152.4	75%	0.754	77%	0.771	S	S	*	*			trans	109.9	74.8	155.5	-59.7	177.2	0	0	0	119.7
226	S	42.1	Very low	45.3	Very low	97 Å²	97	155.1 Å²	155.1	68%	0.678	78%	0.777	S	S	*	*				39.1	127.8	123.5	-90.3	0	0	0	0	123.3
227	R	44.4	Very low	44.9	Very low	231 Å²	231	162 Å²	162	87%	0.872	79%	0.789	S	S	*	*			trans	86	153	140.2	-70.8	-178.8	175.5	168.4	0.1	121.3
228	D	44.8	Very low	44.5	Very low	135 Å²	135	164.8 Å²	164.8	72%	0.722	79%	0.789	S	S	*	*			trans	66.2	97.7	165.5	-84.6	-75.1	0	0	0	122.6
229	R	43.3	Very low	44.4	Very low	191 Å²	191	168 Å²	168	72%	0.721	79%	0.788	S	S	*	*				103.4	116.4	105.7	-155.6	163	-163.4	-157.9	9.4	119.4
230	R	41.9	Very low	44.1	Very low	199 Å²	199	169.2 Å²	169.2	75%	0.751	79%	0.785	S	S	*	*			trans	79.6	106	164.6	-61.8	161.8	-160.8	-166.5	8.7	117.3
231	Q	44.8	Very low	43.9	Very low	175 Å²	175	168.7 Å²	168.7	82%	0.818	78%	0.783	S	S	*	*			trans	-67.6	126.4	161.4	-63.8	177.4	-2.4	0	0	111
232	I	51.5	Low	43.6	Very low	161 Å²	161	171.7 Å²	171.7	83%	0.826	78%	0.778	S	S	*	*			trans	-92.2	100.7	170.2	-62.8	169.9	0	0	0	109.1	K234	I232-K234 PolarHBondContact O-N 2.8Å
233	K	48.6	Very low	43.2	Very low	182 Å²	182	170 Å²	170	79%	0.791	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.1	121.7	174.1	-79.2	179.2	174	175.8	0	110.6
234	K	50.3	Low	42.8	Very low	193 Å²	193	169.6 Å²	169.6	84%	0.839	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.3	137.3	170.2	-64.8	-177.7	-179.3	178.5	0	109.8	I232 K236	I232-K234 PolarHBondContact O-N 2.8Å; K234-K236 PolarHBondContact O-N 3.49Å
235	P	39.4	Very low	42.8	Very low	135 Å²	135	166.4 Å²	166.4	88%	0.877	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.3	117.6	-172.5	-17.8	31.8	0	0	0	112.4
236	K	42	Very low	42.9	Very low	201 Å²	201	169.1 Å²	169.1	87%	0.874	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-94	117.4	171.1	-163.8	174.2	-175.3	-179.8	0	108.1	K234 E238	K234-K236 PolarHBondContact O-N 3.49Å; K236-E238 PolarHBondContact O-N 2.95Å
237	R	42.2	Very low	43.6	Very low	252 Å²	252	176 Å²	176	95%	0.951	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.7	125.8	-179.2	-78.5	-179.1	173.4	149	-2.3	110.4
238	E	33.6	Very low	44.7	Very low	177 Å²	177	169.7 Å²	169.7	83%	0.827	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-99.1	130.3	178	-173.4	159.7	-124.6	0	0	109.3	K236	K236-E238 PolarHBondContact O-N 2.95Å
239	Y	38.5	Very low	46.3	Very low	200 Å²	200	174.9 Å²	174.9	78%	0.784	79%	0.793	S	S	*	*			trans	-135.9	99.6	172.8	-173.5	-90.6	0	0	0	107.7	E241	Y239-E241 PolarHBondContact O-N 3.2Å; Y239-E241 VanDerWaalsContact O-N 3.09Å
240	E	38.9	Very low	48.3	Very low	123 Å²	123	167.8 Å²	167.8	58%	0.575	77%	0.769	S	S	*	*			trans	-71	97.5	179.6	-67.6	-167.9	137.6	0	0	111.6	R242	E240-R242 VanDerWaalsContact C-N 3.32Å; E240-R242 PolarHBondContact O-N 2.96Å; E240-R242 IonicContact OE2-CZ 3.85Å; E240-R242 IonicContact OE2-NE 4Å; E240-R242 PolarHBondContact OE2-NE 3.49Å; E240-R242 IonicContact OE2-NH2 2.93Å; E240-R242 PolarHBondContact OE2-NH2 2.96Å
241	E	38.1	Very low	50.6	Low	169 Å²	169	160 Å²	160	79%	0.79	75%	0.745	S	S	*	*			trans	-78.2	85.9	164.3	-162.3	167.7	-158.1	0	0	109.1	Y239 N243	Y239-E241 PolarHBondContact O-N 3.2Å; Y239-E241 VanDerWaalsContact O-N 3.09Å; E241-N243 PolarHBondContact O-N 2.93Å
242	R	43.8	Very low	52.9	Low	163 Å²	163	157.7 Å²	157.7	62%	0.615	73%	0.734	S	S	*	*			trans	-70.9	124.3	-165.7	-114.2	179.9	-79.8	102.6	-1.6	113.7	E240	E240-R242 VanDerWaalsContact C-N 3.32Å; E240-R242 PolarHBondContact O-N 2.96Å; E240-R242 IonicContact OE2-CZ 3.85Å; E240-R242 IonicContact OE2-NE 4Å; E240-R242 PolarHBondContact OE2-NE 3.49Å; E240-R242 IonicContact OE2-NH2 2.93Å; E240-R242 PolarHBondContact OE2-NH2 2.96Å
243	N	36.2	Very low	54.9	Low	157 Å²	157	150 Å²	150	84%	0.84	70%	0.695	S	S	*	*			trans	-40.6	134.5	176.1	-91.8	-53.8	0	0	0	115.9	E241	E241-N243 PolarHBondContact O-N 2.93Å
244	V	42.1	Very low	57.2	Low	144 Å²	144	141.7 Å²	141.7	87%	0.873	66%	0.659	S	S	*	*			trans	-114.7	65.7	156.9	-171.6	0	0	0	0	108.6
245	G	40	Very low	59.3	Low	66 Å²	66	137 Å²	137	68%	0.68	64%	0.639	S	S	*	*			trans	-95.6	22.1	-175.2	0	0	0	0	0	115.2	R247	G245-R247 PolarHBondContact O-N 3.46Å
246	K	54.3	Low	62	Low	201 Å²	201	131.9 Å²	131.9	87%	0.874	61%	0.608	S	S	*	*			trans	-80.9	103.5	-179.3	-68.5	-174.5	179.6	-178.7	0	109.8	L248	K246-L248 PolarHBondContact O-N 3.26Å
247	R	57.1	Low	64.7	Low	240 Å²	240	122.3 Å²	122.3	91%	0.906	57%	0.567	S	S	*	*			trans	-47.8	136.1	170.6	-92.7	179	157.5	175.7	-9.1	110.8	G245 R249	G245-R247 PolarHBondContact O-N 3.46Å; R247-R249 PolarHBondContact O-N 2.99Å
248	L	68.4	Low	67.3	Low	100 Å²	100	111.3 Å²	111.3	52%	0.524	53%	0.528	S	S	.	.			trans	-54.6	134.9	166.7	-177.9	68.1	0	0	0	109.8	K246 L250	K246-L248 PolarHBondContact O-N 3.26Å; L248-L250 HydrophobicContact CD2-CD2 3.87Å; L248-L250 HydrophobicContact CG-CD2 4.38Å
249	R	77.9	Confident	70.3	Confident	243 Å²	243	107.5 Å²	107.5	92%	0.917	51%	0.514	S	S	*	.			trans	-94.6	104.4	172.3	-83.3	-175.7	159.8	-179.3	-7.9	109	R247	R247-R249 PolarHBondContact O-N 2.99Å
250	L	85.7	Confident	73.1	Confident	42 Å²	42	98.9 Å²	98.9	22%	0.22	48%	0.481	C	S	.	.			trans	-72.9	154.3	168.7	-60.5	178.1	0	0	0	110.6	L248 L254 K255 L307	L248-L250 HydrophobicContact CD2-CD2 3.87Å; L248-L250 HydrophobicContact CG-CD2 4.38Å; L250-L254 HydrophobicContact CB-CB 3.89Å; L250-L254 HydrophobicContact CD2-CB 4.36Å; L250-L254 HydrophobicContact CD2-CD1 4.45Å; L250-K255 HydrophobicContact CB-CG 4.27Å; L250-K255 WeakPolarHBondContact O-CE 3.38Å; L250-L307 HydrophobicContact CD1-CD1 4.2Å; L250-L307 HydrophobicContact CD1-CG 4.38Å; L250-L307 HydrophobicContact CD2-CD1 4.23Å
251	S	90	Very high	75.9	Confident	35 Å²	35	93.3 Å²	93.3	25%	0.245	46%	0.455	C	S	.	.			trans	-64.9	178.4	172	74.3	0	0	0	0	112.4	L254 K255 D360	S251-L254 WeakPolarHBondContact OG-CB 3.36Å; S251-L254 WeakPolarHBondContact OG-CG 3.2Å; S251-L254 PolarHBondContact OG-N 3.03Å; S251-L254 VanDerWaalsContact OG-N 3.07Å; S251-K255 WeakPolarHBondContact O-CE 3.33Å; S251-K255 WeakPolarHBondContact O-CG 3.2Å; S251-K255 PolarHBondContact O-N 3.11Å; S251-K255 VanDerWaalsContact O-N 3.17Å; S251-K255 PolarHBondContact O-NZ 2.97Å; S251-K255 VanDerWaalsContact O-NZ 3.13Å; S251-D360 VanDerWaalsContact CB-OD1 3.31Å; S251-D360 WeakPolarHBondContact CB-OD1 3.2Å; S251-D360 WeakPolarHBondContact CB-OD2 3.38Å; S251-D360 PolarHBondContact OG-OD1 3.32Å; S251-D360 PolarHBondContact OG-OD2 2.52Å
252	E	91.7	Very high	78.8	Confident	127 Å²	127	90.9 Å²	90.9	59%	0.593	44%	0.442	S	S	*	.	H	α-helix	trans	-64.3	-50.8	174	-164.7	78.7	-179.7	0	0	110.1	L254 K255 A256 D360	E252-L254 PolarHBondContact O-N 2.93Å; E252-K255 VanDerWaalsContact CA-NZ 3.34Å; E252-K255 WeakPolarHBondContact O-CB 3.24Å; E252-K255 PolarHBondContact O-N 3.14Å; E252-K255 VanDerWaalsContact O-N 3.14Å; E252-K255 IonicContact OE2-NZ 3.59Å; E252-K255 PolarHBondContact OE2-NZ 2.9Å; E252-A256 PolarHBondContact O-N 3.31Å; E252-A256 VanDerWaalsContact O-N 3.17Å; E252-D360 PolarHBondContact N-OD1 3.23Å
253	A	94.8	Very high	81.3	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-61.2	-43.4	179.1	0	0	0	0	0	111.9	K255 A256 C257 K315 V357 P358 D360	A253-K255 VanDerWaalsContact C-N 3.31Å; A253-K255 PolarHBondContact O-N 2.73Å; A253-A256 WeakPolarHBondContact O-CA 3.39Å; A253-A256 WeakPolarHBondContact O-CB 3.36Å; A253-A256 PolarHBondContact O-N 3.17Å; A253-C257 PolarHBondContact O-N 2.85Å; A253-C257 PolarHBondContact O-SG 3.02Å; A253-K315 HydrophobicContact CB-CB 3.85Å; A253-K315 HydrophobicContact CB-CD 4.05Å; A253-K315 HydrophobicContact CB-CG 4.33Å; A253-V357 HydrophobicContact CB-CG1 3.74Å; A253-P358 WeakPolarHBondContact CB-O 3.41Å; A253-D360 WeakPolarHBondContact CB-OD2 3.42Å; A253-D360 PolarHBondContact N-OD1 3.14Å; A253-D360 VanDerWaalsContact N-OD1 3.12Å
254	L	95.8	Very high	84.2	Confident	7 Å²	7	78 Å²	78	4%	0.037	39%	0.385	C	S	.	.	H	α-helix	trans	-66.6	-26	177.7	-72.7	172.4	0	0	0	113.8	L250 S251 E252 S258 L307 Y312 T314	L250-L254 HydrophobicContact CB-CB 3.89Å; L250-L254 HydrophobicContact CD2-CB 4.36Å; L250-L254 HydrophobicContact CD2-CD1 4.45Å; S251-L254 WeakPolarHBondContact OG-CB 3.36Å; S251-L254 WeakPolarHBondContact OG-CG 3.2Å; S251-L254 PolarHBondContact OG-N 3.03Å; S251-L254 VanDerWaalsContact OG-N 3.07Å; E252-L254 PolarHBondContact O-N 2.93Å; L254-S258 WeakPolarHBondContact O-CB 3.29Å; L254-S258 PolarHBondContact O-N 3.25Å; L254-L307 HydrophobicContact CB-CD1 4.45Å; L254-L307 HydrophobicContact CD2-CD1 3.92Å; L254-Y312 WeakPolarHBondContact CD1-O 3.14Å; L254-T314 WeakPolarHBondContact CD2-O 3.37Å
255	K	95.1	Very high	86.9	Confident	94 Å²	94	73 Å²	73	41%	0.409	36%	0.357	S	S	.	.	H	α-helix	trans	-68.5	-41	168.6	-69.9	169.5	-140.8	108.4	0	111.1	L250 S251 E252 A253 S258 N259	L250-K255 HydrophobicContact CB-CG 4.27Å; L250-K255 WeakPolarHBondContact O-CE 3.38Å; S251-K255 WeakPolarHBondContact O-CE 3.33Å; S251-K255 WeakPolarHBondContact O-CG 3.2Å; S251-K255 PolarHBondContact O-N 3.11Å; S251-K255 VanDerWaalsContact O-N 3.17Å; S251-K255 PolarHBondContact O-NZ 2.97Å; S251-K255 VanDerWaalsContact O-NZ 3.13Å; E252-K255 VanDerWaalsContact CA-NZ 3.34Å; E252-K255 WeakPolarHBondContact O-CB 3.24Å; E252-K255 PolarHBondContact O-N 3.14Å; E252-K255 VanDerWaalsContact O-N 3.14Å; E252-K255 IonicContact OE2-NZ 3.59Å; E252-K255 PolarHBondContact OE2-NZ 2.9Å; A253-K255 VanDerWaalsContact C-N 3.31Å; A253-K255 PolarHBondContact O-N 2.73Å; K255-S258 VanDerWaalsContact O-CB 3.31Å; K255-S258 WeakPolarHBondContact O-CB 3.02Å; K255-S258 PolarHBondContact O-N 3.42Å; K255-N259 PolarHBondContact O-N 3.5Å; K255-N259 VanDerWaalsContact O-N 3.17Å
256	A	96.3	Very high	89.6	Confident	29 Å²	29	71.4 Å²	71.4	24%	0.24	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-44.8	175.8	0	0	0	0	0	111.2	E252 A253 S258 N259 I260 V357	E252-A256 PolarHBondContact O-N 3.31Å; E252-A256 VanDerWaalsContact O-N 3.17Å; A253-A256 WeakPolarHBondContact O-CA 3.39Å; A253-A256 WeakPolarHBondContact O-CB 3.36Å; A253-A256 PolarHBondContact O-N 3.17Å; A256-S258 VanDerWaalsContact C-N 3.28Å; A256-S258 PolarHBondContact O-N 3.37Å; A256-N259 WeakPolarHBondContact O-CA 3.31Å; A256-N259 WeakPolarHBondContact O-CB 3.44Å; A256-N259 PolarHBondContact O-N 3.37Å; A256-I260 PolarHBondContact O-N 2.87Å; A256-V357 HydrophobicContact CB-CB 4.47Å; A256-V357 HydrophobicContact CB-CG1 3.94Å; A256-V357 HydrophobicContact CB-CG2 3.98Å
257	C	97.5	Very high	91.6	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-53	-43.4	169.4	-64.2	0	0	0	0	112.3	A253 N259 I260 L261 F318	A253-C257 PolarHBondContact O-N 2.85Å; A253-C257 PolarHBondContact O-SG 3.02Å; C257-N259 PolarHBondContact O-N 3.11Å; C257-I260 PolarHBondContact O-N 3.27Å; C257-L261 WeakPolarHBondContact O-CB 3.43Å; C257-L261 PolarHBondContact O-N 2.81Å; C257-F318 HydrophobicContact CB-CD1 3.48Å; C257-F318 VanDerWaalsContact CB-CD1 3.48Å; C257-F318 HydrophobicContact CB-CD2 4.29Å; C257-F318 HydrophobicContact CB-CE1 3.45Å; C257-F318 VanDerWaalsContact CB-CE1 3.45Å; C257-F318 HydrophobicContact CB-CE2 4.27Å; C257-F318 HydrophobicContact CB-CG 3.91Å; C257-F318 HydrophobicContact CB-CZ 3.87Å; C257-F318 WeakPolarHBondContact O-CZ 3.23Å; C257-F318 WeakPolarHBondContact SG-CD1 3.33Å
258	S	96.7	Very high	93.4	Very high	21 Å²	21	64.7 Å²	64.7	15%	0.147	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-30.3	174.5	-171.8	0	0	0	0	113.1	L254 K255 A256 K262	L254-S258 WeakPolarHBondContact O-CB 3.29Å; L254-S258 PolarHBondContact O-N 3.25Å; K255-S258 VanDerWaalsContact O-CB 3.31Å; K255-S258 WeakPolarHBondContact O-CB 3.02Å; K255-S258 PolarHBondContact O-N 3.42Å; A256-S258 VanDerWaalsContact C-N 3.28Å; A256-S258 PolarHBondContact O-N 3.37Å; S258-K262 VanDerWaalsContact O-CD 3.24Å; S258-K262 WeakPolarHBondContact O-CD 3.49Å; S258-K262 WeakPolarHBondContact O-CE 3.48Å; S258-K262 WeakPolarHBondContact O-CG 3.38Å; S258-K262 PolarHBondContact O-N 3Å; S258-K262 PolarHBondContact O-NZ 3.4Å; S258-K262 VanDerWaalsContact O-NZ 3.16Å; S258-K262 VanDerWaalsContact OG-CE 3.29Å; S258-K262 WeakPolarHBondContact OG-CE 3.45Å; S258-K262 PolarHBondContact OG-NZ 3.08Å
259	N	97	Very high	94.8	Very high	97 Å²	97	62 Å²	62	52%	0.519	29%	0.294	S	S	.	.	H	α-helix	trans	-80.8	-42.8	177.3	-65.9	-18.9	0	0	0	111.8	K255 A256 C257 L261 K262 D263	K255-N259 PolarHBondContact O-N 3.5Å; K255-N259 VanDerWaalsContact O-N 3.17Å; A256-N259 WeakPolarHBondContact O-CA 3.31Å; A256-N259 WeakPolarHBondContact O-CB 3.44Å; A256-N259 PolarHBondContact O-N 3.37Å; C257-N259 PolarHBondContact O-N 3.11Å; N259-L261 VanDerWaalsContact C-N 3.29Å; N259-L261 PolarHBondContact O-N 3.4Å; N259-K262 PolarHBondContact O-N 3.17Å; N259-K262 PolarHBondContact OD1-NZ 2.69Å; N259-D263 PolarHBondContact O-N 2.81Å
260	I	97.9	Very high	95.6	Very high	18 Å²	18	57.5 Å²	57.5	9%	0.092	28%	0.276	C	S	.	.	H	α-helix	trans	-55.7	-47.3	172.1	-63.8	170	0	0	0	110.1	A256 C257 K262 D263 I264 F350 N353 F354 V357	A256-I260 PolarHBondContact O-N 2.87Å; C257-I260 PolarHBondContact O-N 3.27Å; I260-K262 VanDerWaalsContact C-N 3.34Å; I260-K262 PolarHBondContact O-N 3.08Å; I260-D263 PolarHBondContact O-N 2.66Å; I260-D263 VanDerWaalsContact O-N 3.07Å; I260-I264 HydrophobicContact CG2-CG2 4.36Å; I260-I264 WeakPolarHBondContact O-CG1 3.44Å; I260-I264 PolarHBondContact O-N 3.46Å; I260-F350 HydrophobicContact CG2-CD2 3.71Å; I260-F350 HydrophobicContact CG2-CE2 4.03Å; I260-N353 HydrophobicContact CD1-CB 4.23Å; I260-N353 WeakPolarHBondContact CD1-O 3.06Å; I260-N353 HydrophobicContact CG1-CB 4.17Å; I260-F354 HydrophobicContact CD1-CB 4.47Å; I260-V357 HydrophobicContact CD1-CG2 3.41Å; I260-V357 VanDerWaalsContact CD1-CG2 3.41Å
261	L	98.3	Very high	96.1	Very high	7 Å²	7	61.1 Å²	61.1	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-59.5	-41.6	179.4	-175.4	63.7	0	0	0	112.7	C257 N259 D263 S265 L300 I303 K304 L307 F318	C257-L261 WeakPolarHBondContact O-CB 3.43Å; C257-L261 PolarHBondContact O-N 2.81Å; N259-L261 VanDerWaalsContact C-N 3.29Å; N259-L261 PolarHBondContact O-N 3.4Å; L261-D263 VanDerWaalsContact C-N 3.31Å; L261-S265 WeakPolarHBondContact O-CB 3.31Å; L261-S265 PolarHBondContact O-N 3.26Å; L261-S265 VanDerWaalsContact O-N 3.1Å; L261-S265 PolarHBondContact O-OG 3.47Å; L261-L300 HydrophobicContact CD1-CD2 3.83Å; L261-I303 HydrophobicContact CD1-CB 4.37Å; L261-I303 HydrophobicContact CD1-CG2 3.89Å; L261-I303 HydrophobicContact CD2-CG2 4.06Å; L261-K304 HydrophobicContact CD2-CB 3.82Å; L261-K304 HydrophobicContact CD2-CG 4.36Å; L261-L307 HydrophobicContact CD2-CD2 4.06Å; L261-F318 HydrophobicContact CB-CE2 4.1Å; L261-F318 HydrophobicContact CB-CZ 4.15Å; L261-F318 HydrophobicContact CD1-CE2 4.35Å; L261-F318 HydrophobicContact CD2-CE2 4.24Å; L261-F318 HydrophobicContact CG-CE2 4.46Å
262	K	97.6	Very high	96.4	Very high	117 Å²	117	61 Å²	61	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-64.1	-38.7	175	-69.7	159.2	-153.2	142.1	0	111.5	S258 N259 I260 S266	S258-K262 VanDerWaalsContact O-CD 3.24Å; S258-K262 WeakPolarHBondContact O-CD 3.49Å; S258-K262 WeakPolarHBondContact O-CE 3.48Å; S258-K262 WeakPolarHBondContact O-CG 3.38Å; S258-K262 PolarHBondContact O-N 3Å; S258-K262 PolarHBondContact O-NZ 3.4Å; S258-K262 VanDerWaalsContact O-NZ 3.16Å; S258-K262 VanDerWaalsContact OG-CE 3.29Å; S258-K262 WeakPolarHBondContact OG-CE 3.45Å; S258-K262 PolarHBondContact OG-NZ 3.08Å; N259-K262 PolarHBondContact O-N 3.17Å; N259-K262 PolarHBondContact OD1-NZ 2.69Å; I260-K262 VanDerWaalsContact C-N 3.34Å; I260-K262 PolarHBondContact O-N 3.08Å; K262-S266 WeakPolarHBondContact O-CB 3.2Å; K262-S266 PolarHBondContact O-N 2.88Å; K262-S266 VanDerWaalsContact O-N 3.15Å
263	D	97.3	Very high	96.7	Very high	49 Å²	49	55 Å²	55	26%	0.262	27%	0.265	S	S	.	.	H	α-helix	trans	-71.9	-50.8	-175.7	-155.8	56	0	0	0	111.2	N259 I260 L261 S265 S266 R268 Y269	N259-D263 PolarHBondContact O-N 2.81Å; I260-D263 PolarHBondContact O-N 2.66Å; I260-D263 VanDerWaalsContact O-N 3.07Å; L261-D263 VanDerWaalsContact C-N 3.31Å; D263-S265 VanDerWaalsContact C-N 3.26Å; D263-S265 PolarHBondContact O-N 2.86Å; D263-S266 WeakPolarHBondContact O-CB 3.31Å; D263-S266 PolarHBondContact O-N 2.8Å; D263-S266 PolarHBondContact O-OG 2.95Å; D263-R268 IonicContact OD1-CZ 2.69Å; D263-R268 VanDerWaalsContact OD1-CZ 3.23Å; D263-R268 IonicContact OD1-NH1 3.22Å; D263-R268 PolarHBondContact OD1-NH1 2.59Å; D263-R268 IonicContact OD1-NH2 3.25Å; D263-R268 PolarHBondContact OD1-NH2 2.82Å; D263-R268 IonicContact OD2-CZ 2.67Å; D263-R268 IonicContact OD2-NH1 3.57Å; D263-R268 PolarHBondContact OD2-NH1 3.05Å; D263-R268 IonicContact OD2-NH2 3.71Å; D263-Y269 VanDerWaalsContact O-CD2 3.27Å; D263-Y269 WeakPolarHBondContact O-CD2 3.3Å
264	I	97.7	Very high	96.7	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-27.2	176.2	70	-177.4	0	0	0	112.8	I260 S266 N273 L300 L346 I349 F350	I260-I264 HydrophobicContact CG2-CG2 4.36Å; I260-I264 WeakPolarHBondContact O-CG1 3.44Å; I260-I264 PolarHBondContact O-N 3.46Å; I264-S266 VanDerWaalsContact C-N 3.31Å; I264-N273 WeakPolarHBondContact O-CB 3.37Å; I264-N273 PolarHBondContact O-ND2 3.2Å; I264-L300 HydrophobicContact CD1-CD2 3.67Å; I264-L300 HydrophobicContact CG1-CD2 3.96Å; I264-L346 HydrophobicContact CB-CD1 4.28Å; I264-I349 HydrophobicContact CG2-CG2 4.44Å; I264-F350 HydrophobicContact CD1-CD2 4.17Å
265	S	97.7	Very high	96.7	Very high	39 Å²	39	63.5 Å²	63.5	27%	0.273	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	0.9	172.5	-49.9	0	0	0	0	113.7	L261 D263	L261-S265 WeakPolarHBondContact O-CB 3.31Å; L261-S265 PolarHBondContact O-N 3.26Å; L261-S265 VanDerWaalsContact O-N 3.1Å; L261-S265 PolarHBondContact O-OG 3.47Å; D263-S265 VanDerWaalsContact C-N 3.26Å; D263-S265 PolarHBondContact O-N 2.86Å
266	S	96.9	Very high	96.8	Very high	32 Å²	32	59.5 Å²	59.5	22%	0.224	29%	0.286	C	S	.	.	S	Bend	trans	-80.4	165.8	-174.4	78.2	0	0	0	0	112.9	K262 D263 I264 R268 Y269 N273	K262-S266 WeakPolarHBondContact O-CB 3.2Å; K262-S266 PolarHBondContact O-N 2.88Å; K262-S266 VanDerWaalsContact O-N 3.15Å; D263-S266 WeakPolarHBondContact O-CB 3.31Å; D263-S266 PolarHBondContact O-N 2.8Å; D263-S266 PolarHBondContact O-OG 2.95Å; I264-S266 VanDerWaalsContact C-N 3.31Å; S266-R268 PolarHBondContact O-N 3.09Å; S266-R268 VanDerWaalsContact O-N 3.12Å; S266-R268 WeakPolarHBondContact OG-CB 3.44Å; S266-R268 PolarHBondContact OG-N 2.8Å; S266-Y269 PolarHBondContact O-N 2.83Å; S266-N273 PolarHBondContact O-ND2 2.82Å
267	Q	95.1	Very high	96.9	Very high	146 Å²	146	61.2 Å²	61.2	68%	0.682	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-61.3	-16.6	172.6	-169.9	60.5	37.4	0	0	113.3	Y269 R270	Q267-Y269 VanDerWaalsContact C-N 3.31Å; Q267-Y269 PolarHBondContact O-N 3.05Å; Q267-R270 PolarHBondContact O-N 3.37Å
268	R	96.4	Very high	96.9	Very high	154 Å²	154	68.7 Å²	68.7	58%	0.581	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-63.2	-38.2	177.5	-164.8	-163.8	-57.4	132.2	13.8	111.8	D263 S266	D263-R268 IonicContact OD1-CZ 2.69Å; D263-R268 VanDerWaalsContact OD1-CZ 3.23Å; D263-R268 IonicContact OD1-NH1 3.22Å; D263-R268 PolarHBondContact OD1-NH1 2.59Å; D263-R268 IonicContact OD1-NH2 3.25Å; D263-R268 PolarHBondContact OD1-NH2 2.82Å; D263-R268 IonicContact OD2-CZ 2.67Å; D263-R268 IonicContact OD2-NH1 3.57Å; D263-R268 PolarHBondContact OD2-NH1 3.05Å; D263-R268 IonicContact OD2-NH2 3.71Å; S266-R268 PolarHBondContact O-N 3.09Å; S266-R268 VanDerWaalsContact O-N 3.12Å; S266-R268 WeakPolarHBondContact OG-CB 3.44Å; S266-R268 PolarHBondContact OG-N 2.8Å
269	Y	96.4	Very high	96.9	Very high	44 Å²	44	71.3 Å²	71.3	17%	0.173	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-103.9	25.1	-177.7	-57.6	-69.5	0	0	0	112.6	D263 S266 Q267 D271 L272 N273 L346 I349	D263-Y269 VanDerWaalsContact O-CD2 3.27Å; D263-Y269 WeakPolarHBondContact O-CD2 3.3Å; S266-Y269 PolarHBondContact O-N 2.83Å; Q267-Y269 VanDerWaalsContact C-N 3.31Å; Q267-Y269 PolarHBondContact O-N 3.05Å; Y269-D271 PolarHBondContact O-N 3.14Å; Y269-D271 VanDerWaalsContact O-N 3.12Å; Y269-L272 HydrophobicContact CD1-CD1 4.3Å; Y269-L272 CarbonylContact O-C 3.54Å; Y269-L272 WeakPolarHBondContact O-CA 3.44Å; Y269-L272 PolarHBondContact O-N 3.16Å; Y269-N273 WeakPolarHBondContact O-CB 3.43Å; Y269-N273 PolarHBondContact O-N 2.93Å; Y269-N273 PolarHBondContact O-ND2 3.48Å; Y269-N273 PolarHBondContact O-OD1 3.28Å; Y269-L346 HydrophobicContact CG-CD1 4.43Å; Y269-I349 HydrophobicContact CD1-CD1 3.96Å; Y269-I349 HydrophobicContact CE1-CD1 3.75Å; Y269-I349 HydrophobicContact CE1-CG2 4.19Å; Y269-I349 HydrophobicContact CE2-CG2 4.4Å
270	R	95.4	Very high	96.8	Very high	147 Å²	147	68.7 Å²	68.7	56%	0.555	33%	0.327	S	S	*	.	H	α-helix	trans	-46.1	-46.8	-178	-171.5	-144.4	-169.6	168.8	-0.3	112.7	Q267 L272 N273 H274	Q267-R270 PolarHBondContact O-N 3.37Å; R270-L272 PolarHBondContact O-N 3.45Å; R270-N273 WeakPolarHBondContact CA-OD1 3.27Å; R270-N273 PolarHBondContact O-N 3.26Å; R270-N273 PolarHBondContact O-OD1 3.5Å; R270-H274 WeakPolarHBondContact O-CB 3.43Å; R270-H274 PolarHBondContact O-N 2.92Å; R270-H274 PolarHBondContact O-ND1 3.01Å
271	D	95.8	Very high	96.6	Very high	119 Å²	119	72.1 Å²	72.1	64%	0.636	35%	0.345	S	S	*	.	H	α-helix	trans	-74.1	-12.9	-174.1	-50.3	-34	0	0	0	112.2	Y269 H274	Y269-D271 PolarHBondContact O-N 3.14Å; Y269-D271 VanDerWaalsContact O-N 3.12Å; D271-H274 PolarHBondContact O-CE1 2.86Å; D271-H274 VanDerWaalsContact O-CE1 3.25Å; D271-H274 PolarHBondContact O-ND1 3.5Å
272	L	97.1	Very high	96.4	Very high	31 Å²	31	73 Å²	73	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-105	-31.2	173.8	-57.3	-177.9	0	0	0	114.1	Y269 R270 F276 V342 Q345 L346 I349	Y269-L272 HydrophobicContact CD1-CD1 4.3Å; Y269-L272 CarbonylContact O-C 3.54Å; Y269-L272 WeakPolarHBondContact O-CA 3.44Å; Y269-L272 PolarHBondContact O-N 3.16Å; R270-L272 PolarHBondContact O-N 3.45Å; L272-F276 WeakPolarHBondContact O-CD2 3.24Å; L272-V342 HydrophobicContact CB-CG1 4.35Å; L272-V342 HydrophobicContact CD2-CG1 4.14Å; L272-V342 VanDerWaalsContact O-CG1 3.27Å; L272-V342 WeakPolarHBondContact O-CG1 3.2Å; L272-Q345 HydrophobicContact CD1-CB 4.29Å; L272-Q345 HydrophobicContact CD2-CB 4.12Å; L272-L346 HydrophobicContact CB-CB 4.24Å; L272-L346 HydrophobicContact CB-CD1 4.1Å; L272-I349 HydrophobicContact CD1-CD1 3.67Å
273	N	97.4	Very high	96	Very high	3 Å²	3	73.3 Å²	73.3	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-98.6	-12.3	-169.5	72.4	15.4	0	0	0	115	I264 S266 Y269 R270 F275 F276 L277 L300 L346	I264-N273 WeakPolarHBondContact O-CB 3.37Å; I264-N273 PolarHBondContact O-ND2 3.2Å; S266-N273 PolarHBondContact O-ND2 2.82Å; Y269-N273 WeakPolarHBondContact O-CB 3.43Å; Y269-N273 PolarHBondContact O-N 2.93Å; Y269-N273 PolarHBondContact O-ND2 3.48Å; Y269-N273 PolarHBondContact O-OD1 3.28Å; R270-N273 WeakPolarHBondContact CA-OD1 3.27Å; R270-N273 PolarHBondContact O-N 3.26Å; R270-N273 PolarHBondContact O-OD1 3.5Å; N273-F275 PolarHBondContact O-N 3.28Å; N273-F275 VanDerWaalsContact O-N 3.12Å; N273-F276 WeakPolarHBondContact O-CA 3.49Å; N273-F276 PolarHBondContact O-N 3.49Å; N273-L277 HydrophobicContact CB-CG 4.47Å; N273-L277 WeakPolarHBondContact O-CG 3.23Å; N273-L277 PolarHBondContact O-N 2.9Å; N273-L277 VanDerWaalsContact O-N 3.15Å; N273-L300 HydrophobicContact CB-CD1 4.4Å; N273-L346 HydrophobicContact CB-CD1 4.5Å; N273-L346 HydrophobicContact CB-CD2 3.86Å
274	H	95.1	Very high	95.7	Very high	96 Å²	96	74.8 Å²	74.8	44%	0.444	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28	-172.3	61.2	-85.4	0	0	0	114.7	R270 D271 F276	R270-H274 WeakPolarHBondContact O-CB 3.43Å; R270-H274 PolarHBondContact O-N 2.92Å; R270-H274 PolarHBondContact O-ND1 3.01Å; D271-H274 PolarHBondContact O-CE1 2.86Å; D271-H274 VanDerWaalsContact O-CE1 3.25Å; D271-H274 PolarHBondContact O-ND1 3.5Å; H274-F276 VanDerWaalsContact C-N 3.3Å
275	F	95.7	Very high	95.4	Very high	89 Å²	89	80 Å²	80	39%	0.39	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-18.3	171.6	-59.6	-64.6	0	0	0	114.3	N273 V339 V342	N273-F275 PolarHBondContact O-N 3.28Å; N273-F275 VanDerWaalsContact O-N 3.12Å; F275-V339 HydrophobicContact CB-CG1 4.37Å; F275-V339 HydrophobicContact CD1-CG1 4.22Å; F275-V339 HydrophobicContact CD2-CG1 3.94Å; F275-V339 HydrophobicContact CE1-CG1 4.5Å; F275-V339 HydrophobicContact CE2-CG1 4.22Å; F275-V339 HydrophobicContact CG-CG1 3.94Å; F275-V339 HydrophobicContact CZ-CG1 4.49Å; F275-V339 HydrophobicContact CZ-CG2 4.38Å; F275-V342 HydrophobicContact CD2-CG1 4.04Å; F275-V342 HydrophobicContact CE2-CB 4.42Å; F275-V342 HydrophobicContact CE2-CG1 4.19Å
276	F	98.1	Very high	95.2	Very high	10 Å²	10	80 Å²	80	4%	0.044	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-8.6	-166.1	-59	-74	0	0	0	114.1	L272 N273 H274 K278 L300 M325 F326 C329 L346	L272-F276 WeakPolarHBondContact O-CD2 3.24Å; N273-F276 WeakPolarHBondContact O-CA 3.49Å; N273-F276 PolarHBondContact O-N 3.49Å; H274-F276 VanDerWaalsContact C-N 3.3Å; F276-K278 VanDerWaalsContact C-N 3.26Å; F276-K278 PolarHBondContact O-N 3.36Å; F276-L300 HydrophobicContact CB-CD1 4.07Å; F276-L300 HydrophobicContact CB-CG 4.31Å; F276-L300 WeakPolarHBondContact O-CB 3.36Å; F276-L300 WeakPolarHBondContact O-CG 3.49Å; F276-L300 PolarHBondContact O-N 2.92Å; F276-M325 HydrophobicContact CB-CE 4.12Å; F276-M325 HydrophobicContact CB-SD 3.85Å; F276-M325 HydrophobicContact CD1-CE 4.02Å; F276-M325 HydrophobicContact CD1-CG 3.77Å; F276-M325 HydrophobicContact CD1-SD 4.01Å; F276-M325 HydrophobicContact CE1-CG 4.49Å; F276-M325 HydrophobicContact CG-CE 4.21Å; F276-M325 HydrophobicContact CG-SD 4.32Å; F276-F326 HydrophobicContact CD1-CE1 4.46Å; F276-F326 HydrophobicContact CE1-CD1 4.01Å; F276-F326 HydrophobicContact CE1-CE1 4.22Å; F276-F326 HydrophobicContact CE2-CE1 4.34Å; F276-F326 HydrophobicContact CZ-CD1 4.11Å; F276-F326 HydrophobicContact CZ-CE1 4.17Å; F276-C329 HydrophobicContact CE1-CB 3.83Å; F276-C329 HydrophobicContact CZ-CB 4.23Å; F276-L346 HydrophobicContact CD2-CD2 3.84Å; F276-L346 HydrophobicContact CE2-CD2 4.43Å; F276-L346 HydrophobicContact CG-CD2 4.42Å
277	L	97.8	Very high	94.9	Very high	65 Å²	65	80.5 Å²	80.5	34%	0.34	42%	0.415	S	S	.	.	S	Bend	trans	-68.7	-17	-175	-77.2	173.4	0	0	0	115	N273 L300 S301	N273-L277 HydrophobicContact CB-CG 4.47Å; N273-L277 WeakPolarHBondContact O-CG 3.23Å; N273-L277 PolarHBondContact O-N 2.9Å; N273-L277 VanDerWaalsContact O-N 3.15Å; L277-L300 HydrophobicContact CD2-CD1 4.12Å; L277-S301 WeakPolarHBondContact O-CB 3.38Å
278	K	96.8	Very high	94.7	Very high	156 Å²	156	81.5 Å²	81.5	68%	0.678	42%	0.419	S	S	*	.	S	Bend	trans	-151	163.6	-172.6	-72.5	-173.1	178.4	-177.4	0	110.4	F276 D299	F276-K278 VanDerWaalsContact C-N 3.26Å; F276-K278 PolarHBondContact O-N 3.36Å; K278-D299 VanDerWaalsContact CA-OD1 3.31Å; K278-D299 WeakPolarHBondContact CA-OD1 3.46Å; K278-D299 VanDerWaalsContact O-CB 3.29Å; K278-D299 WeakPolarHBondContact O-CB 3.39Å
279	P	97.1	Very high	94.7	Very high	76 Å²	76	77.8 Å²	77.8	49%	0.494	41%	0.41	S	S	.	.			trans	-54.3	146.3	167.9	-22.8	32.4	0	0	0	111.7	D281 D299	P279-D281 PolarHBondContact O-N 2.88Å; P279-D299 VanDerWaalsContact CD-CG 3.48Å; P279-D299 WeakPolarHBondContact CD-OD1 3.33Å; P279-D299 WeakPolarHBondContact CD-OD2 3.49Å; P279-D299 WeakPolarHBondContact CG-OD2 3.36Å; P279-D299 VanDerWaalsContact N-CG 3.29Å
280	V	95.3	Very high	94.6	Very high	42 Å²	42	76.4 Å²	76.4	26%	0.255	41%	0.405	S	S	.	.			trans	-66.1	120.7	177.7	177.8	0	0	0	0	109.9	V282 L285 L287 Y290	V280-V282 VanDerWaalsContact C-N 3.31Å; V280-V282 HydrophobicContact CG1-CG1 4.18Å; V280-V282 PolarHBondContact O-N 2.86Å; V280-L285 HydrophobicContact CG1-CD1 4.13Å; V280-L287 HydrophobicContact CG1-CD1 3.85Å; V280-Y290 HydrophobicContact CB-CE1 4.1Å; V280-Y290 HydrophobicContact CB-CE2 4.29Å; V280-Y290 HydrophobicContact CG1-CD2 4.32Å; V280-Y290 HydrophobicContact CG1-CE2 4.19Å; V280-Y290 HydrophobicContact CG2-CE1 4.32Å; V280-Y290 HydrophobicContact CG2-CE2 4.03Å; V280-Y290 WeakPolarHBondContact CG2-OH 3.48Å
281	D	93.6	Very high	94.7	Very high	91 Å²	91	74.2 Å²	74.2	49%	0.487	40%	0.397	S	S	.	.			trans	-78.6	82.2	174.9	-167.9	-23.4	0	0	0	110.2	P279 V283 A284 L285	P279-D281 PolarHBondContact O-N 2.88Å; D281-V283 PolarHBondContact O-N 3.21Å; D281-V283 VanDerWaalsContact O-N 3.15Å; D281-V283 PolarHBondContact OD1-N 2.9Å; D281-A284 HydrophobicContact CB-CB 4.11Å; D281-A284 PolarHBondContact O-N 3.38Å; D281-A284 WeakPolarHBondContact OD1-CB 3.4Å; D281-A284 PolarHBondContact OD1-N 3.42Å; D281-A284 WeakPolarHBondContact OD2-CB 3.42Å; D281-L285 WeakPolarHBondContact O-CB 3.31Å; D281-L285 WeakPolarHBondContact O-CG 3.17Å; D281-L285 PolarHBondContact O-N 3.15Å
282	V	93.5	Very high	94.7	Very high	24 Å²	24	72.9 Å²	72.9	15%	0.145	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.6	-178.9	-56.3	0	0	0	0	113.1	V280 G286 L287 Y290 Y291	V280-V282 VanDerWaalsContact C-N 3.31Å; V280-V282 HydrophobicContact CG1-CG1 4.18Å; V280-V282 PolarHBondContact O-N 2.86Å; V282-G286 CarbonylContact O-C 3.58Å; V282-G286 PolarHBondContact O-N 2.82Å; V282-G286 VanDerWaalsContact O-N 3.14Å; V282-L287 HydrophobicContact CB-CB 4.3Å; V282-L287 HydrophobicContact CG1-CB 4.47Å; V282-L287 PolarHBondContact O-N 3.07Å; V282-Y290 HydrophobicContact CG1-CD1 3.65Å; V282-Y290 HydrophobicContact CG1-CG 3.78Å; V282-Y291 HydrophobicContact CB-CE2 4.36Å; V282-Y291 HydrophobicContact CG1-CD2 4.32Å; V282-Y291 HydrophobicContact CG1-CE2 3.72Å; V282-Y291 HydrophobicContact CG2-CD2 4.4Å; V282-Y291 HydrophobicContact CG2-CE2 3.71Å
283	V	89.3	Confident	94.6	Very high	125 Å²	125	73.3 Å²	73.3	76%	0.758	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-48.6	-179.2	-177.1	0	0	0	0	110	D281 L285 G286	D281-V283 PolarHBondContact O-N 3.21Å; D281-V283 VanDerWaalsContact O-N 3.15Å; D281-V283 PolarHBondContact OD1-N 2.9Å; V283-L285 VanDerWaalsContact C-N 3.25Å; V283-L285 PolarHBondContact O-N 2.84Å; V283-G286 PolarHBondContact O-N 3.34Å
284	A	91.6	Very high	94.4	Very high	79 Å²	79	73.2 Å²	73.2	65%	0.653	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-26.5	177.2	0	0	0	0	0	113.1	D281	D281-A284 HydrophobicContact CB-CB 4.11Å; D281-A284 PolarHBondContact O-N 3.38Å; D281-A284 WeakPolarHBondContact OD1-CB 3.4Å; D281-A284 PolarHBondContact OD1-N 3.42Å; D281-A284 WeakPolarHBondContact OD2-CB 3.42Å
285	L	91.7	Very high	94.4	Very high	112 Å²	112	74.2 Å²	74.2	59%	0.586	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-6.3	178.9	-62.3	173.2	0	0	0	114.2	V280 D281 V283 L287	V280-L285 HydrophobicContact CG1-CD1 4.13Å; D281-L285 WeakPolarHBondContact O-CB 3.31Å; D281-L285 WeakPolarHBondContact O-CG 3.17Å; D281-L285 PolarHBondContact O-N 3.15Å; V283-L285 VanDerWaalsContact C-N 3.25Å; V283-L285 PolarHBondContact O-N 2.84Å; L285-L287 VanDerWaalsContact C-N 3.31Å; L285-L287 HydrophobicContact CB-CD1 3.77Å; L285-L287 HydrophobicContact CB-CD2 4.35Å; L285-L287 HydrophobicContact CB-CG 3.63Å; L285-L287 HydrophobicContact CD1-CD1 3.92Å; L285-L287 PolarHBondContact O-N 2.96Å
286	G	92.5	Very high	94.4	Very high	39 Å²	39	75.1 Å²	75.1	40%	0.402	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	21.8	-179.6	0	0	0	0	0	115.2	V282 V283 H288	V282-G286 CarbonylContact O-C 3.58Å; V282-G286 PolarHBondContact O-N 2.82Å; V282-G286 VanDerWaalsContact O-N 3.14Å; V283-G286 PolarHBondContact O-N 3.34Å; G286-H288 VanDerWaalsContact C-N 3.29Å; G286-H288 PolarHBondContact O-CD2 2.81Å; G286-H288 VanDerWaalsContact O-CD2 3.22Å; G286-H288 PolarHBondContact O-N 3.22Å
287	L	91.5	Very high	94.3	Very high	43 Å²	43	76.7 Å²	76.7	23%	0.225	42%	0.416	C	S	.	.			trans	-87	63.7	-171.8	-53.5	178.8	0	0	0	111.5	V280 V282 L285 D289 Y290 Y332	V280-L287 HydrophobicContact CG1-CD1 3.85Å; V282-L287 HydrophobicContact CB-CB 4.3Å; V282-L287 HydrophobicContact CG1-CB 4.47Å; V282-L287 PolarHBondContact O-N 3.07Å; L285-L287 VanDerWaalsContact C-N 3.31Å; L285-L287 HydrophobicContact CB-CD1 3.77Å; L285-L287 HydrophobicContact CB-CD2 4.35Å; L285-L287 HydrophobicContact CB-CG 3.63Å; L285-L287 HydrophobicContact CD1-CD1 3.92Å; L285-L287 PolarHBondContact O-N 2.96Å; L287-D289 PolarHBondContact O-N 3.05Å; L287-D289 VanDerWaalsContact O-N 3.17Å; L287-Y290 VanDerWaalsContact O-CB 3.31Å; L287-Y290 WeakPolarHBondContact O-CB 3.13Å; L287-Y290 PolarHBondContact O-N 3.35Å; L287-Y290 VanDerWaalsContact O-N 3.09Å; L287-Y332 HydrophobicContact CD1-CE1 4.07Å; L287-Y332 HydrophobicContact CD2-CE1 4.24Å
288	H	90.9	Very high	94.3	Very high	166 Å²	166	74.6 Å²	74.6	77%	0.769	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.4	-172.5	-61.5	-65.3	0	0	0	114.3	G286	G286-H288 VanDerWaalsContact C-N 3.29Å; G286-H288 PolarHBondContact O-CD2 2.81Å; G286-H288 VanDerWaalsContact O-CD2 3.22Å; G286-H288 PolarHBondContact O-N 3.22Å
289	D	95.7	Very high	94.4	Very high	76 Å²	76	67.3 Å²	67.3	41%	0.406	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-2.9	-179.2	70.6	-33	0	0	0	113.9	L287 Y291 D292 V293 Y332	L287-D289 PolarHBondContact O-N 3.05Å; L287-D289 VanDerWaalsContact O-N 3.17Å; D289-Y291 VanDerWaalsContact C-N 3.32Å; D289-Y291 PolarHBondContact O-N 2.8Å; D289-D292 WeakPolarHBondContact O-CA 3.47Å; D289-D292 WeakPolarHBondContact O-CB 3.44Å; D289-D292 PolarHBondContact O-N 3.08Å; D289-V293 PolarHBondContact O-N 3.36Å; D289-V293 VanDerWaalsContact O-N 3.1Å; D289-Y332 WeakPolarHBondContact OD1-CE2 3.49Å; D289-Y332 PolarHBondContact OD1-OH 3.38Å
290	Y	95.6	Very high	94.4	Very high	15 Å²	15	63.8 Å²	63.8	6%	0.059	35%	0.35	C	S	.	.	H	α-helix	trans	-55.5	-45.3	-172.6	-177.9	-96	0	0	0	112.5	V280 V282 L287 D292 V293 V294 A297 Y332	V280-Y290 HydrophobicContact CB-CE1 4.1Å; V280-Y290 HydrophobicContact CB-CE2 4.29Å; V280-Y290 HydrophobicContact CG1-CD2 4.32Å; V280-Y290 HydrophobicContact CG1-CE2 4.19Å; V280-Y290 HydrophobicContact CG2-CE1 4.32Å; V280-Y290 HydrophobicContact CG2-CE2 4.03Å; V280-Y290 WeakPolarHBondContact CG2-OH 3.48Å; V282-Y290 HydrophobicContact CG1-CD1 3.65Å; V282-Y290 HydrophobicContact CG1-CG 3.78Å; L287-Y290 VanDerWaalsContact O-CB 3.31Å; L287-Y290 WeakPolarHBondContact O-CB 3.13Å; L287-Y290 PolarHBondContact O-N 3.35Å; L287-Y290 VanDerWaalsContact O-N 3.09Å; Y290-D292 VanDerWaalsContact C-N 3.31Å; Y290-D292 PolarHBondContact O-N 3.47Å; Y290-V293 PolarHBondContact O-N 2.59Å; Y290-V294 HydrophobicContact CD1-CB 4.34Å; Y290-V294 HydrophobicContact CD2-CG2 4.33Å; Y290-V294 HydrophobicContact CE1-CB 3.95Å; Y290-V294 HydrophobicContact CE1-CG1 3.96Å; Y290-V294 HydrophobicContact CE1-CG2 4.32Å; Y290-V294 HydrophobicContact CE2-CB 4.39Å; Y290-V294 HydrophobicContact CE2-CG2 3.86Å; Y290-V294 WeakPolarHBondContact O-CA 3.28Å; Y290-V294 VanDerWaalsContact O-CB 3.3Å; Y290-V294 WeakPolarHBondContact O-CB 3.45Å; Y290-V294 PolarHBondContact O-N 3.03Å; Y290-A297 HydrophobicContact CE1-CB 4.38Å; Y290-Y332 AromaticContact CD2-CD1 3.71Å; Y290-Y332 HydrophobicContact CD2-CD1 3.71Å; Y290-Y332 AromaticContact CD2-CD2 3.88Å; Y290-Y332 HydrophobicContact CD2-CD2 3.88Å; Y290-Y332 AromaticContact CD2-CE1 3.85Å; Y290-Y332 HydrophobicContact CD2-CE1 3.85Å; Y290-Y332 HydrophobicContact CD2-CE2 4.04Å; Y290-Y332 AromaticContact CD2-CG 3.73Å; Y290-Y332 HydrophobicContact CD2-CG 3.73Å; Y290-Y332 HydrophobicContact CE2-CD1 4.04Å; Y290-Y332 HydrophobicContact CE2-CG 4.02Å
291	Y	96.1	Very high	94.6	Very high	101 Å²	101	64 Å²	64	40%	0.396	35%	0.353	S	S	.	.	H	α-helix	trans	-79.3	-11	177.4	-62.1	-58.7	0	0	0	113.9	V282 D289 K295 A297	V282-Y291 HydrophobicContact CB-CE2 4.36Å; V282-Y291 HydrophobicContact CG1-CD2 4.32Å; V282-Y291 HydrophobicContact CG1-CE2 3.72Å; V282-Y291 HydrophobicContact CG2-CD2 4.4Å; V282-Y291 HydrophobicContact CG2-CE2 3.71Å; D289-Y291 VanDerWaalsContact C-N 3.32Å; D289-Y291 PolarHBondContact O-N 2.8Å; Y291-K295 PolarHBondContact O-NZ 2.87Å; Y291-A297 HydrophobicContact CE1-CB 4.09Å
292	D	95.9	Very high	94.8	Very high	91 Å²	91	61.9 Å²	61.9	49%	0.487	34%	0.344	S	S	.	.	H	α-helix	trans	-76	-33.4	168.3	-73.7	-44.1	0	0	0	111.6	D289 Y290 K295	D289-D292 WeakPolarHBondContact O-CA 3.47Å; D289-D292 WeakPolarHBondContact O-CB 3.44Å; D289-D292 PolarHBondContact O-N 3.08Å; Y290-D292 VanDerWaalsContact C-N 3.31Å; Y290-D292 PolarHBondContact O-N 3.47Å; D292-K295 VanDerWaalsContact CA-NZ 3.35Å; D292-K295 WeakPolarHBondContact O-CE 3.48Å; D292-K295 PolarHBondContact O-NZ 2.93Å; D292-K295 IonicContact OD1-NZ 2.7Å
293	V	94.6	Very high	95	Very high	40 Å²	40	60.8 Å²	60.8	24%	0.242	34%	0.337	C	S	.	.	H	α-helix	trans	-88.2	-50.4	174.8	-177.6	0	0	0	0	112.5	D289 Y290 K331 Y332	D289-V293 PolarHBondContact O-N 3.36Å; D289-V293 VanDerWaalsContact O-N 3.1Å; Y290-V293 PolarHBondContact O-N 2.59Å; V293-K331 HydrophobicContact CG1-CD 4.12Å; V293-K331 HydrophobicContact CG1-CG 3.95Å; V293-K331 WeakPolarHBondContact O-CE 3.18Å; V293-K331 PolarHBondContact O-NZ 3.46Å; V293-Y332 HydrophobicContact CB-CD2 3.91Å; V293-Y332 HydrophobicContact CG1-CD2 4.16Å; V293-Y332 HydrophobicContact CG2-CD2 4.12Å; V293-Y332 HydrophobicContact CG2-CE2 4.36Å
294	V	94.9	Very high	95.4	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.012	32%	0.321	C	S	.	.			trans	-94.2	106	-174.7	174.7	0	0	0	0	110.5	Y290 A297 N328	Y290-V294 HydrophobicContact CD1-CB 4.34Å; Y290-V294 HydrophobicContact CD2-CG2 4.33Å; Y290-V294 HydrophobicContact CE1-CB 3.95Å; Y290-V294 HydrophobicContact CE1-CG1 3.96Å; Y290-V294 HydrophobicContact CE1-CG2 4.32Å; Y290-V294 HydrophobicContact CE2-CB 4.39Å; Y290-V294 HydrophobicContact CE2-CG2 3.86Å; Y290-V294 WeakPolarHBondContact O-CA 3.28Å; Y290-V294 VanDerWaalsContact O-CB 3.3Å; Y290-V294 WeakPolarHBondContact O-CB 3.45Å; Y290-V294 PolarHBondContact O-N 3.03Å; V294-A297 HydrophobicContact CG1-CB 4.24Å; V294-N328 HydrophobicContact CG1-CB 3.96Å; V294-N328 HydrophobicContact CG2-CB 4.17Å
295	K	95.2	Very high	95.6	Very high	117 Å²	117	60 Å²	60	51%	0.509	32%	0.316	S	S	.	.	S	Bend	trans	-90.8	-17.8	-173	-62.1	-55.9	-178.2	-167.4	0	115.7	Y291 D292	Y291-K295 PolarHBondContact O-NZ 2.87Å; D292-K295 VanDerWaalsContact CA-NZ 3.35Å; D292-K295 WeakPolarHBondContact O-CE 3.48Å; D292-K295 PolarHBondContact O-NZ 2.93Å; D292-K295 IonicContact OD1-NZ 2.7Å
296	K	94.4	Very high	95.9	Very high	108 Å²	108	56.5 Å²	56.5	47%	0.47	30%	0.296	S	S	.	.	S	Bend	trans	-138.6	83.6	172.4	-175.4	-171.8	155.6	-156.7	0	107.8	D321 L324 N328	K296-D321 WeakPolarHBondContact CE-OD1 3.31Å; K296-D321 IonicContact NZ-OD1 2.65Å; K296-D321 PolarHBondContact NZ-OD1 3.16Å; K296-L324 HydrophobicContact CB-CD2 4.14Å; K296-L324 HydrophobicContact CD-CD2 3.38Å; K296-L324 HydrophobicContact CG-CD2 3.73Å; K296-L324 VanDerWaalsContact NZ-CD2 3.3Å; K296-N328 PolarHBondContact O-ND2 2.77Å
297	A	96.1	Very high	96	Very high	43 Å²	43	54.8 Å²	54.8	36%	0.355	28%	0.277	S	S	.	.			trans	-58.4	147.1	176.5	0	0	0	0	0	110.8	Y290 Y291 V294	Y290-A297 HydrophobicContact CE1-CB 4.38Å; Y291-A297 HydrophobicContact CE1-CB 4.09Å; V294-A297 HydrophobicContact CG1-CB 4.24Å
298	M	98.2	Very high	96	Very high	20 Å²	20	58.7 Å²	58.7	10%	0.099	30%	0.295	C	S	.	.			trans	-157.5	146.7	-177	-168.5	54.1	59.3	0	0	110.1	T302 I303 D321 L324 M325	M298-T302 HydrophobicContact CE-CG2 4.08Å; M298-T302 HydrophobicContact SD-CG2 3.6Å; M298-T302 VanDerWaalsContact SD-CG2 3.6Å; M298-I303 HydrophobicContact CG-CD1 3.93Å; M298-I303 HydrophobicContact CG-CG1 3.82Å; M298-I303 HydrophobicContact SD-CD1 4.37Å; M298-I303 HydrophobicContact SD-CG1 3.58Å; M298-I303 VanDerWaalsContact SD-CG1 3.58Å; M298-D321 HydrophobicContact CE-CB 4.35Å; M298-D321 HydrophobicContact CG-CB 4.04Å; M298-D321 VanDerWaalsContact CG-O 3.32Å; M298-D321 WeakPolarHBondContact CG-O 3.37Å; M298-D321 HydrophobicContact SD-CB 4.15Å; M298-L324 HydrophobicContact CB-CD2 4.17Å; M298-L324 HydrophobicContact CB-CG 4.26Å; M298-M325 HydrophobicContact CB-CB 4.18Å; M298-M325 HydrophobicContact CG-CB 4.24Å; M298-M325 WeakPolarHBondContact O-CG 3.45Å
299	D	98.5	Very high	95.9	Very high	4 Å²	4	54 Å²	54	2%	0.021	28%	0.281	C	S	.	.			trans	-155.9	165.4	-177.2	73.1	95.1	0	0	0	110.9	K278 P279 S301 T302 I303	K278-D299 VanDerWaalsContact CA-OD1 3.31Å; K278-D299 WeakPolarHBondContact CA-OD1 3.46Å; K278-D299 VanDerWaalsContact O-CB 3.29Å; K278-D299 WeakPolarHBondContact O-CB 3.39Å; P279-D299 VanDerWaalsContact CD-CG 3.48Å; P279-D299 WeakPolarHBondContact CD-OD1 3.33Å; P279-D299 WeakPolarHBondContact CD-OD2 3.49Å; P279-D299 WeakPolarHBondContact CG-OD2 3.36Å; P279-D299 VanDerWaalsContact N-CG 3.29Å; D299-S301 VanDerWaalsContact C-N 3.29Å; D299-S301 PolarHBondContact O-N 3.25Å; D299-S301 VanDerWaalsContact OD1-CA 3.31Å; D299-S301 WeakPolarHBondContact OD1-CA 3.43Å; D299-S301 VanDerWaalsContact OD1-CB 3.28Å; D299-S301 WeakPolarHBondContact OD1-CB 3.48Å; D299-S301 PolarHBondContact OD1-N 2.83Å; D299-S301 PolarHBondContact OD1-OG 2.65Å; D299-T302 PolarHBondContact O-N 3.18Å; D299-T302 PolarHBondContact OD1-N 2.96Å; D299-T302 VanDerWaalsContact OD1-N 3.08Å; D299-T302 WeakPolarHBondContact OD2-CB 3.43Å; D299-T302 PolarHBondContact OD2-OG1 2.65Å; D299-I303 VanDerWaalsContact O-CG1 3.27Å; D299-I303 WeakPolarHBondContact O-CG1 3.37Å; D299-I303 PolarHBondContact O-N 3.45Å
300	L	98.5	Very high	95.5	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-30.1	-175.6	-64	171.3	0	0	0	113.9	L261 I264 N273 F276 L277 K304 M325	L261-L300 HydrophobicContact CD1-CD2 3.83Å; I264-L300 HydrophobicContact CD1-CD2 3.67Å; I264-L300 HydrophobicContact CG1-CD2 3.96Å; N273-L300 HydrophobicContact CB-CD1 4.4Å; F276-L300 HydrophobicContact CB-CD1 4.07Å; F276-L300 HydrophobicContact CB-CG 4.31Å; F276-L300 WeakPolarHBondContact O-CB 3.36Å; F276-L300 WeakPolarHBondContact O-CG 3.49Å; F276-L300 PolarHBondContact O-N 2.92Å; L277-L300 HydrophobicContact CD2-CD1 4.12Å; L300-K304 VanDerWaalsContact O-CB 3.3Å; L300-K304 WeakPolarHBondContact O-CB 3.17Å; L300-K304 PolarHBondContact O-N 3.33Å; L300-M325 HydrophobicContact CD2-CE 3.95Å; L300-M325 HydrophobicContact CD2-SD 3.96Å; L300-M325 HydrophobicContact CG-CE 4.26Å; L300-M325 HydrophobicContact CG-SD 3.83Å
301	S	97.9	Very high	95.4	Very high	45 Å²	45	55.8 Å²	55.8	32%	0.315	29%	0.293	S	S	.	.	H	α-helix	trans	-77.1	-35.5	177.1	77.6	0	0	0	0	112.5	L277 D299 T305	L277-S301 WeakPolarHBondContact O-CB 3.38Å; D299-S301 VanDerWaalsContact C-N 3.29Å; D299-S301 PolarHBondContact O-N 3.25Å; D299-S301 VanDerWaalsContact OD1-CA 3.31Å; D299-S301 WeakPolarHBondContact OD1-CA 3.43Å; D299-S301 VanDerWaalsContact OD1-CB 3.28Å; D299-S301 WeakPolarHBondContact OD1-CB 3.48Å; D299-S301 PolarHBondContact OD1-N 2.83Å; D299-S301 PolarHBondContact OD1-OG 2.65Å; S301-T305 WeakPolarHBondContact O-CB 3.12Å; S301-T305 PolarHBondContact O-N 3.07Å; S301-T305 PolarHBondContact O-OG1 3.35Å
302	T	98.1	Very high	95.3	Very high	48 Å²	48	51.3 Å²	51.3	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-65.8	-47.2	169.8	-63.7	0	0	0	0	111	M298 D299 K304 T305 K306	M298-T302 HydrophobicContact CE-CG2 4.08Å; M298-T302 HydrophobicContact SD-CG2 3.6Å; M298-T302 VanDerWaalsContact SD-CG2 3.6Å; D299-T302 PolarHBondContact O-N 3.18Å; D299-T302 PolarHBondContact OD1-N 2.96Å; D299-T302 VanDerWaalsContact OD1-N 3.08Å; D299-T302 WeakPolarHBondContact OD2-CB 3.43Å; D299-T302 PolarHBondContact OD2-OG1 2.65Å; T302-K304 VanDerWaalsContact C-N 3.3Å; T302-K304 PolarHBondContact O-N 2.88Å; T302-T305 WeakPolarHBondContact O-CB 3.23Å; T302-T305 PolarHBondContact O-N 3.02Å; T302-K306 WeakPolarHBondContact O-CG 3.37Å; T302-K306 PolarHBondContact O-N 2.98Å
303	I	98.6	Very high	95	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-43.6	176.5	-65.5	166.4	0	0	0	110.8	L261 M298 D299 T305 K306 L307 Y312 F318 D321 V322 M325	L261-I303 HydrophobicContact CD1-CB 4.37Å; L261-I303 HydrophobicContact CD1-CG2 3.89Å; L261-I303 HydrophobicContact CD2-CG2 4.06Å; M298-I303 HydrophobicContact CG-CD1 3.93Å; M298-I303 HydrophobicContact CG-CG1 3.82Å; M298-I303 HydrophobicContact SD-CD1 4.37Å; M298-I303 HydrophobicContact SD-CG1 3.58Å; M298-I303 VanDerWaalsContact SD-CG1 3.58Å; D299-I303 VanDerWaalsContact O-CG1 3.27Å; D299-I303 WeakPolarHBondContact O-CG1 3.37Å; D299-I303 PolarHBondContact O-N 3.45Å; I303-T305 PolarHBondContact O-N 3.26Å; I303-K306 PolarHBondContact O-N 3.36Å; I303-L307 WeakPolarHBondContact O-CB 3.27Å; I303-L307 PolarHBondContact O-N 2.7Å; I303-Y312 HydrophobicContact CG2-CE2 4.21Å; I303-F318 HydrophobicContact CG2-CD2 3.79Å; I303-F318 HydrophobicContact CG2-CE2 3.65Å; I303-D321 HydrophobicContact CD1-CB 4.44Å; I303-D321 HydrophobicContact CG1-CB 4.08Å; I303-V322 HydrophobicContact CD1-CB 4.39Å; I303-V322 HydrophobicContact CD1-CG2 3.84Å; I303-V322 HydrophobicContact CG2-CG2 4.25Å; I303-M325 HydrophobicContact CD1-SD 4.28Å
304	K	97.7	Very high	94.9	Very high	101 Å²	101	54.8 Å²	54.8	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-59.2	-46.6	174.2	-177.5	-172.6	169.1	-169	0	112	L261 L300 T302 K306 L307 E308	L261-K304 HydrophobicContact CD2-CB 3.82Å; L261-K304 HydrophobicContact CD2-CG 4.36Å; L300-K304 VanDerWaalsContact O-CB 3.3Å; L300-K304 WeakPolarHBondContact O-CB 3.17Å; L300-K304 PolarHBondContact O-N 3.33Å; T302-K304 VanDerWaalsContact C-N 3.3Å; T302-K304 PolarHBondContact O-N 2.88Å; K304-K306 VanDerWaalsContact C-N 3.32Å; K304-K306 PolarHBondContact O-N 3.37Å; K304-L307 PolarHBondContact O-N 3.48Å; K304-E308 WeakPolarHBondContact CE-OE1 3.47Å; K304-E308 WeakPolarHBondContact CE-OE2 3.46Å; K304-E308 HydrophobicContact CG-CG 4.36Å; K304-E308 IonicContact NZ-OE1 3.74Å; K304-E308 WeakPolarHBondContact O-CB 3.08Å; K304-E308 WeakPolarHBondContact O-CG 3.42Å; K304-E308 PolarHBondContact O-N 3.02Å
305	T	96.2	Very high	94.9	Very high	87 Å²	87	55.2 Å²	55.2	53%	0.534	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-39.4	179.6	-56.1	0	0	0	0	111.4	S301 T302 I303 S309	S301-T305 WeakPolarHBondContact O-CB 3.12Å; S301-T305 PolarHBondContact O-N 3.07Å; S301-T305 PolarHBondContact O-OG1 3.35Å; T302-T305 WeakPolarHBondContact O-CB 3.23Å; T302-T305 PolarHBondContact O-N 3.02Å; I303-T305 PolarHBondContact O-N 3.26Å; T305-S309 WeakPolarHBondContact O-CB 3.27Å; T305-S309 PolarHBondContact O-N 3.07Å; T305-S309 PolarHBondContact O-OG 3.01Å
306	K	96.8	Very high	95	Very high	39 Å²	39	55.1 Å²	55.1	17%	0.17	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-42.9	173.8	-73.1	-166.4	62.4	-179	0	112.9	T302 I303 K304 S309 G310 Q311 Y312 D321	T302-K306 WeakPolarHBondContact O-CG 3.37Å; T302-K306 PolarHBondContact O-N 2.98Å; I303-K306 PolarHBondContact O-N 3.36Å; K304-K306 VanDerWaalsContact C-N 3.32Å; K304-K306 PolarHBondContact O-N 3.37Å; K306-S309 PolarHBondContact O-OG 3.21Å; K306-G310 PolarHBondContact O-N 3.48Å; K306-G310 VanDerWaalsContact O-N 3.08Å; K306-Q311 HydrophobicContact CB-CB 4.11Å; K306-Q311 HydrophobicContact CG-CB 4.4Å; K306-Q311 PolarHBondContact O-N 2.97Å; K306-Y312 HydrophobicContact CB-CD2 4.31Å; K306-Y312 HydrophobicContact CB-CE1 4.32Å; K306-Y312 HydrophobicContact CB-CE2 3.54Å; K306-Y312 HydrophobicContact CD-CE1 4.34Å; K306-D321 WeakPolarHBondContact CD-OD2 3.43Å; K306-D321 WeakPolarHBondContact CE-OD2 3.28Å; K306-D321 IonicContact NZ-OD1 2.96Å; K306-D321 IonicContact NZ-OD2 3.87Å; K306-D321 PolarHBondContact NZ-OD2 3.07Å
307	L	94.6	Very high	95	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-68.4	-42.5	177.6	-175.7	61.8	0	0	0	112.4	L250 L254 L261 I303 K304 S309 G310 Y312 F318	L250-L307 HydrophobicContact CD1-CD1 4.2Å; L250-L307 HydrophobicContact CD1-CG 4.38Å; L250-L307 HydrophobicContact CD2-CD1 4.23Å; L254-L307 HydrophobicContact CB-CD1 4.45Å; L254-L307 HydrophobicContact CD2-CD1 3.92Å; L261-L307 HydrophobicContact CD2-CD2 4.06Å; I303-L307 WeakPolarHBondContact O-CB 3.27Å; I303-L307 PolarHBondContact O-N 2.7Å; K304-L307 PolarHBondContact O-N 3.48Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-S309 PolarHBondContact O-N 3.47Å; L307-G310 PolarHBondContact O-N 2.83Å; L307-Y312 HydrophobicContact CB-CD2 3.85Å; L307-Y312 HydrophobicContact CB-CE2 3.98Å; L307-Y312 HydrophobicContact CD1-CD2 3.96Å; L307-F318 HydrophobicContact CD2-CE2 4.49Å
308	E	91	Very high	95.1	Very high	125 Å²	125	50.3 Å²	50.3	58%	0.584	26%	0.262	S	S	*	.	H	α-helix	trans	-71	-24.5	178.7	-71.2	-178.3	169.5	0	0	112.9	K304	K304-E308 WeakPolarHBondContact CE-OE1 3.47Å; K304-E308 WeakPolarHBondContact CE-OE2 3.46Å; K304-E308 HydrophobicContact CG-CG 4.36Å; K304-E308 IonicContact NZ-OE1 3.74Å; K304-E308 WeakPolarHBondContact O-CB 3.08Å; K304-E308 WeakPolarHBondContact O-CG 3.42Å; K304-E308 PolarHBondContact O-N 3.02Å
309	S	88.7	Confident	95.1	Very high	68 Å²	68	49.4 Å²	49.4	48%	0.476	26%	0.258	S	S	.	.	H	α-helix	trans	-91.2	-9.1	174.1	56.8	0	0	0	0	114.9	T305 K306 L307 Q311	T305-S309 WeakPolarHBondContact O-CB 3.27Å; T305-S309 PolarHBondContact O-N 3.07Å; T305-S309 PolarHBondContact O-OG 3.01Å; K306-S309 PolarHBondContact O-OG 3.21Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-S309 PolarHBondContact O-N 3.47Å; S309-Q311 PolarHBondContact OG-NE2 3.21Å
310	G	88.7	Confident	95.1	Very high	23 Å²	23	53.8 Å²	53.8	24%	0.237	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	27.9	176.7	0	0	0	0	0	115.5	K306 L307 Y312	K306-G310 PolarHBondContact O-N 3.48Å; K306-G310 VanDerWaalsContact O-N 3.08Å; L307-G310 PolarHBondContact O-N 2.83Å; G310-Y312 VanDerWaalsContact C-N 3.27Å
311	Q	92.3	Very high	95.1	Very high	105 Å²	105	53.9 Å²	53.9	49%	0.491	28%	0.282	S	S	.	.			trans	-81.6	-2.1	176.9	-64	178.3	50.5	0	0	114	K306 S309	K306-Q311 HydrophobicContact CB-CB 4.11Å; K306-Q311 HydrophobicContact CG-CB 4.4Å; K306-Q311 PolarHBondContact O-N 2.97Å; S309-Q311 PolarHBondContact OG-NE2 3.21Å
312	Y	93.9	Very high	95.2	Very high	7 Å²	7	51.8 Å²	51.8	3%	0.027	27%	0.267	C	S	.	.			trans	-108.8	129.3	170.2	-56	-53.7	0	0	0	108.3	L254 I303 K306 L307 G310 D317 F318 D321	L254-Y312 WeakPolarHBondContact CD1-O 3.14Å; I303-Y312 HydrophobicContact CG2-CE2 4.21Å; K306-Y312 HydrophobicContact CB-CD2 4.31Å; K306-Y312 HydrophobicContact CB-CE1 4.32Å; K306-Y312 HydrophobicContact CB-CE2 3.54Å; K306-Y312 HydrophobicContact CD-CE1 4.34Å; L307-Y312 HydrophobicContact CB-CD2 3.85Å; L307-Y312 HydrophobicContact CB-CE2 3.98Å; L307-Y312 HydrophobicContact CD1-CD2 3.96Å; G310-Y312 VanDerWaalsContact C-N 3.27Å; Y312-D317 VanDerWaalsContact CD1-C 3.47Å; Y312-D317 HydrophobicContact CD1-CB 3.72Å; Y312-D317 WeakPolarHBondContact CD1-O 3.3Å; Y312-D317 WeakPolarHBondContact CE1-O 3.15Å; Y312-D317 HydrophobicContact CG-CB 4.41Å; Y312-F318 HydrophobicContact CD1-CB 4.29Å; Y312-F318 HydrophobicContact CD2-CB 3.93Å; Y312-F318 HydrophobicContact CD2-CD2 4.26Å; Y312-F318 HydrophobicContact CE2-CB 4.26Å; Y312-F318 HydrophobicContact CE2-CD2 4.04Å; Y312-F318 HydrophobicContact CG-CB 3.95Å; Y312-D321 HydrophobicContact CE1-CB 4.3Å; Y312-D321 VanDerWaalsContact CE1-OD2 3.22Å; Y312-D321 WeakPolarHBondContact CE1-OD2 3.5Å; Y312-D321 WeakPolarHBondContact OH-CB 3.26Å; Y312-D321 PolarHBondContact OH-OD2 3.15Å
313	H	89.7	Confident	95.2	Very high	149 Å²	149	53.1 Å²	53.1	69%	0.69	27%	0.266	S	S	*	.	S	Bend	trans	-101.9	-32.9	179.2	-55.3	-38.8	0	0	0	111.2	D317	H313-D317 WeakPolarHBondContact CA-OD2 3.46Å; H313-D317 WeakPolarHBondContact CB-OD2 3.43Å; H313-D317 PolarHBondContact N-OD2 3.21Å
314	T	92.4	Very high	95.2	Very high	55 Å²	55	54.7 Å²	54.7	34%	0.337	28%	0.275	S	S	.	.	S	Bend	trans	-121.1	166.7	174.8	84.9	0	0	0	0	111.8	L254 Y316 D317	L254-T314 WeakPolarHBondContact CD2-O 3.37Å; T314-Y316 PolarHBondContact O-N 2.81Å; T314-Y316 WeakPolarHBondContact OG1-CB 3.4Å; T314-Y316 PolarHBondContact OG1-N 3.19Å; T314-D317 PolarHBondContact N-OD2 3.34Å; T314-D317 PolarHBondContact OG1-N 3.08Å; T314-D317 PolarHBondContact OG1-OD1 3.25Å
315	K	95.4	Very high	95.2	Very high	10 Å²	10	50.1 Å²	50.1	4%	0.043	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-26.3	170.2	69.9	176.3	-172.3	-166.7	0	113.4	A253 A319 F354 V357 P358 D359	A253-K315 HydrophobicContact CB-CB 3.85Å; A253-K315 HydrophobicContact CB-CD 4.05Å; A253-K315 HydrophobicContact CB-CG 4.33Å; K315-A319 PolarHBondContact O-N 2.8Å; K315-A319 VanDerWaalsContact O-N 3.15Å; K315-F354 HydrophobicContact CB-CE2 3.99Å; K315-F354 HydrophobicContact CB-CZ 4.01Å; K315-F354 HydrophobicContact CD-CE2 4.41Å; K315-F354 HydrophobicContact CD-CZ 4Å; K315-F354 HydrophobicContact CG-CE2 4.28Å; K315-F354 HydrophobicContact CG-CZ 3.81Å; K315-F354 WeakPolarHBondContact O-CE2 2.97Å; K315-F354 WeakPolarHBondContact O-CZ 3.39Å; K315-V357 HydrophobicContact CB-CG1 4.46Å; K315-V357 HydrophobicContact CD-CB 4.29Å; K315-V357 HydrophobicContact CD-CG1 3.73Å; K315-V357 PolarHBondContact NZ-O 3.06Å; K315-P358 WeakPolarHBondContact CD-O 3.27Å; K315-P358 PolarHBondContact NZ-O 2.98Å; K315-D359 WeakPolarHBondContact CE-OD1 3.45Å; K315-D359 IonicContact NZ-OD1 2.66Å; K315-D359 PolarHBondContact NZ-OD1 2.99Å; K315-D359 IonicContact NZ-OD2 3.93Å; K315-D359 PolarHBondContact NZ-OD2 3.17Å
316	Y	97	Very high	95.3	Very high	115 Å²	115	46 Å²	46	45%	0.451	23%	0.229	S	C	.	.	H	α-helix	trans	-73.5	-42.2	-178.7	-59.5	-71.7	0	0	0	111.6	T314 F318 A319 D320 F354 D359	T314-Y316 PolarHBondContact O-N 2.81Å; T314-Y316 WeakPolarHBondContact OG1-CB 3.4Å; T314-Y316 PolarHBondContact OG1-N 3.19Å; Y316-F318 PolarHBondContact O-N 2.68Å; Y316-F318 VanDerWaalsContact O-N 3.12Å; Y316-A319 CarbonylContact O-C 3.46Å; Y316-A319 WeakPolarHBondContact O-CA 3.41Å; Y316-A319 PolarHBondContact O-N 2.66Å; Y316-D320 PolarHBondContact O-N 3.1Å; Y316-F354 HydrophobicContact CD1-CE1 4.47Å; Y316-F354 HydrophobicContact CD1-CZ 4.41Å; Y316-D359 PolarHBondContact OH-OD1 2.85Å
317	D	95.9	Very high	95.4	Very high	51 Å²	51	48.4 Å²	48.4	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-55.4	-35.8	176.7	-39.2	-10.3	0	0	0	112.1	Y312 H313 T314	Y312-D317 VanDerWaalsContact CD1-C 3.47Å; Y312-D317 HydrophobicContact CD1-CB 3.72Å; Y312-D317 WeakPolarHBondContact CD1-O 3.3Å; Y312-D317 WeakPolarHBondContact CE1-O 3.15Å; Y312-D317 HydrophobicContact CG-CB 4.41Å; H313-D317 WeakPolarHBondContact CA-OD2 3.46Å; H313-D317 WeakPolarHBondContact CB-OD2 3.43Å; H313-D317 PolarHBondContact N-OD2 3.21Å; T314-D317 PolarHBondContact N-OD2 3.34Å; T314-D317 PolarHBondContact OG1-N 3.08Å; T314-D317 PolarHBondContact OG1-OD1 3.25Å
318	F	98	Very high	95.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-71.6	-46	174.4	159.6	-96.3	0	0	0	111.7	C257 L261 I303 L307 Y312 Y316 D320 D321 V322 F350 F354	C257-F318 HydrophobicContact CB-CD1 3.48Å; C257-F318 VanDerWaalsContact CB-CD1 3.48Å; C257-F318 HydrophobicContact CB-CD2 4.29Å; C257-F318 HydrophobicContact CB-CE1 3.45Å; C257-F318 VanDerWaalsContact CB-CE1 3.45Å; C257-F318 HydrophobicContact CB-CE2 4.27Å; C257-F318 HydrophobicContact CB-CG 3.91Å; C257-F318 HydrophobicContact CB-CZ 3.87Å; C257-F318 WeakPolarHBondContact O-CZ 3.23Å; C257-F318 WeakPolarHBondContact SG-CD1 3.33Å; L261-F318 HydrophobicContact CB-CE2 4.1Å; L261-F318 HydrophobicContact CB-CZ 4.15Å; L261-F318 HydrophobicContact CD1-CE2 4.35Å; L261-F318 HydrophobicContact CD2-CE2 4.24Å; L261-F318 HydrophobicContact CG-CE2 4.46Å; I303-F318 HydrophobicContact CG2-CD2 3.79Å; I303-F318 HydrophobicContact CG2-CE2 3.65Å; L307-F318 HydrophobicContact CD2-CE2 4.49Å; Y312-F318 HydrophobicContact CD1-CB 4.29Å; Y312-F318 HydrophobicContact CD2-CB 3.93Å; Y312-F318 HydrophobicContact CD2-CD2 4.26Å; Y312-F318 HydrophobicContact CE2-CB 4.26Å; Y312-F318 HydrophobicContact CE2-CD2 4.04Å; Y312-F318 HydrophobicContact CG-CB 3.95Å; Y316-F318 PolarHBondContact O-N 2.68Å; Y316-F318 VanDerWaalsContact O-N 3.12Å; F318-D320 VanDerWaalsContact C-N 3.3Å; F318-D320 PolarHBondContact O-N 3.22Å; F318-D321 PolarHBondContact O-N 3.16Å; F318-V322 HydrophobicContact CD2-CG2 4.47Å; F318-V322 HydrophobicContact CE1-CG2 4.31Å; F318-V322 HydrophobicContact CE2-CG2 4.05Å; F318-V322 HydrophobicContact CZ-CG2 3.97Å; F318-V322 WeakPolarHBondContact O-CG2 3.32Å; F318-V322 PolarHBondContact O-N 3.15Å; F318-F350 AromaticContact CE1-CE2 3.74Å; F318-F350 HydrophobicContact CE1-CE2 3.74Å; F318-F350 HydrophobicContact CE1-CZ 4.16Å; F318-F350 HydrophobicContact CZ-CE2 4.16Å; F318-F354 HydrophobicContact CD1-CE2 4.22Å; F318-F354 HydrophobicContact CE1-CD2 4.42Å
319	A	98.1	Very high	95.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-33	178.6	0	0	0	0	0	112.9	K315 Y316 V322 R323 F350 F354	K315-A319 PolarHBondContact O-N 2.8Å; K315-A319 VanDerWaalsContact O-N 3.15Å; Y316-A319 CarbonylContact O-C 3.46Å; Y316-A319 WeakPolarHBondContact O-CA 3.41Å; Y316-A319 PolarHBondContact O-N 2.66Å; A319-V322 PolarHBondContact O-N 2.97Å; A319-R323 WeakPolarHBondContact O-CB 3.31Å; A319-R323 VanDerWaalsContact O-CG 3.31Å; A319-R323 WeakPolarHBondContact O-CG 3.19Å; A319-R323 PolarHBondContact O-N 3.16Å; A319-F350 HydrophobicContact CB-CE1 4.35Å; A319-F350 HydrophobicContact CB-CZ 3.99Å; A319-F354 HydrophobicContact CB-CD1 4.4Å; A319-F354 HydrophobicContact CB-CD2 4.25Å; A319-F354 HydrophobicContact CB-CE1 3.9Å; A319-F354 HydrophobicContact CB-CE2 3.74Å; A319-F354 HydrophobicContact CB-CZ 3.53Å
320	D	98.2	Very high	96.3	Very high	97 Å²	97	41.2 Å²	41.2	52%	0.519	20%	0.204	S	C	.	.	H	α-helix	trans	-65.5	-38.6	177.9	-74.5	-11.3	0	0	0	112.1	Y316 F318 L324	Y316-D320 PolarHBondContact O-N 3.1Å; F318-D320 VanDerWaalsContact C-N 3.3Å; F318-D320 PolarHBondContact O-N 3.22Å; D320-L324 WeakPolarHBondContact O-CB 3.43Å; D320-L324 PolarHBondContact O-N 3.42Å
321	D	98.5	Very high	96.7	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-71.6	-36.4	172.8	-85	-13.9	0	0	0	112.3	K296 M298 I303 K306 Y312 F318 L324 M325	K296-D321 WeakPolarHBondContact CE-OD1 3.31Å; K296-D321 IonicContact NZ-OD1 2.65Å; K296-D321 PolarHBondContact NZ-OD1 3.16Å; M298-D321 HydrophobicContact CE-CB 4.35Å; M298-D321 HydrophobicContact CG-CB 4.04Å; M298-D321 VanDerWaalsContact CG-O 3.32Å; M298-D321 WeakPolarHBondContact CG-O 3.37Å; M298-D321 HydrophobicContact SD-CB 4.15Å; I303-D321 HydrophobicContact CD1-CB 4.44Å; I303-D321 HydrophobicContact CG1-CB 4.08Å; K306-D321 WeakPolarHBondContact CD-OD2 3.43Å; K306-D321 WeakPolarHBondContact CE-OD2 3.28Å; K306-D321 IonicContact NZ-OD1 2.96Å; K306-D321 IonicContact NZ-OD2 3.87Å; K306-D321 PolarHBondContact NZ-OD2 3.07Å; Y312-D321 HydrophobicContact CE1-CB 4.3Å; Y312-D321 VanDerWaalsContact CE1-OD2 3.22Å; Y312-D321 WeakPolarHBondContact CE1-OD2 3.5Å; Y312-D321 WeakPolarHBondContact OH-CB 3.26Å; Y312-D321 PolarHBondContact OH-OD2 3.15Å; F318-D321 PolarHBondContact O-N 3.16Å; D321-L324 PolarHBondContact O-N 3.42Å; D321-M325 PolarHBondContact O-N 2.79Å
322	V	98.6	Very high	97	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.3	-44.7	174	177.1	0	0	0	0	111	I303 F318 A319 M325 F326 F350	I303-V322 HydrophobicContact CD1-CB 4.39Å; I303-V322 HydrophobicContact CD1-CG2 3.84Å; I303-V322 HydrophobicContact CG2-CG2 4.25Å; F318-V322 HydrophobicContact CD2-CG2 4.47Å; F318-V322 HydrophobicContact CE1-CG2 4.31Å; F318-V322 HydrophobicContact CE2-CG2 4.05Å; F318-V322 HydrophobicContact CZ-CG2 3.97Å; F318-V322 WeakPolarHBondContact O-CG2 3.32Å; F318-V322 PolarHBondContact O-N 3.15Å; A319-V322 PolarHBondContact O-N 2.97Å; V322-M325 WeakPolarHBondContact O-CB 3.41Å; V322-M325 PolarHBondContact O-N 3.25Å; V322-F326 HydrophobicContact CG1-CD2 4.18Å; V322-F326 HydrophobicContact CG1-CE2 3.68Å; V322-F326 WeakPolarHBondContact O-CD2 3.27Å; V322-F326 PolarHBondContact O-N 2.83Å; V322-F350 HydrophobicContact CB-CD1 4.5Å; V322-F350 HydrophobicContact CB-CD2 4.49Å; V322-F350 HydrophobicContact CB-CE1 4.08Å; V322-F350 HydrophobicContact CB-CE2 4.06Å; V322-F350 HydrophobicContact CB-CZ 3.84Å; V322-F350 HydrophobicContact CG1-CB 4.49Å; V322-F350 HydrophobicContact CG1-CD1 3.68Å; V322-F350 HydrophobicContact CG1-CD2 3.68Å; V322-F350 HydrophobicContact CG1-CE1 3.76Å; V322-F350 HydrophobicContact CG1-CE2 3.75Å; V322-F350 HydrophobicContact CG1-CG 3.65Å; V322-F350 HydrophobicContact CG1-CZ 3.79Å; V322-F350 HydrophobicContact CG2-CE2 3.93Å; V322-F350 HydrophobicContact CG2-CZ 4.08Å
323	R	98.6	Very high	97.1	Very high	76 Å²	76	46.5 Å²	46.5	29%	0.287	22%	0.221	S	C	.	.	H	α-helix	trans	-69.9	-34.6	177.3	-70.4	169.9	-178.5	153.8	-2.2	111.8	A319 F326 N327 F350 D351	A319-R323 WeakPolarHBondContact O-CB 3.31Å; A319-R323 VanDerWaalsContact O-CG 3.31Å; A319-R323 WeakPolarHBondContact O-CG 3.19Å; A319-R323 PolarHBondContact O-N 3.16Å; R323-F326 PolarHBondContact O-N 3.09Å; R323-N327 WeakPolarHBondContact O-CB 3.49Å; R323-N327 PolarHBondContact O-N 2.57Å; R323-N327 PolarHBondContact O-ND2 3.28Å; R323-F350 HydrophobicContact CG-CE1 4.42Å; R323-D351 IonicContact CZ-OD1 3.18Å; R323-D351 VanDerWaalsContact CZ-OD1 3.27Å; R323-D351 IonicContact NE-OD1 3.07Å; R323-D351 PolarHBondContact NE-OD1 3.31Å; R323-D351 IonicContact NH2-OD1 3.41Å; R323-D351 PolarHBondContact NH2-OD1 3.19Å
324	L	98.5	Very high	97.3	Very high	33 Å²	33	41 Å²	41	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-43.1	170.8	171.1	65.2	0	0	0	112.4	K296 M298 D320 D321 F326 N327 N328	K296-L324 HydrophobicContact CB-CD2 4.14Å; K296-L324 HydrophobicContact CD-CD2 3.38Å; K296-L324 HydrophobicContact CG-CD2 3.73Å; K296-L324 VanDerWaalsContact NZ-CD2 3.3Å; M298-L324 HydrophobicContact CB-CD2 4.17Å; M298-L324 HydrophobicContact CB-CG 4.26Å; D320-L324 WeakPolarHBondContact O-CB 3.43Å; D320-L324 PolarHBondContact O-N 3.42Å; D321-L324 PolarHBondContact O-N 3.42Å; L324-F326 VanDerWaalsContact C-N 3.29Å; L324-F326 PolarHBondContact O-N 3.49Å; L324-N327 PolarHBondContact O-N 2.89Å; L324-N328 WeakPolarHBondContact O-CB 3.47Å; L324-N328 PolarHBondContact O-N 3.19Å; L324-N328 PolarHBondContact O-ND2 2.96Å
325	M	98.5	Very high	97.4	Very high	5 Å²	5	44 Å²	44	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-56.3	-43.8	175.5	174.1	-169.5	78.8	0	0	111.4	F276 M298 L300 I303 D321 V322 C329	F276-M325 HydrophobicContact CB-CE 4.12Å; F276-M325 HydrophobicContact CB-SD 3.85Å; F276-M325 HydrophobicContact CD1-CE 4.02Å; F276-M325 HydrophobicContact CD1-CG 3.77Å; F276-M325 HydrophobicContact CD1-SD 4.01Å; F276-M325 HydrophobicContact CE1-CG 4.49Å; F276-M325 HydrophobicContact CG-CE 4.21Å; F276-M325 HydrophobicContact CG-SD 4.32Å; M298-M325 HydrophobicContact CB-CB 4.18Å; M298-M325 HydrophobicContact CG-CB 4.24Å; M298-M325 WeakPolarHBondContact O-CG 3.45Å; L300-M325 HydrophobicContact CD2-CE 3.95Å; L300-M325 HydrophobicContact CD2-SD 3.96Å; L300-M325 HydrophobicContact CG-CE 4.26Å; L300-M325 HydrophobicContact CG-SD 3.83Å; I303-M325 HydrophobicContact CD1-SD 4.28Å; D321-M325 PolarHBondContact O-N 2.79Å; V322-M325 WeakPolarHBondContact O-CB 3.41Å; V322-M325 PolarHBondContact O-N 3.25Å; M325-C329 PolarHBondContact O-N 3.43Å
326	F	98.4	Very high	97.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-46.5	174.7	-66.5	-56.3	0	0	0	112.9	F276 V322 R323 L324 N328 C329 Y330 G343 L346 Q347 F350	F276-F326 HydrophobicContact CD1-CE1 4.46Å; F276-F326 HydrophobicContact CE1-CD1 4.01Å; F276-F326 HydrophobicContact CE1-CE1 4.22Å; F276-F326 HydrophobicContact CE2-CE1 4.34Å; F276-F326 HydrophobicContact CZ-CD1 4.11Å; F276-F326 HydrophobicContact CZ-CE1 4.17Å; V322-F326 HydrophobicContact CG1-CD2 4.18Å; V322-F326 HydrophobicContact CG1-CE2 3.68Å; V322-F326 WeakPolarHBondContact O-CD2 3.27Å; V322-F326 PolarHBondContact O-N 2.83Å; R323-F326 PolarHBondContact O-N 3.09Å; L324-F326 VanDerWaalsContact C-N 3.29Å; L324-F326 PolarHBondContact O-N 3.49Å; F326-N328 VanDerWaalsContact C-N 3.28Å; F326-N328 PolarHBondContact O-N 2.86Å; F326-C329 WeakPolarHBondContact O-CA 3.43Å; F326-C329 VanDerWaalsContact O-CB 3.27Å; F326-C329 WeakPolarHBondContact O-CB 3.41Å; F326-C329 PolarHBondContact O-N 3.12Å; F326-Y330 HydrophobicContact CB-CE2 3.89Å; F326-Y330 WeakPolarHBondContact O-CD2 3.43Å; F326-Y330 VanDerWaalsContact O-CG 3.3Å; F326-Y330 PolarHBondContact O-N 3.45Å; F326-G343 WeakPolarHBondContact CE1-O 3.49Å; F326-L346 HydrophobicContact CE1-CB 3.93Å; F326-L346 HydrophobicContact CE1-CD2 4.08Å; F326-L346 HydrophobicContact CE1-CG 4.19Å; F326-L346 HydrophobicContact CZ-CB 4.01Å; F326-L346 HydrophobicContact CZ-CD2 4.06Å; F326-L346 HydrophobicContact CZ-CG 3.92Å; F326-Q347 HydrophobicContact CD1-CB 4.16Å; F326-Q347 HydrophobicContact CD2-CB 3.67Å; F326-Q347 HydrophobicContact CD2-CG 3.73Å; F326-Q347 HydrophobicContact CE1-CB 4.24Å; F326-Q347 HydrophobicContact CE2-CB 3.74Å; F326-Q347 HydrophobicContact CE2-CG 4.04Å; F326-Q347 HydrophobicContact CG-CB 3.89Å; F326-Q347 HydrophobicContact CG-CG 4.25Å; F326-Q347 HydrophobicContact CZ-CB 4.04Å; F326-F350 HydrophobicContact CE2-CB 4.4Å
327	N	98.1	Very high	97.4	Very high	90 Å²	90	47.3 Å²	47.3	48%	0.481	24%	0.243	S	C	.	.	H	α-helix	trans	-60.1	-36.4	177.9	-69.4	-17.1	0	0	0	112.5	R323 L324 Y330 K331	R323-N327 WeakPolarHBondContact O-CB 3.49Å; R323-N327 PolarHBondContact O-N 2.57Å; R323-N327 PolarHBondContact O-ND2 3.28Å; L324-N327 PolarHBondContact O-N 2.89Å; N327-Y330 PolarHBondContact O-N 3.29Å; N327-K331 WeakPolarHBondContact O-CB 3.42Å; N327-K331 PolarHBondContact O-N 3.44Å
328	N	98	Very high	97.3	Very high	11 Å²	11	50.2 Å²	50.2	6%	0.059	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-42	172.4	-74	-26.8	0	0	0	111.7	V294 K296 L324 F326 K331 Y332	V294-N328 HydrophobicContact CG1-CB 3.96Å; V294-N328 HydrophobicContact CG2-CB 4.17Å; K296-N328 PolarHBondContact O-ND2 2.77Å; L324-N328 WeakPolarHBondContact O-CB 3.47Å; L324-N328 PolarHBondContact O-N 3.19Å; L324-N328 PolarHBondContact O-ND2 2.96Å; F326-N328 VanDerWaalsContact C-N 3.28Å; F326-N328 PolarHBondContact O-N 2.86Å; N328-K331 PolarHBondContact O-N 3.3Å; N328-Y332 WeakPolarHBondContact O-CB 3.49Å; N328-Y332 PolarHBondContact O-N 2.89Å
329	C	97.8	Very high	97.2	Very high	10 Å²	10	51.8 Å²	51.8	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-46.9	176	176	0	0	0	0	111.6	F276 M325 F326 Y332 N333	F276-C329 HydrophobicContact CE1-CB 3.83Å; F276-C329 HydrophobicContact CZ-CB 4.23Å; M325-C329 PolarHBondContact O-N 3.43Å; F326-C329 WeakPolarHBondContact O-CA 3.43Å; F326-C329 VanDerWaalsContact O-CB 3.27Å; F326-C329 WeakPolarHBondContact O-CB 3.41Å; F326-C329 PolarHBondContact O-N 3.12Å; C329-Y332 PolarHBondContact O-N 2.96Å; C329-N333 WeakPolarHBondContact O-CB 3.37Å; C329-N333 PolarHBondContact O-N 2.7Å; C329-N333 PolarHBondContact O-ND2 3.29Å
330	Y	98	Very high	97.1	Very high	25 Å²	25	51.8 Å²	51.8	10%	0.098	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-41.7	178.4	-49.4	-31.7	0	0	0	111.7	F326 N327 Y332 G334 A340 G343 K344 Q347	F326-Y330 HydrophobicContact CB-CE2 3.89Å; F326-Y330 WeakPolarHBondContact O-CD2 3.43Å; F326-Y330 VanDerWaalsContact O-CG 3.3Å; F326-Y330 PolarHBondContact O-N 3.45Å; N327-Y330 PolarHBondContact O-N 3.29Å; Y330-Y332 PolarHBondContact O-N 3.39Å; Y330-G334 CarbonylContact O-C 3.58Å; Y330-G334 VanDerWaalsContact O-CA 3.29Å; Y330-G334 WeakPolarHBondContact O-CA 3.39Å; Y330-G334 PolarHBondContact O-N 3.21Å; Y330-A340 HydrophobicContact CD1-CB 3.7Å; Y330-A340 HydrophobicContact CE1-CB 4.27Å; Y330-G343 PolarHBondContact OH-O 3.48Å; Y330-K344 HydrophobicContact CE1-CG 3.73Å; Y330-K344 WeakPolarHBondContact OH-CA 3.34Å; Y330-K344 PolarHBondContact OH-N 2.92Å; Y330-Q347 PolarHBondContact OH-OE1 3.15Å
331	K	97.2	Very high	97.1	Very high	130 Å²	130	52.4 Å²	52.4	57%	0.565	26%	0.26	S	S	*	.	H	α-helix	trans	-65	-37.1	178.9	-168.8	-171.1	-179.2	-167.5	0	113.2	V293 N327 N328	V293-K331 HydrophobicContact CG1-CD 4.12Å; V293-K331 HydrophobicContact CG1-CG 3.95Å; V293-K331 WeakPolarHBondContact O-CE 3.18Å; V293-K331 PolarHBondContact O-NZ 3.46Å; N327-K331 WeakPolarHBondContact O-CB 3.42Å; N327-K331 PolarHBondContact O-N 3.44Å; N328-K331 PolarHBondContact O-N 3.3Å
332	Y	97.6	Very high	97.1	Very high	47 Å²	47	52.6 Å²	52.6	18%	0.184	26%	0.261	C	S	.	.	H	α-helix	trans	-83.3	-48.8	-178.9	-173.1	-109.4	0	0	0	113	L287 D289 Y290 V293 N328 C329 Y330	L287-Y332 HydrophobicContact CD1-CE1 4.07Å; L287-Y332 HydrophobicContact CD2-CE1 4.24Å; D289-Y332 WeakPolarHBondContact OD1-CE2 3.49Å; D289-Y332 PolarHBondContact OD1-OH 3.38Å; Y290-Y332 AromaticContact CD2-CD1 3.71Å; Y290-Y332 HydrophobicContact CD2-CD1 3.71Å; Y290-Y332 AromaticContact CD2-CD2 3.88Å; Y290-Y332 HydrophobicContact CD2-CD2 3.88Å; Y290-Y332 AromaticContact CD2-CE1 3.85Å; Y290-Y332 HydrophobicContact CD2-CE1 3.85Å; Y290-Y332 HydrophobicContact CD2-CE2 4.04Å; Y290-Y332 AromaticContact CD2-CG 3.73Å; Y290-Y332 HydrophobicContact CD2-CG 3.73Å; Y290-Y332 HydrophobicContact CE2-CD1 4.04Å; Y290-Y332 HydrophobicContact CE2-CG 4.02Å; V293-Y332 HydrophobicContact CB-CD2 3.91Å; V293-Y332 HydrophobicContact CG1-CD2 4.16Å; V293-Y332 HydrophobicContact CG2-CD2 4.12Å; V293-Y332 HydrophobicContact CG2-CE2 4.36Å; N328-Y332 WeakPolarHBondContact O-CB 3.49Å; N328-Y332 PolarHBondContact O-N 2.89Å; C329-Y332 PolarHBondContact O-N 2.96Å; Y330-Y332 PolarHBondContact O-N 3.39Å
333	N	95.8	Very high	97	Very high	68 Å²	68	52.6 Å²	52.6	36%	0.364	26%	0.261	S	S	.	.	H	α-helix	trans	-86.8	-14.9	-172.8	-56.4	-85	0	0	0	113.3	C329 S337 V339	C329-N333 WeakPolarHBondContact O-CB 3.37Å; C329-N333 PolarHBondContact O-N 2.7Å; C329-N333 PolarHBondContact O-ND2 3.29Å; N333-S337 WeakPolarHBondContact CB-OG 3.34Å; N333-S337 VanDerWaalsContact O-CB 3.27Å; N333-S337 WeakPolarHBondContact O-CB 3.4Å; N333-S337 PolarHBondContact O-OG 3.18Å; N333-V339 HydrophobicContact CB-CB 4.4Å
334	G	95.2	Very high	97	Very high	34 Å²	34	52.8 Å²	52.8	35%	0.351	26%	0.264	S	S	.	.			trans	83	148.6	-168.4	0	0	0	0	0	112.4	Y330 D336 S337 A340	Y330-G334 CarbonylContact O-C 3.58Å; Y330-G334 VanDerWaalsContact O-CA 3.29Å; Y330-G334 WeakPolarHBondContact O-CA 3.39Å; Y330-G334 PolarHBondContact O-N 3.21Å; G334-D336 VanDerWaalsContact C-N 3.3Å; G334-D336 PolarHBondContact O-N 3.3Å; G334-S337 WeakPolarHBondContact O-CB 3.49Å; G334-S337 PolarHBondContact O-N 3.25Å; G334-S337 PolarHBondContact O-OG 2.93Å; G334-A340 WeakPolarHBondContact O-CB 3.5Å
335	E	94.5	Very high	97	Very high	119 Å²	119	55.4 Å²	55.4	56%	0.556	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-26.1	-170.1	-78.1	-139.1	-135	0	0	115.7	K344	E335-K344 PolarHBondContact O-NZ 2.61Å; E335-K344 WeakPolarHBondContact OE2-CE 3.09Å; E335-K344 IonicContact OE2-NZ 3.47Å; E335-K344 PolarHBondContact OE2-NZ 2.88Å
336	D	95.1	Very high	97	Very high	165 Å²	165	55.2 Å²	55.2	88%	0.882	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-0.3	-178.9	-55	-56.7	0	0	0	113	G334	G334-D336 VanDerWaalsContact C-N 3.3Å; G334-D336 PolarHBondContact O-N 3.3Å
337	S	96.8	Very high	96.9	Very high	29 Å²	29	57.1 Å²	57.1	20%	0.203	28%	0.283	C	S	.	.	S	Bend	trans	-68.9	151.5	178.8	65.3	0	0	0	0	112.2	N333 G334 V339 A340 R341	N333-S337 WeakPolarHBondContact CB-OG 3.34Å; N333-S337 VanDerWaalsContact O-CB 3.27Å; N333-S337 WeakPolarHBondContact O-CB 3.4Å; N333-S337 PolarHBondContact O-OG 3.18Å; G334-S337 WeakPolarHBondContact O-CB 3.49Å; G334-S337 PolarHBondContact O-N 3.25Å; G334-S337 PolarHBondContact O-OG 2.93Å; S337-V339 PolarHBondContact O-N 3.35Å; S337-A340 CarbonylContact O-C 3.51Å; S337-A340 WeakPolarHBondContact O-CA 3.19Å; S337-A340 WeakPolarHBondContact O-CB 3.49Å; S337-A340 PolarHBondContact O-N 3.11Å; S337-A340 WeakPolarHBondContact OG-CB 3.33Å; S337-A340 PolarHBondContact OG-N 3.23Å; S337-A340 VanDerWaalsContact OG-N 3.1Å; S337-R341 PolarHBondContact O-N 2.98Å
338	E	94.8	Very high	96.9	Very high	111 Å²	111	55.7 Å²	55.7	52%	0.519	28%	0.284	S	S	.	.	H	α-helix	trans	-57.8	-35.9	175.2	177.6	60.6	-173.3	0	0	112.1	R341 V342	E338-R341 VanDerWaalsContact CD-NH2 3.34Å; E338-R341 WeakPolarHBondContact O-CB 3.48Å; E338-R341 PolarHBondContact O-N 3.27Å; E338-R341 IonicContact OE1-CZ 2.67Å; E338-R341 IonicContact OE1-NE 2.75Å; E338-R341 IonicContact OE1-NH2 3.11Å; E338-R341 PolarHBondContact OE1-NH2 3.03Å; E338-R341 IonicContact OE2-CZ 2.7Å; E338-R341 IonicContact OE2-NE 3.7Å; E338-R341 PolarHBondContact OE2-NE 3.1Å; E338-R341 IonicContact OE2-NH2 3.57Å; E338-R341 PolarHBondContact OE2-NH2 3.46Å; E338-V342 WeakPolarHBondContact O-CG2 3.3Å; E338-V342 PolarHBondContact O-N 2.87Å
339	V	95	Very high	96.9	Very high	33 Å²	33	56.7 Å²	56.7	20%	0.2	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-40.2	175.7	-163.3	0	0	0	0	111.1	F275 N333 S337 V342 G343	F275-V339 HydrophobicContact CB-CG1 4.37Å; F275-V339 HydrophobicContact CD1-CG1 4.22Å; F275-V339 HydrophobicContact CD2-CG1 3.94Å; F275-V339 HydrophobicContact CE1-CG1 4.5Å; F275-V339 HydrophobicContact CE2-CG1 4.22Å; F275-V339 HydrophobicContact CG-CG1 3.94Å; F275-V339 HydrophobicContact CZ-CG1 4.49Å; F275-V339 HydrophobicContact CZ-CG2 4.38Å; N333-V339 HydrophobicContact CB-CB 4.4Å; S337-V339 PolarHBondContact O-N 3.35Å; V339-V342 PolarHBondContact O-N 2.96Å; V339-G343 PolarHBondContact O-N 3.14Å
340	A	97	Very high	97	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-37.5	172.8	0	0	0	0	0	112.4	Y330 G334 S337 V342 G343 K344	Y330-A340 HydrophobicContact CD1-CB 3.7Å; Y330-A340 HydrophobicContact CE1-CB 4.27Å; G334-A340 WeakPolarHBondContact O-CB 3.5Å; S337-A340 CarbonylContact O-C 3.51Å; S337-A340 WeakPolarHBondContact O-CA 3.19Å; S337-A340 WeakPolarHBondContact O-CB 3.49Å; S337-A340 PolarHBondContact O-N 3.11Å; S337-A340 WeakPolarHBondContact OG-CB 3.33Å; S337-A340 PolarHBondContact OG-N 3.23Å; S337-A340 VanDerWaalsContact OG-N 3.1Å; A340-V342 VanDerWaalsContact C-N 3.35Å; A340-V342 PolarHBondContact O-N 2.93Å; A340-G343 PolarHBondContact O-N 3.35Å; A340-K344 WeakPolarHBondContact O-CB 3.21Å; A340-K344 VanDerWaalsContact O-CG 3.29Å; A340-K344 WeakPolarHBondContact O-CG 3.33Å; A340-K344 PolarHBondContact O-N 2.79Å
341	R	97.8	Very high	97	Very high	110 Å²	110	57 Å²	57	42%	0.415	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-44.7	174	-167.6	-171.6	67.4	69.7	-2.6	111.3	S337 E338 Q345	S337-R341 PolarHBondContact O-N 2.98Å; E338-R341 VanDerWaalsContact CD-NH2 3.34Å; E338-R341 WeakPolarHBondContact O-CB 3.48Å; E338-R341 PolarHBondContact O-N 3.27Å; E338-R341 IonicContact OE1-CZ 2.67Å; E338-R341 IonicContact OE1-NE 2.75Å; E338-R341 IonicContact OE1-NH2 3.11Å; E338-R341 PolarHBondContact OE1-NH2 3.03Å; E338-R341 IonicContact OE2-CZ 2.7Å; E338-R341 IonicContact OE2-NE 3.7Å; E338-R341 PolarHBondContact OE2-NE 3.1Å; E338-R341 IonicContact OE2-NH2 3.57Å; E338-R341 PolarHBondContact OE2-NH2 3.46Å; R341-Q345 WeakPolarHBondContact O-CG 3.27Å; R341-Q345 PolarHBondContact O-N 2.84Å
342	V	97.1	Very high	97	Very high	8 Å²	8	56.3 Å²	56.3	5%	0.048	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-42.9	174.4	169.4	0	0	0	0	111.5	L272 F275 E338 V339 A340 Q345 L346	L272-V342 HydrophobicContact CB-CG1 4.35Å; L272-V342 HydrophobicContact CD2-CG1 4.14Å; L272-V342 VanDerWaalsContact O-CG1 3.27Å; L272-V342 WeakPolarHBondContact O-CG1 3.2Å; F275-V342 HydrophobicContact CD2-CG1 4.04Å; F275-V342 HydrophobicContact CE2-CB 4.42Å; F275-V342 HydrophobicContact CE2-CG1 4.19Å; E338-V342 WeakPolarHBondContact O-CG2 3.3Å; E338-V342 PolarHBondContact O-N 2.87Å; V339-V342 PolarHBondContact O-N 2.96Å; A340-V342 VanDerWaalsContact C-N 3.35Å; A340-V342 PolarHBondContact O-N 2.93Å; V342-Q345 PolarHBondContact O-N 2.85Å; V342-L346 PolarHBondContact O-N 3.23Å
343	G	97.9	Very high	97	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-47.6	173.9	0	0	0	0	0	112.9	F326 Y330 V339 A340 Q345 L346 Q347	F326-G343 WeakPolarHBondContact CE1-O 3.49Å; Y330-G343 PolarHBondContact OH-O 3.48Å; V339-G343 PolarHBondContact O-N 3.14Å; A340-G343 PolarHBondContact O-N 3.35Å; G343-Q345 VanDerWaalsContact C-N 3.27Å; G343-Q345 PolarHBondContact O-N 2.95Å; G343-L346 PolarHBondContact O-N 2.93Å; G343-Q347 WeakPolarHBondContact O-CB 3.15Å; G343-Q347 PolarHBondContact O-N 3.1Å
344	K	98	Very high	97.1	Very high	81 Å²	81	53.4 Å²	53.4	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-59.1	-36.7	177.3	-74.6	168.5	176.9	176.4	0	111.8	Y330 E335 A340 A348	Y330-K344 HydrophobicContact CE1-CG 3.73Å; Y330-K344 WeakPolarHBondContact OH-CA 3.34Å; Y330-K344 PolarHBondContact OH-N 2.92Å; E335-K344 PolarHBondContact O-NZ 2.61Å; E335-K344 WeakPolarHBondContact OE2-CE 3.09Å; E335-K344 IonicContact OE2-NZ 3.47Å; E335-K344 PolarHBondContact OE2-NZ 2.88Å; A340-K344 WeakPolarHBondContact O-CB 3.21Å; A340-K344 VanDerWaalsContact O-CG 3.29Å; A340-K344 WeakPolarHBondContact O-CG 3.33Å; A340-K344 PolarHBondContact O-N 2.79Å; K344-A348 PolarHBondContact O-N 3.34Å; K344-A348 VanDerWaalsContact O-N 3.07Å
345	Q	98	Very high	97.2	Very high	88 Å²	88	55.9 Å²	55.9	41%	0.411	30%	0.295	S	S	.	.	H	α-helix	trans	-68.7	-45.2	174.5	-72	-178.4	-24	0	0	112.8	L272 R341 V342 G343 Q347 A348 I349	L272-Q345 HydrophobicContact CD1-CB 4.29Å; L272-Q345 HydrophobicContact CD2-CB 4.12Å; R341-Q345 WeakPolarHBondContact O-CG 3.27Å; R341-Q345 PolarHBondContact O-N 2.84Å; V342-Q345 PolarHBondContact O-N 2.85Å; G343-Q345 VanDerWaalsContact C-N 3.27Å; G343-Q345 PolarHBondContact O-N 2.95Å; Q345-Q347 VanDerWaalsContact C-N 3.35Å; Q345-A348 PolarHBondContact O-N 3.17Å; Q345-I349 WeakPolarHBondContact O-CD1 3.42Å; Q345-I349 WeakPolarHBondContact O-CG1 3.33Å; Q345-I349 PolarHBondContact O-N 3.17Å
346	L	98	Very high	97.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-69.2	-33.9	177.1	-168.7	65.3	0	0	0	112.2	I264 Y269 L272 N273 F276 F326 V342 G343 I349 F350	I264-L346 HydrophobicContact CB-CD1 4.28Å; Y269-L346 HydrophobicContact CG-CD1 4.43Å; L272-L346 HydrophobicContact CB-CB 4.24Å; L272-L346 HydrophobicContact CB-CD1 4.1Å; N273-L346 HydrophobicContact CB-CD1 4.5Å; N273-L346 HydrophobicContact CB-CD2 3.86Å; F276-L346 HydrophobicContact CD2-CD2 3.84Å; F276-L346 HydrophobicContact CE2-CD2 4.43Å; F276-L346 HydrophobicContact CG-CD2 4.42Å; F326-L346 HydrophobicContact CE1-CB 3.93Å; F326-L346 HydrophobicContact CE1-CD2 4.08Å; F326-L346 HydrophobicContact CE1-CG 4.19Å; F326-L346 HydrophobicContact CZ-CB 4.01Å; F326-L346 HydrophobicContact CZ-CD2 4.06Å; F326-L346 HydrophobicContact CZ-CG 3.92Å; V342-L346 PolarHBondContact O-N 3.23Å; G343-L346 PolarHBondContact O-N 2.93Å; L346-I349 PolarHBondContact O-N 3.32Å; L346-F350 PolarHBondContact O-N 3.05Å
347	Q	98.2	Very high	97.2	Very high	41 Å²	41	48.7 Å²	48.7	19%	0.192	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-43.8	174.8	-175.9	179.1	-12.6	0	0	111.6	F326 Y330 G343 Q345 I349 F350 D351	F326-Q347 HydrophobicContact CD1-CB 4.16Å; F326-Q347 HydrophobicContact CD2-CB 3.67Å; F326-Q347 HydrophobicContact CD2-CG 3.73Å; F326-Q347 HydrophobicContact CE1-CB 4.24Å; F326-Q347 HydrophobicContact CE2-CB 3.74Å; F326-Q347 HydrophobicContact CE2-CG 4.04Å; F326-Q347 HydrophobicContact CG-CB 3.89Å; F326-Q347 HydrophobicContact CG-CG 4.25Å; F326-Q347 HydrophobicContact CZ-CB 4.04Å; Y330-Q347 PolarHBondContact OH-OE1 3.15Å; G343-Q347 WeakPolarHBondContact O-CB 3.15Å; G343-Q347 PolarHBondContact O-N 3.1Å; Q345-Q347 VanDerWaalsContact C-N 3.35Å; Q347-I349 VanDerWaalsContact C-N 3.28Å; Q347-I349 PolarHBondContact O-N 3.42Å; Q347-F350 CarbonylContact O-C 3.58Å; Q347-F350 WeakPolarHBondContact O-CA 3.4Å; Q347-F350 WeakPolarHBondContact O-CB 3.27Å; Q347-F350 PolarHBondContact O-N 2.85Å; Q347-D351 VanDerWaalsContact CG-OD2 3.25Å; Q347-D351 WeakPolarHBondContact CG-OD2 3.36Å; Q347-D351 PolarHBondContact NE2-OD2 3.47Å; Q347-D351 PolarHBondContact O-N 2.91Å
348	A	98.2	Very high	96.9	Very high	60 Å²	60	50.7 Å²	50.7	50%	0.496	27%	0.267	S	S	.	.	H	α-helix	trans	-57.4	-43.5	176.6	0	0	0	0	0	111.7	K344 Q345 F350 D351 E352	K344-A348 PolarHBondContact O-N 3.34Å; K344-A348 VanDerWaalsContact O-N 3.07Å; Q345-A348 PolarHBondContact O-N 3.17Å; A348-F350 VanDerWaalsContact C-N 3.31Å; A348-F350 PolarHBondContact O-N 3.28Å; A348-D351 PolarHBondContact O-N 3.08Å; A348-E352 VanDerWaalsContact O-CB 3.24Å; A348-E352 WeakPolarHBondContact O-CB 3.22Å; A348-E352 PolarHBondContact O-N 2.99Å
349	I	97.6	Very high	96.4	Very high	32 Å²	32	48.9 Å²	48.9	16%	0.164	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-36.2	174.9	-64.2	160.3	0	0	0	111.5	I264 Y269 L272 Q345 L346 Q347 N353	I264-I349 HydrophobicContact CG2-CG2 4.44Å; Y269-I349 HydrophobicContact CD1-CD1 3.96Å; Y269-I349 HydrophobicContact CE1-CD1 3.75Å; Y269-I349 HydrophobicContact CE1-CG2 4.19Å; Y269-I349 HydrophobicContact CE2-CG2 4.4Å; L272-I349 HydrophobicContact CD1-CD1 3.67Å; Q345-I349 WeakPolarHBondContact O-CD1 3.42Å; Q345-I349 WeakPolarHBondContact O-CG1 3.33Å; Q345-I349 PolarHBondContact O-N 3.17Å; L346-I349 PolarHBondContact O-N 3.32Å; Q347-I349 VanDerWaalsContact C-N 3.28Å; Q347-I349 PolarHBondContact O-N 3.42Å; I349-N353 PolarHBondContact O-N 3.46Å; I349-N353 PolarHBondContact O-ND2 3.34Å
350	F	98.4	Very high	95.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.2	-56.4	174.2	168.9	-100.8	0	0	0	111.9	I260 I264 F318 A319 V322 R323 F326 L346 Q347 A348 E352 N353 F354	I260-F350 HydrophobicContact CG2-CD2 3.71Å; I260-F350 HydrophobicContact CG2-CE2 4.03Å; I264-F350 HydrophobicContact CD1-CD2 4.17Å; F318-F350 AromaticContact CE1-CE2 3.74Å; F318-F350 HydrophobicContact CE1-CE2 3.74Å; F318-F350 HydrophobicContact CE1-CZ 4.16Å; F318-F350 HydrophobicContact CZ-CE2 4.16Å; A319-F350 HydrophobicContact CB-CE1 4.35Å; A319-F350 HydrophobicContact CB-CZ 3.99Å; V322-F350 HydrophobicContact CB-CD1 4.5Å; V322-F350 HydrophobicContact CB-CD2 4.49Å; V322-F350 HydrophobicContact CB-CE1 4.08Å; V322-F350 HydrophobicContact CB-CE2 4.06Å; V322-F350 HydrophobicContact CB-CZ 3.84Å; V322-F350 HydrophobicContact CG1-CB 4.49Å; V322-F350 HydrophobicContact CG1-CD1 3.68Å; V322-F350 HydrophobicContact CG1-CD2 3.68Å; V322-F350 HydrophobicContact CG1-CE1 3.76Å; V322-F350 HydrophobicContact CG1-CE2 3.75Å; V322-F350 HydrophobicContact CG1-CG 3.65Å; V322-F350 HydrophobicContact CG1-CZ 3.79Å; V322-F350 HydrophobicContact CG2-CE2 3.93Å; V322-F350 HydrophobicContact CG2-CZ 4.08Å; R323-F350 HydrophobicContact CG-CE1 4.42Å; F326-F350 HydrophobicContact CE2-CB 4.4Å; L346-F350 PolarHBondContact O-N 3.05Å; Q347-F350 CarbonylContact O-C 3.58Å; Q347-F350 WeakPolarHBondContact O-CA 3.4Å; Q347-F350 WeakPolarHBondContact O-CB 3.27Å; Q347-F350 PolarHBondContact O-N 2.85Å; A348-F350 VanDerWaalsContact C-N 3.31Å; A348-F350 PolarHBondContact O-N 3.28Å; F350-E352 VanDerWaalsContact C-N 3.35Å; F350-E352 PolarHBondContact O-N 3.16Å; F350-N353 PolarHBondContact O-N 3.43Å; F350-N353 VanDerWaalsContact O-N 3.15Å; F350-F354 HydrophobicContact CE1-CB 4.18Å; F350-F354 HydrophobicContact CE1-CG 4.34Å; F350-F354 HydrophobicContact CE2-CB 4.25Å; F350-F354 HydrophobicContact CE2-CD2 4.27Å; F350-F354 HydrophobicContact CZ-CB 3.95Å; F350-F354 AromaticContact CZ-CD2 3.85Å; F350-F354 HydrophobicContact CZ-CD2 3.85Å; F350-F354 AromaticContact CZ-CG 3.93Å; F350-F354 HydrophobicContact CZ-CG 3.93Å; F350-F354 WeakPolarHBondContact O-CB 3.41Å; F350-F354 PolarHBondContact O-N 2.86Å
351	D	98.1	Very high	93.4	Very high	42 Å²	42	58 Å²	58	23%	0.225	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-35.9	-173.7	-79.7	-50	0	0	0	111.4	R323 Q347 A348 N353 F354 A355	R323-D351 IonicContact CZ-OD1 3.18Å; R323-D351 VanDerWaalsContact CZ-OD1 3.27Å; R323-D351 IonicContact NE-OD1 3.07Å; R323-D351 PolarHBondContact NE-OD1 3.31Å; R323-D351 IonicContact NH2-OD1 3.41Å; R323-D351 PolarHBondContact NH2-OD1 3.19Å; Q347-D351 VanDerWaalsContact CG-OD2 3.25Å; Q347-D351 WeakPolarHBondContact CG-OD2 3.36Å; Q347-D351 PolarHBondContact NE2-OD2 3.47Å; Q347-D351 PolarHBondContact O-N 2.91Å; A348-D351 PolarHBondContact O-N 3.08Å; D351-N353 VanDerWaalsContact C-N 3.34Å; D351-N353 PolarHBondContact O-N 2.94Å; D351-F354 PolarHBondContact O-N 3.13Å; D351-A355 WeakPolarHBondContact O-CB 3.34Å; D351-A355 PolarHBondContact O-N 3.5Å
352	E	97.5	Very high	91.2	Very high	114 Å²	114	57.9 Å²	57.9	53%	0.533	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-40.4	172.9	-168	-142	129.7	0	0	112.1	A348 F350 K356	A348-E352 VanDerWaalsContact O-CB 3.24Å; A348-E352 WeakPolarHBondContact O-CB 3.22Å; A348-E352 PolarHBondContact O-N 2.99Å; F350-E352 VanDerWaalsContact C-N 3.35Å; F350-E352 PolarHBondContact O-N 3.16Å; E352-K356 WeakPolarHBondContact O-CE 3.44Å; E352-K356 WeakPolarHBondContact OE1-CE 3.47Å; E352-K356 IonicContact OE1-NZ 3.59Å; E352-K356 PolarHBondContact OE1-NZ 3.02Å
353	N	97.3	Very high	88.5	Confident	43 Å²	43	64.2 Å²	64.2	23%	0.23	35%	0.353	C	S	.	.	H	α-helix	trans	-82	-29	178	-72.2	-59.6	0	0	0	112.8	I260 I349 F350 D351 K356	I260-N353 HydrophobicContact CD1-CB 4.23Å; I260-N353 WeakPolarHBondContact CD1-O 3.06Å; I260-N353 HydrophobicContact CG1-CB 4.17Å; I349-N353 PolarHBondContact O-N 3.46Å; I349-N353 PolarHBondContact O-ND2 3.34Å; F350-N353 PolarHBondContact O-N 3.43Å; F350-N353 VanDerWaalsContact O-N 3.15Å; D351-N353 VanDerWaalsContact C-N 3.34Å; D351-N353 PolarHBondContact O-N 2.94Å; N353-K356 WeakPolarHBondContact O-CB 3.29Å; N353-K356 PolarHBondContact O-N 3.4Å; N353-K356 PolarHBondContact OD1-NZ 2.9Å
354	F	97.8	Very high	85.6	Confident	12 Å²	12	69.8 Å²	69.8	5%	0.053	39%	0.389	C	S	.	.	H	α-helix	trans	-69.2	-35	174.8	-173.1	-98.4	0	0	0	111.9	I260 K315 Y316 F318 A319 F350 D351 K356 V357	I260-F354 HydrophobicContact CD1-CB 4.47Å; K315-F354 HydrophobicContact CB-CE2 3.99Å; K315-F354 HydrophobicContact CB-CZ 4.01Å; K315-F354 HydrophobicContact CD-CE2 4.41Å; K315-F354 HydrophobicContact CD-CZ 4Å; K315-F354 HydrophobicContact CG-CE2 4.28Å; K315-F354 HydrophobicContact CG-CZ 3.81Å; K315-F354 WeakPolarHBondContact O-CE2 2.97Å; K315-F354 WeakPolarHBondContact O-CZ 3.39Å; Y316-F354 HydrophobicContact CD1-CE1 4.47Å; Y316-F354 HydrophobicContact CD1-CZ 4.41Å; F318-F354 HydrophobicContact CD1-CE2 4.22Å; F318-F354 HydrophobicContact CE1-CD2 4.42Å; A319-F354 HydrophobicContact CB-CD1 4.4Å; A319-F354 HydrophobicContact CB-CD2 4.25Å; A319-F354 HydrophobicContact CB-CE1 3.9Å; A319-F354 HydrophobicContact CB-CE2 3.74Å; A319-F354 HydrophobicContact CB-CZ 3.53Å; F350-F354 HydrophobicContact CE1-CB 4.18Å; F350-F354 HydrophobicContact CE1-CG 4.34Å; F350-F354 HydrophobicContact CE2-CB 4.25Å; F350-F354 HydrophobicContact CE2-CD2 4.27Å; F350-F354 HydrophobicContact CZ-CB 3.95Å; F350-F354 AromaticContact CZ-CD2 3.85Å; F350-F354 HydrophobicContact CZ-CD2 3.85Å; F350-F354 AromaticContact CZ-CG 3.93Å; F350-F354 HydrophobicContact CZ-CG 3.93Å; F350-F354 WeakPolarHBondContact O-CB 3.41Å; F350-F354 PolarHBondContact O-N 2.86Å; D351-F354 PolarHBondContact O-N 3.13Å; F354-K356 PolarHBondContact O-N 3.18Å; F354-K356 VanDerWaalsContact O-N 3.13Å; F354-V357 HydrophobicContact CD2-CG2 4.28Å; F354-V357 VanDerWaalsContact O-CB 3.31Å; F354-V357 WeakPolarHBondContact O-CB 3.45Å; F354-V357 WeakPolarHBondContact O-CG2 3.46Å; F354-V357 PolarHBondContact O-N 3.18Å
355	A	97.1	Very high	82.9	Confident	86 Å²	86	69.7 Å²	69.7	71%	0.711	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.7	172.2	0	0	0	0	0	113.9	D351	D351-A355 WeakPolarHBondContact O-CB 3.34Å; D351-A355 PolarHBondContact O-N 3.5Å
356	K	96.4	Very high	80.3	Confident	125 Å²	125	69.9 Å²	69.9	54%	0.543	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-1.6	175.8	-55.2	165.9	-164.1	162.4	0	112.9	E352 N353 F354	E352-K356 WeakPolarHBondContact O-CE 3.44Å; E352-K356 WeakPolarHBondContact OE1-CE 3.47Å; E352-K356 IonicContact OE1-NZ 3.59Å; E352-K356 PolarHBondContact OE1-NZ 3.02Å; N353-K356 WeakPolarHBondContact O-CB 3.29Å; N353-K356 PolarHBondContact O-N 3.4Å; N353-K356 PolarHBondContact OD1-NZ 2.9Å; F354-K356 PolarHBondContact O-N 3.18Å; F354-K356 VanDerWaalsContact O-N 3.13Å
357	V	95.3	Very high	77.4	Confident	8 Å²	8	75.2 Å²	75.2	5%	0.048	46%	0.457	C	S	.	.	S	Bend	trans	-81.5	120.6	176.6	179.8	0	0	0	0	108.5	A253 A256 I260 K315 F354	A253-V357 HydrophobicContact CB-CG1 3.74Å; A256-V357 HydrophobicContact CB-CB 4.47Å; A256-V357 HydrophobicContact CB-CG1 3.94Å; A256-V357 HydrophobicContact CB-CG2 3.98Å; I260-V357 HydrophobicContact CD1-CG2 3.41Å; I260-V357 VanDerWaalsContact CD1-CG2 3.41Å; K315-V357 HydrophobicContact CB-CG1 4.46Å; K315-V357 HydrophobicContact CD-CB 4.29Å; K315-V357 HydrophobicContact CD-CG1 3.73Å; K315-V357 PolarHBondContact NZ-O 3.06Å; F354-V357 HydrophobicContact CD2-CG2 4.28Å; F354-V357 VanDerWaalsContact O-CB 3.31Å; F354-V357 WeakPolarHBondContact O-CB 3.45Å; F354-V357 WeakPolarHBondContact O-CG2 3.46Å; F354-V357 PolarHBondContact O-N 3.18Å
358	P	90.1	Very high	74.8	Confident	71 Å²	71	78.8 Å²	78.8	46%	0.461	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-59.8	156.5	176.5	27.9	-35.9	0	0	0	110.6	A253 K315	A253-P358 WeakPolarHBondContact CB-O 3.41Å; K315-P358 WeakPolarHBondContact CD-O 3.27Å; K315-P358 PolarHBondContact NZ-O 2.98Å
359	D	83.9	Confident	72.3	Confident	72 Å²	72	84 Å²	84	39%	0.385	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-71.4	150.5	164.8	-81.2	-73.6	0	0	0	110.3	K315 Y316 E361	K315-D359 WeakPolarHBondContact CE-OD1 3.45Å; K315-D359 IonicContact NZ-OD1 2.66Å; K315-D359 PolarHBondContact NZ-OD1 2.99Å; K315-D359 IonicContact NZ-OD2 3.93Å; K315-D359 PolarHBondContact NZ-OD2 3.17Å; Y316-D359 PolarHBondContact OH-OD1 2.85Å; D359-E361 PolarHBondContact O-N 3.07Å
360	D	69.2	Low	69.5	Low	68 Å²	68	85.8 Å²	85.8	36%	0.364	53%	0.529	S	S	.	.			trans	-76	78.1	171	-78.1	-44.6	0	0	0	107	S251 E252 A253 S362	S251-D360 VanDerWaalsContact CB-OD1 3.31Å; S251-D360 WeakPolarHBondContact CB-OD1 3.2Å; S251-D360 WeakPolarHBondContact CB-OD2 3.38Å; S251-D360 PolarHBondContact OG-OD1 3.32Å; S251-D360 PolarHBondContact OG-OD2 2.52Å; E252-D360 PolarHBondContact N-OD1 3.23Å; A253-D360 WeakPolarHBondContact CB-OD2 3.42Å; A253-D360 PolarHBondContact N-OD1 3.14Å; A253-D360 VanDerWaalsContact N-OD1 3.12Å; D360-S362 PolarHBondContact O-N 3.4Å
361	E	59.1	Low	66.9	Low	157 Å²	157	96.8 Å²	96.8	73%	0.734	57%	0.571	S	S	*	*			trans	-49.2	103.6	-175.4	-73.3	-74.6	118	0	0	112.5	D359 D363	D359-E361 PolarHBondContact O-N 3.07Å; E361-D363 PolarHBondContact O-N 2.63Å; E361-D363 VanDerWaalsContact O-N 3.17Å
362	S	51.6	Low	64.1	Low	107 Å²	107	100.9 Å²	100.9	75%	0.748	60%	0.6	S	S	*	*			trans	-83.1	86	170.7	62.1	0	0	0	0	110.1	D360 P364	D360-S362 PolarHBondContact O-N 3.4Å; S362-P364 WeakPolarHBondContact O-CD 3.36Å; S362-P364 VanDerWaalsContact O-N 3.07Å
363	D	40.2	Very low	61.6	Low	142 Å²	142	100 Å²	100	76%	0.759	60%	0.602	S	S	*	*			trans	-25.6	98.3	-178.7	-164.4	-1.6	0	0	0	114.7	E361 A365	E361-D363 PolarHBondContact O-N 2.63Å; E361-D363 VanDerWaalsContact O-N 3.17Å; D363-A365 PolarHBondContact O-N 3.05Å; D363-A365 VanDerWaalsContact O-N 3.15Å
364	P	38.5	Very low	59.8	Low	117 Å²	117	101.8 Å²	101.8	76%	0.76	61%	0.611	S	S	*	*			trans	-93.2	56.6	-165	36.3	-36	0	0	0	113.1	S362	S362-P364 WeakPolarHBondContact O-CD 3.36Å; S362-P364 VanDerWaalsContact O-N 3.07Å
365	A	40.7	Very low	58	Low	78 Å²	78	109 Å²	109	65%	0.645	65%	0.645	S	S	*	*			trans	-136	117.1	-177.1	0	0	0	0	0	115.9	D363	D363-A365 PolarHBondContact O-N 3.05Å; D363-A365 VanDerWaalsContact O-N 3.15Å
366	A	42.3	Very low	56.6	Low	93 Å²	93	111.1 Å²	111.1	77%	0.769	65%	0.645	S	S	*	*			trans	43.9	102.9	150.9	0	0	0	0	0	121
367	S	38.6	Very low	55.2	Low	112 Å²	112	110 Å²	110	78%	0.783	64%	0.643	S	S	*	*				-175.6	144.6	96.6	-77.7	0	0	0	0	113.5
368	P	43.9	Very low	53.8	Low	116 Å²	116	115.7 Å²	115.7	75%	0.753	66%	0.664	S	S	*	*			trans	-76.5	158.7	164.6	34.6	-34.1	0	0	0	111.4
369	D	44.4	Very low	52.9	Low	170 Å²	170	117.5 Å²	117.5	91%	0.909	67%	0.666	S	S	*	*	S	Bend	trans	55	122.4	-177.2	-66.2	-23.8	0	0	0	116.5
370	G	39.2	Very low	52.5	Low	68 Å²	68	119.8 Å²	119.8	70%	0.701	68%	0.678	S	S	*	*			cis	-159.8	43.9	4.1	0	0	0	0	0	112.7
371	R	43.7	Very low	52.8	Low	231 Å²	231	120.5 Å²	120.5	87%	0.872	68%	0.681	S	S	*	*			trans	69.5	96.1	-179.3	-49.4	-174.3	-162.8	-136.3	5	116.9
372	P	39.8	Very low	53.7	Low	129 Å²	129	116.8 Å²	116.8	84%	0.838	66%	0.664	S	S	*	*			trans	-65.2	131.8	140.2	30.8	-31.7	0	0	0	108.8
373	V	45.1	Very low	55.1	Low	96 Å²	96	115.5 Å²	115.5	58%	0.582	65%	0.648	S	S	*	*			trans	-74.2	133.3	171.3	178.7	0	0	0	0	108.3	Q375 Y378	V373-Q375 PolarHBondContact O-N 3.17Å; V373-Y378 HydrophobicContact CG1-CD2 4.09Å
374	D	58.3	Low	56.9	Low	79 Å²	79	111.7 Å²	111.7	42%	0.422	64%	0.637	S	S	.	*			trans	-46.9	114.6	178	165.3	32.9	0	0	0	110.6	N376 M377 Y378	D374-N376 PolarHBondContact O-N 3.22Å; D374-N376 WeakPolarHBondContact OD1-CB 3.23Å; D374-N376 PolarHBondContact OD1-N 2.93Å; D374-M377 HydrophobicContact CB-CB 4.14Å; D374-M377 HydrophobicContact CB-CE 4.44Å; D374-M377 PolarHBondContact O-N 2.99Å; D374-M377 WeakPolarHBondContact OD2-CB 3.43Å; D374-M377 PolarHBondContact OD2-N 2.91Å; D374-Y378 PolarHBondContact O-N 3.28Å
375	Q	60.9	Low	59.1	Low	164 Å²	164	109.9 Å²	109.9	77%	0.766	62%	0.62	S	S	*	*	H	α-helix	trans	-71.4	-21.7	-172.4	-161.6	160.6	0.6	0	0	111.6	V373 Q379	V373-Q375 PolarHBondContact O-N 3.17Å; Q375-Q379 WeakPolarHBondContact O-CB 3.33Å; Q375-Q379 PolarHBondContact O-N 2.86Å
376	N	68.3	Low	61.1	Low	131 Å²	131	113.1 Å²	113.1	70%	0.701	62%	0.619	S	S	*	*	H	α-helix	trans	-71.4	-48.8	170.1	-71.2	-62.8	0	0	0	111.4	D374 Y378 Q379 L380	D374-N376 PolarHBondContact O-N 3.22Å; D374-N376 WeakPolarHBondContact OD1-CB 3.23Å; D374-N376 PolarHBondContact OD1-N 2.93Å; N376-Y378 PolarHBondContact O-N 3.24Å; N376-Q379 PolarHBondContact O-N 3.31Å; N376-L380 VanDerWaalsContact O-CB 3.31Å; N376-L380 WeakPolarHBondContact O-CB 3.32Å; N376-L380 PolarHBondContact O-N 2.96Å
377	M	65	Low	62.9	Low	101 Å²	101	113.8 Å²	113.8	50%	0.498	61%	0.607	S	S	.	*	H	α-helix	trans	-61.7	-41.3	173.8	176.9	157.9	51.5	0	0	111.9	D374 Q379 L380 I381	D374-M377 HydrophobicContact CB-CB 4.14Å; D374-M377 HydrophobicContact CB-CE 4.44Å; D374-M377 PolarHBondContact O-N 2.99Å; D374-M377 WeakPolarHBondContact OD2-CB 3.43Å; D374-M377 PolarHBondContact OD2-N 2.91Å; M377-Q379 PolarHBondContact O-N 3.17Å; M377-L380 PolarHBondContact O-N 3.08Å; M377-I381 HydrophobicContact CG-CD1 3.73Å; M377-I381 HydrophobicContact CG-CG1 4.36Å; M377-I381 WeakPolarHBondContact O-CB 3.43Å; M377-I381 VanDerWaalsContact O-CG1 3.25Å; M377-I381 WeakPolarHBondContact O-CG1 3.49Å; M377-I381 PolarHBondContact O-N 2.78Å
378	Y	66.2	Low	65	Low	128 Å²	128	114.4 Å²	114.4	50%	0.502	60%	0.597	S	S	.	*	H	α-helix	trans	-62.2	-44.1	175	-155.7	-89.1	0	0	0	111.2	V373 D374 N376 L380 I381 Q382	V373-Y378 HydrophobicContact CG1-CD2 4.09Å; D374-Y378 PolarHBondContact O-N 3.28Å; N376-Y378 PolarHBondContact O-N 3.24Å; Y378-L380 VanDerWaalsContact C-N 3.34Å; Y378-L380 PolarHBondContact O-N 3.16Å; Y378-I381 PolarHBondContact O-N 3.4Å; Y378-Q382 HydrophobicContact CD1-CG 3.93Å; Y378-Q382 HydrophobicContact CE1-CG 3.9Å; Y378-Q382 WeakPolarHBondContact O-CB 3.4Å; Y378-Q382 VanDerWaalsContact O-CG 3.26Å; Y378-Q382 WeakPolarHBondContact O-CG 3.22Å; Y378-Q382 PolarHBondContact O-N 2.95Å
379	Q	72.5	Confident	66.9	Low	108 Å²	108	114.7 Å²	114.7	51%	0.505	59%	0.588	S	S	.	*	H	α-helix	trans	-66.1	-34.4	176.4	-170.4	60.3	84.2	0	0	112.6	Q375 N376 M377 N383	Q375-Q379 WeakPolarHBondContact O-CB 3.33Å; Q375-Q379 PolarHBondContact O-N 2.86Å; N376-Q379 PolarHBondContact O-N 3.31Å; M377-Q379 PolarHBondContact O-N 3.17Å; Q379-N383 WeakPolarHBondContact O-CB 3.24Å; Q379-N383 PolarHBondContact O-N 2.91Å; Q379-N383 PolarHBondContact O-ND2 3.27Å
380	L	75	Confident	68.9	Low	121 Å²	121	111.1 Å²	111.1	63%	0.634	57%	0.565	S	S	*	*	H	α-helix	trans	-67.6	-44.3	174.6	-176.4	62.9	0	0	0	111.6	N376 M377 Y378 N383 A384	N376-L380 VanDerWaalsContact O-CB 3.31Å; N376-L380 WeakPolarHBondContact O-CB 3.32Å; N376-L380 PolarHBondContact O-N 2.96Å; M377-L380 PolarHBondContact O-N 3.08Å; Y378-L380 VanDerWaalsContact C-N 3.34Å; Y378-L380 PolarHBondContact O-N 3.16Å; L380-N383 PolarHBondContact O-N 3.39Å; L380-A384 WeakPolarHBondContact O-CB 3.48Å; L380-A384 PolarHBondContact O-N 3.35Å
381	I	75.3	Confident	71	Confident	82 Å²	82	113.1 Å²	113.1	42%	0.421	56%	0.559	S	S	.	*	H	α-helix	trans	-60.9	-47.7	174.4	-70.9	164.4	0	0	0	110.3	M377 Y378 N383 A384 I385	M377-I381 HydrophobicContact CG-CD1 3.73Å; M377-I381 HydrophobicContact CG-CG1 4.36Å; M377-I381 WeakPolarHBondContact O-CB 3.43Å; M377-I381 VanDerWaalsContact O-CG1 3.25Å; M377-I381 WeakPolarHBondContact O-CG1 3.49Å; M377-I381 PolarHBondContact O-N 2.78Å; Y378-I381 PolarHBondContact O-N 3.4Å; I381-N383 VanDerWaalsContact C-N 3.32Å; I381-N383 PolarHBondContact O-N 2.94Å; I381-A384 PolarHBondContact O-N 2.65Å; I381-A384 VanDerWaalsContact O-N 3.16Å; I381-I385 HydrophobicContact CG2-CD1 3.75Å; I381-I385 HydrophobicContact CG2-CG1 4.44Å; I381-I385 VanDerWaalsContact O-CG1 3.32Å; I381-I385 WeakPolarHBondContact O-CG1 3.36Å; I381-I385 PolarHBondContact O-N 2.7Å
382	Q	77.3	Confident	73	Confident	79 Å²	79	105.4 Å²	105.4	37%	0.369	54%	0.537	S	S	.	.	H	α-helix	trans	-60.2	-40	176.2	-70.5	-67.3	-16	0	0	112.2	Y378 K386	Y378-Q382 HydrophobicContact CD1-CG 3.93Å; Y378-Q382 HydrophobicContact CE1-CG 3.9Å; Y378-Q382 WeakPolarHBondContact O-CB 3.4Å; Y378-Q382 VanDerWaalsContact O-CG 3.26Å; Y378-Q382 WeakPolarHBondContact O-CG 3.22Å; Y378-Q382 PolarHBondContact O-N 2.95Å; Q382-K386 VanDerWaalsContact O-CB 3.29Å; Q382-K386 WeakPolarHBondContact O-CB 3.21Å; Q382-K386 PolarHBondContact O-N 3.41Å
383	N	80.9	Confident	75.2	Confident	80 Å²	80	104 Å²	104	43%	0.428	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-40	174.6	-74.7	-32.3	0	0	0	112.4	Q379 L380 I381 K386 E387	Q379-N383 WeakPolarHBondContact O-CB 3.24Å; Q379-N383 PolarHBondContact O-N 2.91Å; Q379-N383 PolarHBondContact O-ND2 3.27Å; L380-N383 PolarHBondContact O-N 3.39Å; I381-N383 VanDerWaalsContact C-N 3.32Å; I381-N383 PolarHBondContact O-N 2.94Å; N383-K386 PolarHBondContact O-N 3.14Å; N383-E387 PolarHBondContact O-N 3.23Å
384	A	79.8	Confident	77.1	Confident	63 Å²	63	104.7 Å²	104.7	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-44.2	176.7	0	0	0	0	0	112.1	L380 I381 K386 E387 H388	L380-A384 WeakPolarHBondContact O-CB 3.48Å; L380-A384 PolarHBondContact O-N 3.35Å; I381-A384 PolarHBondContact O-N 2.65Å; I381-A384 VanDerWaalsContact O-N 3.16Å; A384-K386 VanDerWaalsContact C-N 3.31Å; A384-K386 PolarHBondContact O-N 3.29Å; A384-E387 PolarHBondContact O-N 2.88Å; A384-H388 WeakPolarHBondContact O-CB 3.45Å; A384-H388 PolarHBondContact O-N 2.89Å
385	I	83.8	Confident	78.4	Confident	79 Å²	79	108 Å²	108	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-58.7	-44.3	174.1	-68.3	165.8	0	0	0	110.5	I381 H388 Q389	I381-I385 HydrophobicContact CG2-CD1 3.75Å; I381-I385 HydrophobicContact CG2-CG1 4.44Å; I381-I385 VanDerWaalsContact O-CG1 3.32Å; I381-I385 WeakPolarHBondContact O-CG1 3.36Å; I381-I385 PolarHBondContact O-N 2.7Å; I385-H388 PolarHBondContact O-N 2.86Å; I385-Q389 PolarHBondContact O-N 3.39Å
386	K	83.3	Confident	79.6	Confident	145 Å²	145	105.5 Å²	105.5	63%	0.63	52%	0.519	S	S	*	.	H	α-helix	trans	-66.3	-42.8	-178.5	-169.3	171.5	-175.2	173.2	0	113.1	Q382 N383 A384 K390	Q382-K386 VanDerWaalsContact O-CB 3.29Å; Q382-K386 WeakPolarHBondContact O-CB 3.21Å; Q382-K386 PolarHBondContact O-N 3.41Å; N383-K386 PolarHBondContact O-N 3.14Å; A384-K386 VanDerWaalsContact C-N 3.31Å; A384-K386 PolarHBondContact O-N 3.29Å; K386-K390 WeakPolarHBondContact O-CB 3.22Å; K386-K390 PolarHBondContact O-N 3.31Å; K386-K390 VanDerWaalsContact O-N 3.15Å
387	E	79	Confident	80.6	Confident	107 Å²	107	107.6 Å²	107.6	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-71	-32.8	173.6	-72.2	-64.9	125.4	0	0	112.1	N383 A384 K390 L391	N383-E387 PolarHBondContact O-N 3.23Å; A384-E387 PolarHBondContact O-N 2.88Å; E387-K390 PolarHBondContact O-N 2.84Å; E387-K390 VanDerWaalsContact OE1-CD 3.3Å; E387-K390 WeakPolarHBondContact OE1-CD 3.27Å; E387-K390 IonicContact OE1-NZ 3.57Å; E387-K390 PolarHBondContact OE1-NZ 3.32Å; E387-K390 WeakPolarHBondContact OE2-CD 3.38Å; E387-K390 IonicContact OE2-NZ 2.7Å; E387-K390 PolarHBondContact OE2-NZ 2.61Å; E387-L391 WeakPolarHBondContact O-CB 3.43Å; E387-L391 PolarHBondContact O-N 3.11Å
388	H	82.7	Confident	81.7	Confident	125 Å²	125	109.5 Å²	109.5	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-62.8	-49.5	172.3	-176.3	0.6	0	0	0	111.6	A384 I385 K390 L391 T392	A384-H388 WeakPolarHBondContact O-CB 3.45Å; A384-H388 PolarHBondContact O-N 2.89Å; I385-H388 PolarHBondContact O-N 2.86Å; H388-K390 VanDerWaalsContact C-N 3.28Å; H388-K390 PolarHBondContact O-N 2.82Å; H388-L391 PolarHBondContact O-N 3.22Å; H388-L391 VanDerWaalsContact O-N 3.16Å; H388-T392 PolarHBondContact CE1-OG1 3.13Å; H388-T392 VanDerWaalsContact CE1-OG1 3.31Å; H388-T392 PolarHBondContact ND1-OG1 2.79Å; H388-T392 PolarHBondContact O-N 2.92Å; H388-T392 PolarHBondContact O-OG1 3.32Å; H388-T392 VanDerWaalsContact O-OG1 3.06Å
389	Q	85.2	Confident	82.7	Confident	123 Å²	123	106.2 Å²	106.2	58%	0.575	52%	0.519	S	S	*	.	H	α-helix	trans	-56.9	-42.4	176.4	-76.8	-175.8	-13.2	0	0	112	I385 T392 N393	I385-Q389 PolarHBondContact O-N 3.39Å; Q389-T392 PolarHBondContact O-N 2.84Å; Q389-N393 WeakPolarHBondContact O-CB 3.37Å; Q389-N393 VanDerWaalsContact O-CG 3.3Å; Q389-N393 PolarHBondContact O-N 3.42Å; Q389-N393 PolarHBondContact O-ND2 3.35Å; Q389-N393 VanDerWaalsContact O-ND2 3.1Å
390	K	86.4	Confident	83.5	Confident	94 Å²	94	105.2 Å²	105.2	41%	0.409	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-42.1	176.6	177.7	-174.5	170.2	-158.2	0	112.3	K386 E387 H388 N393 Q394	K386-K390 WeakPolarHBondContact O-CB 3.22Å; K386-K390 PolarHBondContact O-N 3.31Å; K386-K390 VanDerWaalsContact O-N 3.15Å; E387-K390 PolarHBondContact O-N 2.84Å; E387-K390 VanDerWaalsContact OE1-CD 3.3Å; E387-K390 WeakPolarHBondContact OE1-CD 3.27Å; E387-K390 IonicContact OE1-NZ 3.57Å; E387-K390 PolarHBondContact OE1-NZ 3.32Å; E387-K390 WeakPolarHBondContact OE2-CD 3.38Å; E387-K390 IonicContact OE2-NZ 2.7Å; E387-K390 PolarHBondContact OE2-NZ 2.61Å; H388-K390 VanDerWaalsContact C-N 3.28Å; H388-K390 PolarHBondContact O-N 2.82Å; K390-N393 PolarHBondContact O-N 3.3Å; K390-Q394 PolarHBondContact O-N 2.61Å
391	L	83	Confident	84.2	Confident	111 Å²	111	103.9 Å²	103.9	58%	0.581	51%	0.507	S	S	*	.	H	α-helix	trans	-67.7	-41.2	175.2	-174.4	63	0	0	0	112	E387 H388 N393 Q394 F395	E387-L391 WeakPolarHBondContact O-CB 3.43Å; E387-L391 PolarHBondContact O-N 3.11Å; H388-L391 PolarHBondContact O-N 3.22Å; H388-L391 VanDerWaalsContact O-N 3.16Å; L391-N393 PolarHBondContact O-N 2.92Å; L391-Q394 WeakPolarHBondContact O-CB 3.44Å; L391-Q394 PolarHBondContact O-N 2.89Å; L391-F395 PolarHBondContact O-N 2.69Å
392	T	84.3	Confident	84.8	Confident	68 Å²	68	104.6 Å²	104.6	42%	0.417	51%	0.511	S	S	.	.	H	α-helix	trans	-59.9	-45.4	173.9	-58.4	0	0	0	0	111.1	H388 Q389 Q394 F395 Q396	H388-T392 PolarHBondContact CE1-OG1 3.13Å; H388-T392 VanDerWaalsContact CE1-OG1 3.31Å; H388-T392 PolarHBondContact ND1-OG1 2.79Å; H388-T392 PolarHBondContact O-N 2.92Å; H388-T392 PolarHBondContact O-OG1 3.32Å; H388-T392 VanDerWaalsContact O-OG1 3.06Å; Q389-T392 PolarHBondContact O-N 2.84Å; T392-Q394 VanDerWaalsContact C-N 3.31Å; T392-Q394 PolarHBondContact O-N 2.57Å; T392-F395 PolarHBondContact O-N 3.25Å; T392-Q396 PolarHBondContact O-N 2.9Å
393	N	86.8	Confident	85.4	Confident	100 Å²	100	107.6 Å²	107.6	54%	0.535	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-33.2	175.3	-75.4	-37.7	0	0	0	113	Q389 K390 L391 R397	Q389-N393 WeakPolarHBondContact O-CB 3.37Å; Q389-N393 VanDerWaalsContact O-CG 3.3Å; Q389-N393 PolarHBondContact O-N 3.42Å; Q389-N393 PolarHBondContact O-ND2 3.35Å; Q389-N393 VanDerWaalsContact O-ND2 3.1Å; K390-N393 PolarHBondContact O-N 3.3Å; L391-N393 PolarHBondContact O-N 2.92Å; N393-R397 WeakPolarHBondContact O-CG 3.5Å; N393-R397 PolarHBondContact O-N 2.87Å
394	Q	85.5	Confident	85.9	Confident	111 Å²	111	109 Å²	109	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-70.1	-41	173.3	-175.7	174.5	-8.5	0	0	111.7	K390 L391 T392 R397 F398	K390-Q394 PolarHBondContact O-N 2.61Å; L391-Q394 WeakPolarHBondContact O-CB 3.44Å; L391-Q394 PolarHBondContact O-N 2.89Å; T392-Q394 VanDerWaalsContact C-N 3.31Å; T392-Q394 PolarHBondContact O-N 2.57Å; Q394-R397 PolarHBondContact O-N 3.12Å; Q394-F398 PolarHBondContact O-N 2.97Å; Q394-F398 VanDerWaalsContact O-N 3.07Å
395	F	85.2	Confident	86.3	Confident	148 Å²	148	108.9 Å²	108.9	65%	0.649	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-41.1	176	-169.9	-93.7	0	0	0	111.9	L391 T392 R397 F398 S399	L391-F395 PolarHBondContact O-N 2.69Å; T392-F395 PolarHBondContact O-N 3.25Å; F395-R397 PolarHBondContact O-N 2.78Å; F395-F398 PolarHBondContact O-N 2.8Å; F395-S399 PolarHBondContact O-N 3.43Å
396	Q	86.6	Confident	86.5	Confident	112 Å²	112	108.3 Å²	108.3	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-56.7	-50	175.6	-163.8	71.8	8.3	0	0	111.4	T392 F398 S399 E400	T392-Q396 PolarHBondContact O-N 2.9Å; Q396-F398 PolarHBondContact O-N 3.12Å; Q396-S399 WeakPolarHBondContact O-CB 3.49Å; Q396-S399 PolarHBondContact O-N 3.15Å; Q396-E400 PolarHBondContact O-N 2.89Å
397	R	88.8	Confident	86.8	Confident	174 Å²	174	104.3 Å²	104.3	66%	0.657	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-41.6	176.9	-70.1	174.3	-177.9	-164.7	0.2	112.6	N393 Q394 F395 S399 E400 D401	N393-R397 WeakPolarHBondContact O-CG 3.5Å; N393-R397 PolarHBondContact O-N 2.87Å; Q394-R397 PolarHBondContact O-N 3.12Å; F395-R397 PolarHBondContact O-N 2.78Å; R397-S399 VanDerWaalsContact C-N 3.3Å; R397-S399 PolarHBondContact O-N 3.34Å; R397-E400 PolarHBondContact O-N 3.25Å; R397-D401 PolarHBondContact O-N 3.1Å
398	F	87.6	Confident	87.4	Confident	142 Å²	142	103.9 Å²	103.9	62%	0.623	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-36.1	176.8	-170.7	-96.8	0	0	0	112.1	Q394 F395 Q396 D401 L402	Q394-F398 PolarHBondContact O-N 2.97Å; Q394-F398 VanDerWaalsContact O-N 3.07Å; F395-F398 PolarHBondContact O-N 2.8Å; Q396-F398 PolarHBondContact O-N 3.12Å; F398-D401 PolarHBondContact O-N 2.89Å; F398-L402 VanDerWaalsContact O-CB 3.32Å; F398-L402 WeakPolarHBondContact O-CB 3.11Å; F398-L402 PolarHBondContact O-N 3.12Å
399	S	87	Confident	87.7	Confident	59 Å²	59	102.9 Å²	102.9	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-64.2	-45	173.3	-164.7	0	0	0	0	111.9	F395 Q396 R397 D401 L402 Q403	F395-S399 PolarHBondContact O-N 3.43Å; Q396-S399 WeakPolarHBondContact O-CB 3.49Å; Q396-S399 PolarHBondContact O-N 3.15Å; R397-S399 VanDerWaalsContact C-N 3.3Å; R397-S399 PolarHBondContact O-N 3.34Å; S399-D401 PolarHBondContact O-N 3.13Å; S399-L402 PolarHBondContact O-N 3.15Å; S399-Q403 WeakPolarHBondContact O-CB 3.46Å; S399-Q403 PolarHBondContact O-N 3.39Å
400	E	89.1	Confident	87.8	Confident	87 Å²	87	101.4 Å²	101.4	41%	0.407	51%	0.513	S	S	.	.	H	α-helix	trans	-60.6	-44.4	174.6	-67.3	175.9	-152.8	0	0	112.6	Q396 R397 Q403 K404	Q396-E400 PolarHBondContact O-N 2.89Å; R397-E400 PolarHBondContact O-N 3.25Å; E400-Q403 PolarHBondContact O-N 3.47Å; E400-K404 WeakPolarHBondContact O-CD 3.37Å; E400-K404 WeakPolarHBondContact O-CE 3.35Å; E400-K404 VanDerWaalsContact O-CG 3.24Å; E400-K404 WeakPolarHBondContact O-CG 3.39Å; E400-K404 PolarHBondContact O-N 3.26Å; E400-K404 IonicContact OE2-NZ 3.11Å; E400-K404 PolarHBondContact OE2-NZ 3.25Å
401	D	90.4	Very high	87.8	Confident	92 Å²	92	100.2 Å²	100.2	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-70.4	-33.1	-179	-72.2	-15.5	0	0	0	112	R397 F398 S399 K404 S405	R397-D401 PolarHBondContact O-N 3.1Å; F398-D401 PolarHBondContact O-N 2.89Å; S399-D401 PolarHBondContact O-N 3.13Å; D401-K404 IonicContact OD1-NZ 3.17Å; D401-K404 PolarHBondContact OD1-NZ 2.9Å; D401-S405 WeakPolarHBondContact O-CB 3.42Å; D401-S405 PolarHBondContact O-N 3.43Å
402	L	89.2	Confident	88.1	Confident	97 Å²	97	98.8 Å²	98.8	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-44.5	168.2	-177.7	61.3	0	0	0	111.2	F398 S399 K404 S405 T406	F398-L402 VanDerWaalsContact O-CB 3.32Å; F398-L402 WeakPolarHBondContact O-CB 3.11Å; F398-L402 PolarHBondContact O-N 3.12Å; S399-L402 PolarHBondContact O-N 3.15Å; L402-K404 PolarHBondContact O-N 3.43Å; L402-S405 WeakPolarHBondContact O-CB 3.49Å; L402-S405 PolarHBondContact O-N 3.14Å; L402-S405 VanDerWaalsContact O-N 3.15Å; L402-T406 PolarHBondContact O-N 3.18Å; L402-T406 PolarHBondContact O-OG1 3.03Å
403	Q	89.1	Confident	88.3	Confident	142 Å²	142	101 Å²	101	66%	0.664	52%	0.517	S	S	*	.	H	α-helix	trans	-63.9	-40.4	178.1	-166.4	176.4	15.1	0	0	112.3	S399 E400 S405 T406 A407	S399-Q403 WeakPolarHBondContact O-CB 3.46Å; S399-Q403 PolarHBondContact O-N 3.39Å; E400-Q403 PolarHBondContact O-N 3.47Å; Q403-S405 VanDerWaalsContact C-N 3.33Å; Q403-S405 PolarHBondContact O-N 2.8Å; Q403-T406 PolarHBondContact O-N 2.72Å; Q403-A407 WeakPolarHBondContact O-CB 3.31Å; Q403-A407 PolarHBondContact O-N 2.84Å
404	K	91.1	Very high	88.2	Confident	110 Å²	110	99.7 Å²	99.7	48%	0.478	52%	0.516	S	S	.	.	H	α-helix	trans	-60.2	-42	171.5	-67.3	160.4	-148.5	159.5	0	111.2	E400 D401 L402 A407 N408	E400-K404 WeakPolarHBondContact O-CD 3.37Å; E400-K404 WeakPolarHBondContact O-CE 3.35Å; E400-K404 VanDerWaalsContact O-CG 3.24Å; E400-K404 WeakPolarHBondContact O-CG 3.39Å; E400-K404 PolarHBondContact O-N 3.26Å; E400-K404 IonicContact OE2-NZ 3.11Å; E400-K404 PolarHBondContact OE2-NZ 3.25Å; D401-K404 IonicContact OD1-NZ 3.17Å; D401-K404 PolarHBondContact OD1-NZ 2.9Å; L402-K404 PolarHBondContact O-N 3.43Å; K404-A407 PolarHBondContact O-N 3.37Å; K404-N408 PolarHBondContact O-N 2.97Å; K404-N408 VanDerWaalsContact O-N 3.1Å
405	S	87.9	Confident	88.2	Confident	61 Å²	61	98 Å²	98	43%	0.427	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-47	176.8	-167.7	0	0	0	0	112.2	D401 L402 Q403 A407 N408 L409	D401-S405 WeakPolarHBondContact O-CB 3.42Å; D401-S405 PolarHBondContact O-N 3.43Å; L402-S405 WeakPolarHBondContact O-CB 3.49Å; L402-S405 PolarHBondContact O-N 3.14Å; L402-S405 VanDerWaalsContact O-N 3.15Å; Q403-S405 VanDerWaalsContact C-N 3.33Å; Q403-S405 PolarHBondContact O-N 2.8Å; S405-A407 PolarHBondContact O-N 3.41Å; S405-N408 WeakPolarHBondContact O-CB 3.43Å; S405-N408 PolarHBondContact O-N 3.4Å; S405-L409 PolarHBondContact O-N 3.03Å
406	T	88.8	Confident	88.2	Confident	66 Å²	66	96 Å²	96	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-42.2	175.7	-59.5	0	0	0	0	112.1	L402 Q403 N408 L409 N410	L402-T406 PolarHBondContact O-N 3.18Å; L402-T406 PolarHBondContact O-OG1 3.03Å; Q403-T406 PolarHBondContact O-N 2.72Å; T406-N408 VanDerWaalsContact C-N 3.32Å; T406-N408 PolarHBondContact O-N 3.44Å; T406-L409 PolarHBondContact O-N 2.69Å; T406-N410 PolarHBondContact O-N 3.47Å
407	A	89.5	Confident	88	Confident	61 Å²	61	93 Å²	93	50%	0.504	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-39.6	175.7	0	0	0	0	0	112.5	Q403 K404 S405 N410 S411	Q403-A407 WeakPolarHBondContact O-CB 3.31Å; Q403-A407 PolarHBondContact O-N 2.84Å; K404-A407 PolarHBondContact O-N 3.37Å; S405-A407 PolarHBondContact O-N 3.41Å; A407-N410 PolarHBondContact O-N 3.02Å; A407-S411 PolarHBondContact O-N 2.94Å; A407-S411 VanDerWaalsContact O-N 3.09Å
408	N	91.2	Very high	87.6	Confident	98 Å²	98	89.9 Å²	89.9	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-44.8	175.3	-171.5	31.9	0	0	0	112	K404 S405 T406 N410 S411 I412	K404-N408 PolarHBondContact O-N 2.97Å; K404-N408 VanDerWaalsContact O-N 3.1Å; S405-N408 WeakPolarHBondContact O-CB 3.43Å; S405-N408 PolarHBondContact O-N 3.4Å; T406-N408 VanDerWaalsContact C-N 3.32Å; T406-N408 PolarHBondContact O-N 3.44Å; N408-N410 VanDerWaalsContact C-N 3.34Å; N408-N410 PolarHBondContact O-N 2.9Å; N408-S411 WeakPolarHBondContact O-CB 3.48Å; N408-S411 PolarHBondContact O-N 3.43Å; N408-I412 WeakPolarHBondContact O-CG1 3.48Å; N408-I412 PolarHBondContact O-N 2.83Å
409	L	88.1	Confident	87	Confident	104 Å²	104	86 Å²	86	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-40.7	176	-69.6	177.3	0	0	0	112.3	S405 T406 S411 I412 L413	S405-L409 PolarHBondContact O-N 3.03Å; T406-L409 PolarHBondContact O-N 2.69Å; L409-S411 VanDerWaalsContact C-N 3.34Å; L409-S411 PolarHBondContact O-N 3.28Å; L409-I412 PolarHBondContact O-N 3.38Å; L409-L413 WeakPolarHBondContact O-CB 3.35Å; L409-L413 PolarHBondContact O-N 3.17Å
410	N	88	Confident	86.4	Confident	92 Å²	92	88.8 Å²	88.8	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-63.5	-39	175.7	-70.9	-7	0	0	0	111.7	T406 A407 N408 L413 S414	T406-N410 PolarHBondContact O-N 3.47Å; A407-N410 PolarHBondContact O-N 3.02Å; N408-N410 VanDerWaalsContact C-N 3.34Å; N408-N410 PolarHBondContact O-N 2.9Å; N410-L413 PolarHBondContact O-N 3.01Å; N410-S414 PolarHBondContact O-N 3.36Å; N410-S414 PolarHBondContact O-OG 3.23Å
411	S	87.5	Confident	85.6	Confident	70 Å²	70	94.3 Å²	94.3	49%	0.49	52%	0.523	S	S	.	.	H	α-helix	trans	-62.9	-41.7	174.4	-170.6	0	0	0	0	112.6	A407 N408 L409 S414 S415	A407-S411 PolarHBondContact O-N 2.94Å; A407-S411 VanDerWaalsContact O-N 3.09Å; N408-S411 WeakPolarHBondContact O-CB 3.48Å; N408-S411 PolarHBondContact O-N 3.43Å; L409-S411 VanDerWaalsContact C-N 3.34Å; L409-S411 PolarHBondContact O-N 3.28Å; S411-S414 PolarHBondContact O-N 3.33Å; S411-S415 WeakPolarHBondContact O-CB 3.5Å; S411-S415 PolarHBondContact O-N 3.12Å; S411-S415 PolarHBondContact O-OG 3.03Å
412	I	89.5	Confident	84.4	Confident	80 Å²	80	98.8 Å²	98.8	41%	0.41	54%	0.538	S	S	.	.	H	α-helix	trans	-64.6	-44.2	175	-66	164.6	0	0	0	110.5	N408 L409 S414 S415 L416	N408-I412 WeakPolarHBondContact O-CG1 3.48Å; N408-I412 PolarHBondContact O-N 2.83Å; L409-I412 PolarHBondContact O-N 3.38Å; I412-S414 PolarHBondContact O-N 3.27Å; I412-S415 WeakPolarHBondContact O-CB 3.45Å; I412-S415 PolarHBondContact O-N 2.83Å; I412-S415 VanDerWaalsContact O-N 3.16Å; I412-L416 HydrophobicContact CG2-CD1 4.01Å; I412-L416 WeakPolarHBondContact O-CG 3.49Å; I412-L416 PolarHBondContact O-N 3.47Å
413	L	86.5	Confident	82.7	Confident	115 Å²	115	97.6 Å²	97.6	60%	0.602	54%	0.543	S	S	*	.	H	α-helix	trans	-63.3	-41.4	178.1	-171.7	67	0	0	0	112.1	L409 N410 S415 L416 S417	L409-L413 WeakPolarHBondContact O-CB 3.35Å; L409-L413 PolarHBondContact O-N 3.17Å; N410-L413 PolarHBondContact O-N 3.01Å; L413-S415 VanDerWaalsContact C-N 3.32Å; L413-S415 PolarHBondContact O-N 2.89Å; L413-L416 PolarHBondContact O-N 3.12Å; L413-S417 PolarHBondContact O-N 3.34Å; L413-S417 PolarHBondContact O-OG 3.15Å
414	S	85.5	Confident	81.1	Confident	73 Å²	73	97 Å²	97	51%	0.51	55%	0.551	S	S	.	*	H	α-helix	trans	-63.7	-36.3	172.6	-60.7	0	0	0	0	112.6	N410 S411 I412 S417 M418	N410-S414 PolarHBondContact O-N 3.36Å; N410-S414 PolarHBondContact O-OG 3.23Å; S411-S414 PolarHBondContact O-N 3.33Å; I412-S414 PolarHBondContact O-N 3.27Å; S414-S417 PolarHBondContact O-OG 2.98Å; S414-M418 WeakPolarHBondContact O-CG 3.29Å; S414-M418 PolarHBondContact O-N 3.23Å
415	S	86.2	Confident	79	Confident	76 Å²	76	98.4 Å²	98.4	53%	0.531	56%	0.562	S	S	.	*	H	α-helix	trans	-67.8	-41.2	176.9	-57.5	0	0	0	0	111.6	S411 I412 L413 A419	S411-S415 WeakPolarHBondContact O-CB 3.5Å; S411-S415 PolarHBondContact O-N 3.12Å; S411-S415 PolarHBondContact O-OG 3.03Å; I412-S415 WeakPolarHBondContact O-CB 3.45Å; I412-S415 PolarHBondContact O-N 2.83Å; I412-S415 VanDerWaalsContact O-N 3.16Å; L413-S415 VanDerWaalsContact C-N 3.32Å; L413-S415 PolarHBondContact O-N 2.89Å; S415-A419 PolarHBondContact O-N 2.72Å
416	L	83.7	Confident	76.8	Confident	104 Å²	104	99.1 Å²	99.1	55%	0.545	58%	0.579	S	S	.	*	H	α-helix	trans	-67.5	-41.6	176.4	-72.1	166.9	0	0	0	112.4	I412 L413 M418 A419 V420	I412-L416 HydrophobicContact CG2-CD1 4.01Å; I412-L416 WeakPolarHBondContact O-CG 3.49Å; I412-L416 PolarHBondContact O-N 3.47Å; L413-L416 PolarHBondContact O-N 3.12Å; L416-M418 VanDerWaalsContact C-N 3.3Å; L416-M418 PolarHBondContact O-N 2.83Å; L416-A419 WeakPolarHBondContact O-CB 3.22Å; L416-A419 PolarHBondContact O-N 3.04Å; L416-A419 VanDerWaalsContact O-N 3.07Å; L416-V420 PolarHBondContact O-N 3.32Å
417	S	82.7	Confident	74.9	Confident	50 Å²	50	103.7 Å²	103.7	35%	0.35	60%	0.596	S	S	.	*	H	α-helix	trans	-67.1	-30.5	179.2	72.1	0	0	0	0	112.9	L413 S414 R421	L413-S417 PolarHBondContact O-N 3.34Å; L413-S417 PolarHBondContact O-OG 3.15Å; S414-S417 PolarHBondContact O-OG 2.98Å; S417-R421 WeakPolarHBondContact O-CG 3.21Å; S417-R421 PolarHBondContact O-N 3.37Å
418	M	80.1	Confident	72.8	Confident	108 Å²	108	108.8 Å²	108.8	53%	0.532	62%	0.615	S	S	.	*	H	α-helix	trans	-70.8	-28.1	170.4	-69.2	-61.1	104.6	0	0	113.4	S414 L416	S414-M418 WeakPolarHBondContact O-CG 3.29Å; S414-M418 PolarHBondContact O-N 3.23Å; L416-M418 VanDerWaalsContact C-N 3.3Å; L416-M418 PolarHBondContact O-N 2.83Å
419	A	76.6	Confident	70.5	Confident	62 Å²	62	110.3 Å²	110.3	51%	0.512	63%	0.627	S	S	.	*	H	α-helix	trans	-73.9	-44.5	174.8	0	0	0	0	0	111.9	S415 L416 R421 K422	S415-A419 PolarHBondContact O-N 2.72Å; L416-A419 WeakPolarHBondContact O-CB 3.22Å; L416-A419 PolarHBondContact O-N 3.04Å; L416-A419 VanDerWaalsContact O-N 3.07Å; A419-R421 VanDerWaalsContact C-N 3.28Å; A419-R421 PolarHBondContact O-N 3.01Å; A419-K422 PolarHBondContact O-N 3.07Å; A419-K422 VanDerWaalsContact O-N 3.12Å
420	V	74.4	Confident	68.8	Low	116 Å²	116	111.9 Å²	111.9	70%	0.703	64%	0.644	S	S	*	*	H	α-helix	trans	-60.2	-37.1	178.4	175	0	0	0	0	111.7	L416 K422	L416-V420 PolarHBondContact O-N 3.32Å; V420-K422 PolarHBondContact O-N 3.46Å
421	R	71	Confident	66.7	Low	203 Å²	203	114.9 Å²	114.9	77%	0.766	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	3.4	177.4	-70.2	179.3	-173.6	-136.4	0.6	115.1	S417 A419	S417-R421 WeakPolarHBondContact O-CG 3.21Å; S417-R421 PolarHBondContact O-N 3.37Å; A419-R421 VanDerWaalsContact C-N 3.28Å; A419-R421 PolarHBondContact O-N 3.01Å
422	K	66.1	Low	64.8	Low	186 Å²	186	119.1 Å²	119.1	81%	0.809	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	1.9	-179.5	-74.6	-170.7	172	-172.1	0	115.4	A419 V420	A419-K422 PolarHBondContact O-N 3.07Å; A419-K422 VanDerWaalsContact O-N 3.12Å; V420-K422 PolarHBondContact O-N 3.46Å
423	A	53.8	Low	62.8	Low	72 Å²	72	121 Å²	121	60%	0.595	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-102.4	122	-179.1	0	0	0	0	0	112.1
424	P	54.7	Low	60.7	Low	129 Å²	129	120 Å²	120	84%	0.838	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-70.2	153.4	170.7	-17.3	32	0	0	0	112.4
425	I	46.8	Very low	59.2	Low	141 Å²	141	124.1 Å²	124.1	72%	0.723	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-102.9	138.8	-177.4	-56.9	172.9	0	0	0	110.3	H427	I425-H427 WeakPolarHBondContact CG2-NE2 3.43Å
426	G	43	Very low	57.4	Low	76 Å²	76	126 Å²	126	78%	0.784	71%	0.709	S	S	*	*			trans	-131.3	132.2	166.1	0	0	0	0	0	110.2
427	H	48.8	Very low	55.9	Low	161 Å²	161	127 Å²	127	75%	0.745	72%	0.722	S	S	*	*			trans	-107.3	152	-174.7	-56.8	-88.7	0	0	0	111.9	I425	I425-H427 WeakPolarHBondContact CG2-NE2 3.43Å
428	N	43.6	Very low	54.1	Low	169 Å²	169	131.1 Å²	131.1	90%	0.904	75%	0.746	S	S	*	*			trans	-166.3	134.1	148.5	-103.9	-32.2	0	0	0	112.1
429	T	44.8	Very low	52.5	Low	129 Å²	129	134.6 Å²	134.6	79%	0.791	76%	0.761	S	S	*	*			trans	-156.6	130.3	177.2	47.5	0	0	0	0	110.5
430	P	50.9	Low	51	Low	137 Å²	137	138 Å²	138	89%	0.89	78%	0.775	S	S	*	*			trans	-95.5	163.3	173.3	34.7	-29.5	0	0	0	113.6
431	H	44.3	Very low	49.4	Very low	156 Å²	156	135.8 Å²	135.8	72%	0.722	78%	0.776	S	S	*	*			trans	-154.8	128.6	-159.2	177.1	-58.2	0	0	0	112.9	N433	H431-N433 PolarHBondContact CE1-OD1 3.38Å; H431-N433 PolarHBondContact ND1-OD1 2.68Å
432	I	47.5	Very low	48.3	Very low	159 Å²	159	134.3 Å²	134.3	82%	0.815	78%	0.782	S	S	*	*			trans	-150.2	117	174.3	-52.7	-178.3	0	0	0	106.3
433	N	48.6	Very low	47.3	Very low	120 Å²	120	130.7 Å²	130.7	64%	0.642	78%	0.778	S	S	*	*				75.1	140.6	58.5	-67.6	3.2	0	0	0	114	H431	H431-N433 PolarHBondContact CE1-OD1 3.38Å; H431-N433 PolarHBondContact ND1-OD1 2.68Å
434	S	42.5	Very low	46.8	Very low	92 Å²	92	133.2 Å²	133.2	64%	0.643	79%	0.786	S	S	*	*			cis	-176.5	174.6	-12.5	47.8	0	0	0	0	111.1
435	L	52.9	Low	46.4	Very low	160 Å²	160	133.9 Å²	133.9	84%	0.838	79%	0.787	S	S	*	*			trans	88.2	155.7	164.9	-53.8	164.6	0	0	0	118.3
436	P	49	Very low	46.2	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	79%	0.788	S	S	*	*				-135.8	169.1	-50.6	39.4	-24.1	0	0	0	114.4
437	P	50.8	Low	46.2	Very low	126 Å²	126	139.6 Å²	139.6	82%	0.818	79%	0.791	S	S	*	*			trans	-118.5	167.3	-172.4	41.7	-32.2	0	0	0	116.9
438	T	46.1	Very low	46.3	Very low	137 Å²	137	137.7 Å²	137.7	84%	0.84	79%	0.792	S	S	*	*			trans	-137.4	120.1	168	50.9	0	0	0	0	114.2
439	Q	46.2	Very low	46.1	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	79%	0.785	S	S	*	*			trans	-0.2	149.7	152.4	-41.9	-178.1	51.4	0	0	119.2
440	T	44.8	Very low	45.8	Very low	134 Å²	134	137.5 Å²	137.5	82%	0.822	79%	0.788	S	S	*	*			cis	-160.9	153.7	47.3	50.4	0	0	0	0	115.6
441	G	41.3	Very low	45.4	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	78%	0.777	S	S	*	*			trans	84.1	109.1	157.4	0	0	0	0	0	117.4
442	L	47.8	Very low	44.9	Very low	171 Å²	171	137.5 Å²	137.5	90%	0.895	79%	0.786	S	S	*	*				79.7	140.3	60.8	-68.3	170.6	0	0	0	115.3
443	P	45.3	Very low	44.7	Very low	111 Å²	111	136.9 Å²	136.9	72%	0.721	78%	0.782	S	S	*	*			cis	-139	148.4	-22.4	38.2	-19.8	0	0	0	117.8
444	T	42.4	Very low	44.1	Very low	125 Å²	125	138.1 Å²	138.1	77%	0.767	79%	0.789	S	S	*	*			trans	2.6	130.5	148.8	-45	0	0	0	0	123.6
445	V	46.5	Very low	44	Very low	142 Å²	142	138.9 Å²	138.9	86%	0.861	79%	0.789	S	S	*	*			trans	-144.2	137.7	134.8	-179.7	0	0	0	0	108.5
446	P	43.3	Very low	43.2	Very low	114 Å²	114	136.5 Å²	136.5	74%	0.74	78%	0.778	S	S	*	*			trans	-94	162.2	-165.7	36.2	-36.9	0	0	0	116.4
447	R	43.4	Very low	42.8	Very low	224 Å²	224	138.1 Å²	138.1	85%	0.845	78%	0.779	S	S	*	*			trans	-105.8	131.8	172.2	176.6	-175.1	176.8	-162.7	-1.3	110.5
448	P	50.2	Low	42.3	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	77%	0.773	S	S	*	*			trans	-74.9	145.4	175.1	30.5	-34.4	0	0	0	112.3
449	T	38.5	Very low	42	Very low	122 Å²	122	140.3 Å²	140.3	75%	0.748	77%	0.773	S	S	*	*			trans	-126.3	107.4	170.7	48.5	0	0	0	0	110.1
450	M	38.5	Very low	41.5	Very low	172 Å²	172	143.7 Å²	143.7	85%	0.847	78%	0.778	S	S	*	*			trans	-153.6	151.7	164.9	-74.1	-166.4	175.3	0	0	107.9
451	N	42.6	Very low	41.1	Very low	124 Å²	124	141.1 Å²	141.1	66%	0.663	78%	0.778	S	S	*	*			cis	-153.4	151.6	-22.8	-100.7	-16.5	0	0	0	105.9	I453	N451-I453 PolarHBondContact O-N 3.18Å
452	D	35	Very low	40.9	Very low	170 Å²	170	149.4 Å²	149.4	91%	0.909	79%	0.788	S	S	*	*			trans	-69.4	125.8	169.8	-73.4	-66.6	0	0	0	110.1
453	I	42.5	Very low	40.7	Very low	146 Å²	146	150 Å²	150	75%	0.749	79%	0.786	S	S	*	*			trans	-109.4	94.7	175.2	-54.8	-177	0	0	0	108.8	N451 V455	N451-I453 PolarHBondContact O-N 3.18Å; I453-V455 HydrophobicContact CG2-CG2 3.76Å; I453-V455 PolarHBondContact O-N 3.43Å
454	D	36.6	Very low	40.4	Very low	145 Å²	145	150 Å²	150	78%	0.775	79%	0.789	S	S	*	*			trans	-81.9	88.8	177.9	-171.8	11.7	0	0	0	110.8	N456	D454-N456 VanDerWaalsContact C-N 3.35Å; D454-N456 PolarHBondContact O-N 2.78Å
455	V	41	Very low	40.2	Very low	108 Å²	108	152.7 Å²	152.7	66%	0.655	79%	0.793	S	S	*	*			trans	-80.5	78.8	-177.3	-172	0	0	0	0	111.5	I453 I457	I453-V455 HydrophobicContact CG2-CG2 3.76Å; I453-V455 PolarHBondContact O-N 3.43Å; V455-I457 HydrophobicContact CG1-CD1 4.13Å; V455-I457 HydrophobicContact CG1-CG1 4.09Å; V455-I457 PolarHBondContact O-N 3.35Å
456	N	36.1	Very low	40	Very low	111 Å²	111	151.3 Å²	151.3	59%	0.594	79%	0.789	S	S	*	*			trans	-91.6	80.3	-179.9	-175.2	0	0	0	0	112.6	D454 T458	D454-N456 VanDerWaalsContact C-N 3.35Å; D454-N456 PolarHBondContact O-N 2.78Å; N456-T458 PolarHBondContact O-N 2.8Å
457	I	40.4	Very low	39.5	Very low	149 Å²	149	155.1 Å²	155.1	76%	0.764	80%	0.795	S	S	*	*			trans	-85.1	101	176.4	-64.2	179.8	0	0	0	111	V455	V455-I457 HydrophobicContact CG1-CD1 4.13Å; V455-I457 HydrophobicContact CG1-CG1 4.09Å; V455-I457 PolarHBondContact O-N 3.35Å
458	T	39.2	Very low	39.3	Very low	114 Å²	114	151 Å²	151	70%	0.699	79%	0.794	S	S	*	*			trans	-126.7	88	172.4	40.1	0	0	0	0	113.2	N456	N456-T458 PolarHBondContact O-N 2.8Å
459	K	40.7	Very low	38.6	Very low	195 Å²	195	154.8 Å²	154.8	85%	0.848	80%	0.799	S	S	*	*			trans	-143.1	105.2	159.6	-92.7	167.6	-176.5	171.4	0	108
460	R	36.3	Very low	38.4	Very low	252 Å²	252	158.2 Å²	158.2	95%	0.951	80%	0.799	S	S	*	*				64.4	76	88	-71.8	-169	177.8	-164.6	2.1	114
461	G	36.5	Very low	38.2	Very low	80 Å²	80	161.2 Å²	161.2	83%	0.825	80%	0.801	S	S	*	*			trans	-122	132.9	151	0	0	0	0	0	108.8
462	R	36.9	Very low	38.2	Very low	242 Å²	242	161.9 Å²	161.9	91%	0.913	80%	0.8	S	S	*	*			trans	-144.8	154.5	-174.5	-175.8	-179.2	-179.9	-163.4	0.6	109
463	Q	42.6	Very low	38.4	Very low	184 Å²	184	158.7 Å²	158.7	86%	0.86	79%	0.791	S	S	*	*			trans	91.3	139.6	-168.7	-56.6	168.8	12.4	0	0	111.8
464	S	40.3	Very low	38	Very low	112 Å²	112	155.2 Å²	155.2	78%	0.783	79%	0.791	S	S	*	*			cis	-156.4	151.6	-12.8	35.6	0	0	0	0	110.6
465	Q	37.8	Very low	38.1	Very low	181 Å²	181	157.1 Å²	157.1	85%	0.846	80%	0.8	S	S	*	*			trans	-82.7	135.5	174.8	-64.3	-176.6	14.7	0	0	111.3
466	S	41.1	Very low	37.8	Very low	112 Å²	112	157.5 Å²	157.5	78%	0.783	81%	0.808	S	S	*	*			trans	-142.6	126.9	153.4	53.3	0	0	0	0	109.2
467	K	34.2	Very low	38	Very low	195 Å²	195	157 Å²	157	85%	0.848	82%	0.819	S	S	*	*			trans	-98.7	131.1	176	-65.9	172.7	-177.2	168.1	0	109
468	T	38.1	Very low	37.9	Very low	136 Å²	136	154.2 Å²	154.2	83%	0.834	82%	0.819	S	S	*	*			trans	-130.3	122.6	163.1	-30.5	0	0	0	0	108.9
469	K	35.5	Very low	38	Very low	201 Å²	201	153.4 Å²	153.4	87%	0.874	82%	0.823	S	S	*	*			trans	-79.3	143.3	167.8	-68.4	172.7	178	173.1	0	107.9
470	Y	34.1	Very low	38.1	Very low	194 Å²	194	149.8 Å²	149.8	76%	0.761	82%	0.82	S	S	*	*			trans	-128.3	147	150.7	-154.7	-107	0	0	0	110	Q472	Y470-Q472 HydrophobicContact CE1-CB 4.4Å; Y470-Q472 HydrophobicContact CE1-CG 3.78Å; Y470-Q472 PolarHBondContact OH-NE2 3.15Å
471	R	34.3	Very low	38.2	Very low	234 Å²	234	143.5 Å²	143.5	88%	0.883	81%	0.809	S	S	*	*			trans	-150.7	109.6	-173.6	-176	-169.7	-174	-153	2.8	109.4
472	Q	43.4	Very low	38.7	Very low	139 Å²	139	148.1 Å²	148.1	65%	0.65	81%	0.814	S	S	*	*			trans	-133.6	137.3	165	-85.9	-178.9	-21.3	0	0	105.9	Y470	Y470-Q472 HydrophobicContact CE1-CB 4.4Å; Y470-Q472 HydrophobicContact CE1-CG 3.78Å; Y470-Q472 PolarHBondContact OH-NE2 3.15Å
473	S	38.4	Very low	38.7	Very low	102 Å²	102	143.9 Å²	143.9	71%	0.713	81%	0.81	S	S	*	*			cis	57.2	87.5	40.7	79.2	0	0	0	0	111.7
474	G	34.3	Very low	38.7	Very low	74 Å²	74	139.4 Å²	139.4	76%	0.763	80%	0.804	S	S	*	*			cis	92.5	127.2	25.2	0	0	0	0	0	110.3
475	L	39.3	Very low	39	Very low	184 Å²	184	139.9 Å²	139.9	96%	0.963	81%	0.805	S	S	*	*			trans	-159.9	159.7	-179.9	-107.2	167.1	0	0	0	109.1
476	S	34.1	Very low	39	Very low	117 Å²	117	137.3 Å²	137.3	82%	0.818	81%	0.805	S	S	*	*			trans	-149.3	127.6	-176.6	59.1	0	0	0	0	113.1
477	A	40.9	Very low	39.1	Very low	99 Å²	99	136.5 Å²	136.5	82%	0.818	81%	0.805	S	S	*	*			trans	-156	147.8	158.3	0	0	0	0	0	107.8
478	A	38.4	Very low	39.7	Very low	92 Å²	92	132.9 Å²	132.9	76%	0.76	80%	0.802	S	S	*	*			cis	127.9	93.2	-5.1	0	0	0	0	0	112.1
479	A	40.1	Very low	39.9	Very low	96 Å²	96	133.1 Å²	133.1	79%	0.793	80%	0.803	S	S	*	*			trans	67.2	172.6	147.7	0	0	0	0	0	118.5
480	P	43.2	Very low	40.2	Very low	119 Å²	119	128.5 Å²	128.5	77%	0.773	80%	0.795	S	S	*	*				-135.9	171.7	-54	38.2	-24.4	0	0	0	115.6
481	V	39.4	Very low	40.5	Very low	121 Å²	121	124.3 Å²	124.3	73%	0.733	80%	0.795	S	S	*	*			trans	-7.3	131.9	152.8	-174.4	0	0	0	0	118.8
482	L	45.3	Very low	40.8	Very low	177 Å²	177	117.7 Å²	117.7	93%	0.927	78%	0.784	S	S	*	*			trans	-136.7	171.6	141.3	-86.1	-175.3	0	0	0	110.5
483	N	38.5	Very low	40.7	Very low	153 Å²	153	117.3 Å²	117.3	82%	0.818	79%	0.792	S	S	*	*			trans	-139	161.9	-145.6	-146	8.6	0	0	0	115.1
484	A	42.5	Very low	41.1	Very low	90 Å²	90	118.1 Å²	118.1	74%	0.744	79%	0.792	S	S	*	*			trans	78.1	154.4	158.7	0	0	0	0	0	121.5
485	P	45.6	Very low	41.3	Very low	122 Å²	122	121.1 Å²	121.1	79%	0.792	79%	0.791	S	S	*	*			trans	-127.7	178	-168.5	44.1	-29.3	0	0	0	115.6
486	C	38.3	Very low	41.4	Very low	126 Å²	126	119.5 Å²	119.5	85%	0.851	78%	0.78	S	S	*	*			trans	-171.8	135.1	141.1	-123.5	0	0	0	0	116.7
487	A	44	Very low	41.6	Very low	95 Å²	95	118.5 Å²	118.5	79%	0.785	77%	0.773	S	S	*	*			trans	52.7	152.5	144.8	0	0	0	0	0	124.5
488	P	47.1	Very low	41.6	Very low	120 Å²	120	118.4 Å²	118.4	78%	0.779	77%	0.766	S	S	*	*			trans	-126.2	168.6	-174.3	43.9	-30.6	0	0	0	116.8
489	V	41.2	Very low	41.6	Very low	141 Å²	141	119.7 Å²	119.7	86%	0.855	77%	0.765	S	S	*	*			trans	-162.6	153.3	154.7	-109.1	0	0	0	0	113.5
490	S	41.4	Very low	41.7	Very low	103 Å²	103	123.1 Å²	123.1	72%	0.72	76%	0.764	S	S	*	*			trans	55.1	112.9	152.7	-62.2	0	0	0	0	119.8
491	S	40.2	Very low	41.5	Very low	107 Å²	107	122.6 Å²	122.6	75%	0.748	76%	0.763	S	S	*	*				69.5	145.5	79.9	83.6	0	0	0	0	113.9
492	S	41.4	Very low	41.2	Very low	95 Å²	95	124.5 Å²	124.5	66%	0.664	76%	0.764	S	S	*	*			cis	-162.8	178.2	30.7	-46.7	0	0	0	0	111.6
493	T	42	Very low	40.7	Very low	131 Å²	131	121.8 Å²	121.8	80%	0.804	76%	0.757	S	S	*	*			trans	69	128.5	146.7	-68.2	0	0	0	0	118.4
494	V	45.4	Very low	40.5	Very low	119 Å²	119	121.3 Å²	121.3	72%	0.721	75%	0.753	S	S	*	*			cis	-153.1	-156.6	-13.2	-87.7	0	0	0	0	105.9
495	N	39.2	Very low	40.1	Very low	137 Å²	137	123 Å²	123	73%	0.733	76%	0.756	S	S	*	*			cis	-166.1	171.6	2.6	-127.8	7.5	0	0	0	106
496	M	41	Very low	39.7	Very low	149 Å²	149	123.2 Å²	123.2	73%	0.734	76%	0.755	S	S	*	*			cis	-165.9	169.7	-20	-134.1	-67.7	-176.3	0	0	107.6
497	S	39.1	Very low	39.7	Very low	97 Å²	97	123.2 Å²	123.2	68%	0.678	75%	0.754	S	S	*	*			trans	50.8	136.4	155.5	58.5	0	0	0	0	121.5
498	S	39.8	Very low	39.2	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	76%	0.757	S	S	*	*			cis	-173.4	145	-7	46.1	0	0	0	0	111.2
499	T	38.7	Very low	38.6	Very low	118 Å²	118	127.1 Å²	127.1	72%	0.724	76%	0.76	S	S	*	*			trans	30.1	129.5	148.1	59.1	0	0	0	0	120
500	H	42.1	Very low	38.5	Very low	168 Å²	168	125.1 Å²	125.1	78%	0.778	76%	0.758	S	S	*	*				-170.9	157.5	52.1	-121.7	-61.4	0	0	0	113.2
501	S	38.5	Very low	38.3	Very low	109 Å²	109	124.9 Å²	124.9	76%	0.762	75%	0.752	S	S	*	*			trans	32.6	139.1	146.1	-54.5	0	0	0	0	124.9
502	Q	34	Very low	38	Very low	161 Å²	161	126.6 Å²	126.6	75%	0.752	75%	0.753	S	S	*	*			trans	-56.6	169	166.3	-65.7	-72.8	-12.4	0	0	114.5
503	P	35.2	Very low	38.1	Very low	119 Å²	119	131.2 Å²	131.2	77%	0.773	76%	0.764	S	S	*	*			cis	-139.5	-173.7	19.8	42.5	-22.4	0	0	0	118.1
504	I	33.6	Very low	38.1	Very low	143 Å²	143	134 Å²	134	73%	0.733	77%	0.768	S	S	*	*			trans	-80.9	136.7	-175.1	-60.5	156	0	0	0	113.2
505	P	34.2	Very low	37.6	Very low	125 Å²	125	136 Å²	136	81%	0.812	77%	0.771	S	S	*	*				-142.3	165	116.1	32.3	-14.7	0	0	0	116.1
506	V	38.2	Very low	37.6	Very low	127 Å²	127	133.5 Å²	133.5	77%	0.77	76%	0.764	S	S	*	*			trans	-112.5	177.4	-178.2	-69.2	0	0	0	0	111.3
507	P	36.6	Very low	38.1	Very low	127 Å²	127	133.2 Å²	133.2	83%	0.825	76%	0.761	S	S	*	*			cis	-127.2	165.5	-32.9	31.4	-14	0	0	0	113.2
508	G	35.2	Very low	38.8	Very low	82 Å²	82	136.5 Å²	136.5	85%	0.845	77%	0.771	S	S	*	*			trans	-107	137.8	168.6	0	0	0	0	0	113.1
509	Y	34.4	Very low	39.6	Very low	215 Å²	215	138.5 Å²	138.5	84%	0.843	77%	0.774	S	S	*	*			trans	-110.1	129.1	171	-168.1	-88.3	0	0	0	108.6	T511	Y509-T511 HydrophobicContact CE1-CG2 4.08Å
510	A	37.7	Very low	41	Very low	98 Å²	98	135.4 Å²	135.4	81%	0.81	76%	0.755	S	S	*	*			trans	-115.8	124.9	174.8	0	0	0	0	0	109.1
511	T	37.8	Very low	42.7	Very low	99 Å²	99	135 Å²	135	61%	0.607	75%	0.747	S	S	*	*			trans	-85.8	154.5	-178.7	4.5	0	0	0	0	112.3	Y509	Y509-T511 HydrophobicContact CE1-CG2 4.08Å
512	D	33.4	Very low	44.8	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	74%	0.735	S	S	*	*			trans	35.2	111.4	145.1	-48.8	-28.6	0	0	0	119.8
513	E	44.4	Very low	47.2	Very low	191 Å²	191	126.3 Å²	126.3	89%	0.893	70%	0.701	S	S	*	*			trans	-140.3	132.3	137	-79.2	-154.7	158.5	0	0	112.5
514	E	40.9	Very low	49.7	Very low	189 Å²	189	123.8 Å²	123.8	88%	0.883	68%	0.684	S	S	*	*			trans	62.4	143.4	155.8	-54.8	-128.3	117.1	0	0	123.3
515	M	35.9	Very low	52.2	Low	163 Å²	163	124.6 Å²	124.6	80%	0.803	68%	0.679	S	S	*	*			trans	-101.1	149.5	174.1	-78	178.7	50.7	0	0	111.7	E517	M515-E517 HydrophobicContact CE-CG 4.32Å
516	S	39.9	Very low	54.6	Low	83 Å²	83	123.8 Å²	123.8	58%	0.58	67%	0.667	S	S	*	*			trans	-137	123.9	153.5	54.8	0	0	0	0	110.5	N518	S516-N518 PolarHBondContact O-N 3.44Å
517	E	50.9	Low	57.1	Low	143 Å²	143	119.7 Å²	119.7	67%	0.668	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-70	-22.7	-171.7	-60.4	-168.6	114.7	0	0	113.2	M515 N519	M515-E517 HydrophobicContact CE-CG 4.32Å; E517-N519 VanDerWaalsContact C-N 3.28Å; E517-N519 PolarHBondContact O-N 3.44Å
518	N	53.1	Low	59.7	Low	166 Å²	166	114.6 Å²	114.6	89%	0.888	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-76.2	-4.8	-172.3	-67.8	-13.4	0	0	0	115.1	S516	S516-N518 PolarHBondContact O-N 3.44Å
519	N	56.8	Low	62.4	Low	140 Å²	140	117.7 Å²	117.7	75%	0.749	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-108.1	12.8	-172.3	-123.7	-21.2	0	0	0	114.5	E517 R521	E517-N519 VanDerWaalsContact C-N 3.28Å; E517-N519 PolarHBondContact O-N 3.44Å; N519-R521 PolarHBondContact O-N 3.42Å
520	V	68.3	Low	65	Low	53 Å²	53	112 Å²	112	32%	0.321	57%	0.572	S	S	.	*			trans	-76.5	105.4	-179.9	-178.7	0	0	0	0	111.1	P522 T575 R578	V520-P522 WeakPolarHBondContact O-CD 3.35Å; V520-T575 HydrophobicContact CB-CG2 4.28Å; V520-T575 HydrophobicContact CG2-CG2 4.07Å; V520-R578 HydrophobicContact CG1-CB 3.92Å; V520-R578 HydrophobicContact CG1-CG 3.63Å
521	R	77.4	Confident	67.7	Low	158 Å²	158	107.7 Å²	107.7	60%	0.596	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-46.7	117.3	178	179	176.2	173.6	-96.8	1.2	111.9	N519 E527 R578	N519-R521 PolarHBondContact O-N 3.42Å; R521-E527 IonicContact CZ-OE1 3.85Å; R521-E527 IonicContact NH1-OE1 2.97Å; R521-E527 PolarHBondContact NH1-OE1 3.34Å; R521-E527 IonicContact NH1-OE2 3.8Å; R521-R578 VanDerWaalsContact NH1-NH2 3.12Å; R521-R578 PolarHBondContact O-NE 2.9Å; R521-R578 PolarHBondContact O-NH2 2.66Å
522	P	83.8	Confident	70.3	Confident	79 Å²	79	104.9 Å²	104.9	51%	0.513	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-50.6	154	175.6	-30.9	37.4	0	0	0	113.2	V520 R578	V520-P522 WeakPolarHBondContact O-CD 3.35Å; P522-R578 PolarHBondContact O-NH2 2.86Å
523	M	84.2	Confident	73	Confident	9 Å²	9	102 Å²	102	4%	0.044	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-103.3	124.4	-173.9	-160.5	152.5	82.9	0	0	110.4	E527 K528 L531 H574 L577	M523-E527 WeakPolarHBondContact CA-OE2 3.41Å; M523-E527 HydrophobicContact CG-CB 3.25Å; M523-E527 HydrophobicContact CG-CG 4.26Å; M523-E527 HydrophobicContact SD-CB 4.09Å; M523-K528 HydrophobicContact CB-CG 4.34Å; M523-K528 HydrophobicContact CE-CB 4.41Å; M523-K528 HydrophobicContact CE-CG 3.93Å; M523-K528 HydrophobicContact CG-CG 4.28Å; M523-L531 HydrophobicContact CE-CB 4.07Å; M523-L531 HydrophobicContact CE-CD2 3.43Å; M523-L531 VanDerWaalsContact CE-CD2 3.43Å; M523-L531 HydrophobicContact CE-CG 4.39Å; M523-H574 PolarHBondContact N-CD2 2.79Å; M523-L577 HydrophobicContact CE-CB 3.69Å; M523-L577 HydrophobicContact CE-CD1 4.34Å; M523-L577 HydrophobicContact CE-CD2 3.85Å; M523-L577 HydrophobicContact CE-CG 4.18Å; M523-L577 HydrophobicContact SD-CB 4.36Å
524	T	88	Confident	75.3	Confident	67 Å²	67	94.6 Å²	94.6	41%	0.411	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-67.4	160.7	-178.9	73.8	0	0	0	0	111.1	D526 E527 K528	T524-D526 PolarHBondContact O-N 2.88Å; T524-E527 PolarHBondContact N-OE2 3.45Å; T524-E527 CarbonylContact O-C 3.5Å; T524-E527 PolarHBondContact O-N 3.08Å; T524-E527 WeakPolarHBondContact OG1-CG 3.48Å; T524-E527 PolarHBondContact OG1-N 2.67Å; T524-E527 VanDerWaalsContact OG1-N 3.14Å; T524-K528 WeakPolarHBondContact O-CG 3.21Å; T524-K528 PolarHBondContact O-N 3.1Å
525	Y	84.9	Confident	77.7	Confident	160 Å²	160	86.2 Å²	86.2	63%	0.627	43%	0.432	S	S	*	.	H	α-helix	trans	-54	-40	174.9	176	-99.7	0	0	0	112.7	K528 R529	Y525-K528 PolarHBondContact O-N 3.23Å; Y525-R529 VanDerWaalsContact O-CB 3.26Å; Y525-R529 WeakPolarHBondContact O-CB 3.37Å; Y525-R529 PolarHBondContact O-N 3.31Å
526	D	84	Confident	80.2	Confident	107 Å²	107	84.7 Å²	84.7	57%	0.572	43%	0.427	S	S	*	.	H	α-helix	trans	-71.7	-35.3	176.1	-69.6	-53.7	0	0	0	112.9	T524 Q530	T524-D526 PolarHBondContact O-N 2.88Å; D526-Q530 VanDerWaalsContact O-CB 3.27Å; D526-Q530 WeakPolarHBondContact O-CB 3.22Å; D526-Q530 PolarHBondContact O-N 3.02Å
527	E	91.2	Very high	82.6	Confident	42 Å²	42	86.2 Å²	86.2	20%	0.196	42%	0.423	C	S	.	.	H	α-helix	trans	-65.5	-42.5	171.1	-71.4	175.4	130.9	0	0	111.3	R521 M523 T524 Q530 L531 R578	R521-E527 IonicContact CZ-OE1 3.85Å; R521-E527 IonicContact NH1-OE1 2.97Å; R521-E527 PolarHBondContact NH1-OE1 3.34Å; R521-E527 IonicContact NH1-OE2 3.8Å; M523-E527 WeakPolarHBondContact CA-OE2 3.41Å; M523-E527 HydrophobicContact CG-CB 3.25Å; M523-E527 HydrophobicContact CG-CG 4.26Å; M523-E527 HydrophobicContact SD-CB 4.09Å; T524-E527 PolarHBondContact N-OE2 3.45Å; T524-E527 CarbonylContact O-C 3.5Å; T524-E527 PolarHBondContact O-N 3.08Å; T524-E527 WeakPolarHBondContact OG1-CG 3.48Å; T524-E527 PolarHBondContact OG1-N 2.67Å; T524-E527 VanDerWaalsContact OG1-N 3.14Å; E527-Q530 PolarHBondContact O-N 3.42Å; E527-L531 WeakPolarHBondContact O-CB 3.4Å; E527-L531 PolarHBondContact O-N 3.31Å; E527-R578 VanDerWaalsContact CD-NH2 3.3Å; E527-R578 IonicContact OE1-CZ 3.14Å; E527-R578 IonicContact OE1-NH1 2.66Å; E527-R578 PolarHBondContact OE1-NH1 3.48Å; E527-R578 IonicContact OE1-NH2 3.78Å; E527-R578 PolarHBondContact OE1-NH2 2.97Å; E527-R578 VanDerWaalsContact OE1-NH2 3.11Å; E527-R578 IonicContact OE2-CZ 3.14Å; E527-R578 IonicContact OE2-NH1 2.86Å; E527-R578 IonicContact OE2-NH2 3.4Å; E527-R578 PolarHBondContact OE2-NH2 3.01Å
528	K	92.4	Very high	84.4	Confident	19 Å²	19	80.1 Å²	80.1	8%	0.083	40%	0.395	C	S	.	.	H	α-helix	trans	-58.4	-48.9	173.1	-72.6	-172.5	179.9	-159.5	0	111.7	M523 T524 Y525 Q530 L531 S532 F569 E570 L577	M523-K528 HydrophobicContact CB-CG 4.34Å; M523-K528 HydrophobicContact CE-CB 4.41Å; M523-K528 HydrophobicContact CE-CG 3.93Å; M523-K528 HydrophobicContact CG-CG 4.28Å; T524-K528 WeakPolarHBondContact O-CG 3.21Å; T524-K528 PolarHBondContact O-N 3.1Å; Y525-K528 PolarHBondContact O-N 3.23Å; K528-Q530 PolarHBondContact O-N 3.36Å; K528-L531 PolarHBondContact O-N 3.34Å; K528-S532 PolarHBondContact O-N 3.06Å; K528-F569 HydrophobicContact CD-CB 4.43Å; K528-F569 WeakPolarHBondContact CE-O 2.99Å; K528-F569 PolarHBondContact NZ-O 2.84Å; K528-E570 WeakPolarHBondContact CD-OE1 3.45Å; K528-E570 WeakPolarHBondContact CE-OE1 3.2Å; K528-E570 IonicContact NZ-OE1 2.79Å; K528-E570 PolarHBondContact NZ-OE1 2.94Å; K528-L577 HydrophobicContact CG-CD1 4.49Å
529	R	90.2	Very high	86.1	Confident	148 Å²	148	74.5 Å²	74.5	56%	0.558	37%	0.367	S	S	*	.	H	α-helix	trans	-62.3	-41.7	177.8	-175.3	-178.8	-179.7	-159.2	2.4	112.2	Y525 S532 L533	Y525-R529 VanDerWaalsContact O-CB 3.26Å; Y525-R529 WeakPolarHBondContact O-CB 3.37Å; Y525-R529 PolarHBondContact O-N 3.31Å; R529-S532 PolarHBondContact O-N 3Å; R529-L533 HydrophobicContact CG-CD1 4.43Å; R529-L533 WeakPolarHBondContact O-CG 3.46Å; R529-L533 PolarHBondContact O-N 3.44Å
530	Q	90.6	Very high	87.4	Confident	95 Å²	95	70.5 Å²	70.5	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-66.4	-40.8	176.5	-175.8	57.8	42.7	0	0	111.4	D526 E527 K528 S532 L533 D534	D526-Q530 VanDerWaalsContact O-CB 3.27Å; D526-Q530 WeakPolarHBondContact O-CB 3.22Å; D526-Q530 PolarHBondContact O-N 3.02Å; E527-Q530 PolarHBondContact O-N 3.42Å; K528-Q530 PolarHBondContact O-N 3.36Å; Q530-S532 PolarHBondContact O-N 3.17Å; Q530-L533 CarbonylContact O-C 3.58Å; Q530-L533 PolarHBondContact O-N 3.39Å; Q530-D534 PolarHBondContact NE2-OD1 2.81Å; Q530-D534 PolarHBondContact NE2-OD2 3.22Å; Q530-D534 WeakPolarHBondContact O-CB 3.45Å; Q530-D534 PolarHBondContact O-N 3.37Å
531	L	93.3	Very high	88.4	Confident	7 Å²	7	74.9 Å²	74.9	4%	0.037	38%	0.376	C	S	.	.	H	α-helix	trans	-59.7	-46.7	174.9	179.9	59.7	0	0	0	112	M523 E527 K528 L533 D534 I535 F569 L577 L580 E581 V584	M523-L531 HydrophobicContact CE-CB 4.07Å; M523-L531 HydrophobicContact CE-CD2 3.43Å; M523-L531 VanDerWaalsContact CE-CD2 3.43Å; M523-L531 HydrophobicContact CE-CG 4.39Å; E527-L531 WeakPolarHBondContact O-CB 3.4Å; E527-L531 PolarHBondContact O-N 3.31Å; K528-L531 PolarHBondContact O-N 3.34Å; L531-L533 VanDerWaalsContact C-N 3.32Å; L531-L533 PolarHBondContact O-N 3.36Å; L531-D534 PolarHBondContact O-N 3.42Å; L531-D534 VanDerWaalsContact O-N 3.15Å; L531-I535 HydrophobicContact CD1-CD1 4.07Å; L531-I535 HydrophobicContact CD1-CG1 4.2Å; L531-I535 HydrophobicContact CG-CD1 3.89Å; L531-I535 HydrophobicContact CG-CG1 4.48Å; L531-I535 WeakPolarHBondContact O-CG1 3.47Å; L531-I535 PolarHBondContact O-N 3.24Å; L531-F569 HydrophobicContact CD2-CD1 4.48Å; L531-F569 HydrophobicContact CD2-CE1 3.99Å; L531-F569 HydrophobicContact CG-CE1 4.05Å; L531-L577 HydrophobicContact CD2-CD2 4.34Å; L531-L580 HydrophobicContact CD2-CB 3.92Å; L531-E581 HydrophobicContact CD1-CB 4.24Å; L531-E581 HydrophobicContact CD2-CB 4.49Å; L531-V584 HydrophobicContact CD1-CB 4.07Å; L531-V584 HydrophobicContact CD1-CG1 4.32Å; L531-V584 HydrophobicContact CD1-CG2 3.86Å
532	S	92	Very high	89	Confident	40 Å²	40	71.1 Å²	71.1	28%	0.28	36%	0.364	S	S	.	.	H	α-helix	trans	-57.5	-44.3	174.3	178.3	0	0	0	0	111.8	K528 R529 Q530 D534 N536	K528-S532 PolarHBondContact O-N 3.06Å; R529-S532 PolarHBondContact O-N 3Å; Q530-S532 PolarHBondContact O-N 3.17Å; S532-D534 VanDerWaalsContact C-N 3.31Å; S532-D534 PolarHBondContact O-N 3.43Å; S532-N536 PolarHBondContact O-N 2.9Å; S532-N536 PolarHBondContact O-ND2 3.36Å
533	L	91	Very high	89.2	Confident	83 Å²	83	70.9 Å²	70.9	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-24.1	176.7	-71.5	173.4	0	0	0	114.4	R529 Q530 L531 K537	R529-L533 HydrophobicContact CG-CD1 4.43Å; R529-L533 WeakPolarHBondContact O-CG 3.46Å; R529-L533 PolarHBondContact O-N 3.44Å; Q530-L533 CarbonylContact O-C 3.58Å; Q530-L533 PolarHBondContact O-N 3.39Å; L531-L533 VanDerWaalsContact C-N 3.32Å; L531-L533 PolarHBondContact O-N 3.36Å; L533-K537 WeakPolarHBondContact O-CE 3.16Å; L533-K537 WeakPolarHBondContact O-CG 3.32Å; L533-K537 PolarHBondContact O-NZ 3.05Å
534	D	93	Very high	89.5	Confident	35 Å²	35	73 Å²	73	19%	0.187	38%	0.382	C	S	.	.	H	α-helix	trans	-92.1	-28.7	179.4	-77.9	-25.3	0	0	0	113.1	Q530 L531 S532 N536 K537 V584 L588	Q530-D534 PolarHBondContact NE2-OD1 2.81Å; Q530-D534 PolarHBondContact NE2-OD2 3.22Å; Q530-D534 WeakPolarHBondContact O-CB 3.45Å; Q530-D534 PolarHBondContact O-N 3.37Å; L531-D534 PolarHBondContact O-N 3.42Å; L531-D534 VanDerWaalsContact O-N 3.15Å; S532-D534 VanDerWaalsContact C-N 3.31Å; S532-D534 PolarHBondContact O-N 3.43Å; D534-N536 VanDerWaalsContact C-N 3.25Å; D534-N536 PolarHBondContact O-N 2.96Å; D534-K537 WeakPolarHBondContact O-CB 3.41Å; D534-K537 PolarHBondContact O-N 3.08Å; D534-K537 WeakPolarHBondContact OD1-CD 3.39Å; D534-K537 WeakPolarHBondContact OD1-CE 3.45Å; D534-V584 HydrophobicContact CB-CG1 3.63Å; D534-L588 HydrophobicContact CB-CD1 3.77Å
535	I	92	Very high	89.5	Confident	14 Å²	14	74.4 Å²	74.4	7%	0.072	38%	0.38	C	S	.	.	H	α-helix	trans	-59.2	-41.8	166.1	-73	163.1	0	0	0	109.8	L531 K537 L538 L543 V546 F569 V584	L531-I535 HydrophobicContact CD1-CD1 4.07Å; L531-I535 HydrophobicContact CD1-CG1 4.2Å; L531-I535 HydrophobicContact CG-CD1 3.89Å; L531-I535 HydrophobicContact CG-CG1 4.48Å; L531-I535 WeakPolarHBondContact O-CG1 3.47Å; L531-I535 PolarHBondContact O-N 3.24Å; I535-K537 PolarHBondContact O-N 3.35Å; I535-L538 WeakPolarHBondContact O-CB 3.43Å; I535-L538 WeakPolarHBondContact O-CG 3.5Å; I535-L538 PolarHBondContact O-N 3.48Å; I535-L543 HydrophobicContact CG2-CD2 4.19Å; I535-V546 HydrophobicContact CD1-CG1 4.33Å; I535-V546 HydrophobicContact CG2-CG1 4.37Å; I535-F569 HydrophobicContact CD1-CE1 4.03Å; I535-F569 HydrophobicContact CD1-CZ 3.78Å; I535-V584 HydrophobicContact CD1-CG2 4.41Å; I535-V584 HydrophobicContact CG1-CG2 3.52Å
536	N	88.4	Confident	89.9	Confident	131 Å²	131	66.9 Å²	66.9	70%	0.701	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	5.9	171.8	-78.2	-80.9	0	0	0	114.8	S532 D534	S532-N536 PolarHBondContact O-N 2.9Å; S532-N536 PolarHBondContact O-ND2 3.36Å; D534-N536 VanDerWaalsContact C-N 3.25Å; D534-N536 PolarHBondContact O-N 2.96Å
537	K	88.8	Confident	90.1	Very high	115 Å²	115	63.3 Å²	63.3	50%	0.5	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	0.6	172.2	-53.3	-179.1	-159.2	-35.6	0	113	L533 D534 I535 L588	L533-K537 WeakPolarHBondContact O-CE 3.16Å; L533-K537 WeakPolarHBondContact O-CG 3.32Å; L533-K537 PolarHBondContact O-NZ 3.05Å; D534-K537 WeakPolarHBondContact O-CB 3.41Å; D534-K537 PolarHBondContact O-N 3.08Å; D534-K537 WeakPolarHBondContact OD1-CD 3.39Å; D534-K537 WeakPolarHBondContact OD1-CE 3.45Å; I535-K537 PolarHBondContact O-N 3.35Å; K537-L588 HydrophobicContact CB-CD1 4.42Å; K537-L588 HydrophobicContact CB-CD2 3.89Å
538	L	89.5	Confident	89.9	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.079	34%	0.343	C	S	.	.	S	Bend	trans	-76	143.9	177.9	-63.4	-178.6	0	0	0	110.9	I535 K542 L543 V546 Y583 V584 V587 L588	I535-L538 WeakPolarHBondContact O-CB 3.43Å; I535-L538 WeakPolarHBondContact O-CG 3.5Å; I535-L538 PolarHBondContact O-N 3.48Å; L538-K542 HydrophobicContact CB-CB 4.32Å; L538-L543 HydrophobicContact CB-CD2 4Å; L538-L543 HydrophobicContact CD1-CD2 4.28Å; L538-V546 HydrophobicContact CD1-CG2 3.49Å; L538-V546 VanDerWaalsContact CD1-CG2 3.49Å; L538-Y583 HydrophobicContact CD1-CE1 4.28Å; L538-V584 HydrophobicContact CD1-CG2 4.12Å; L538-V584 HydrophobicContact CD2-CG1 4.42Å; L538-V587 HydrophobicContact CD2-CB 3.7Å; L538-V587 HydrophobicContact CD2-CG1 3.67Å; L538-V587 HydrophobicContact CD2-CG2 4.34Å; L538-L588 HydrophobicContact CD2-CD2 4.26Å; L538-L588 HydrophobicContact CD2-CG 4.25Å
539	P	87.5	Confident	89.8	Confident	48 Å²	48	64.9 Å²	64.9	31%	0.312	34%	0.34	S	S	.	.			trans	-57.6	148.9	164.6	-23.5	34.7	0	0	0	111.5	E541 K542 L543	P539-E541 WeakPolarHBondContact CB-OE2 3.23Å; P539-E541 PolarHBondContact O-N 3.09Å; P539-K542 HydrophobicContact CB-CG 4.15Å; P539-K542 HydrophobicContact CG-CG 4.3Å; P539-K542 WeakPolarHBondContact O-CA 3.48Å; P539-K542 WeakPolarHBondContact O-CB 3.38Å; P539-K542 PolarHBondContact O-N 3.17Å; P539-L543 PolarHBondContact O-N 3.03Å
540	G	85.3	Confident	89.8	Confident	56 Å²	56	58.3 Å²	58.3	58%	0.577	32%	0.316	S	S	*	.	H	α-helix	trans	-56.4	-37	-175.7	0	0	0	0	0	113.4	K542 L543	G540-K542 PolarHBondContact O-N 2.67Å; G540-L543 PolarHBondContact O-N 3.22Å
541	E	88.5	Confident	89.5	Confident	144 Å²	144	56.9 Å²	56.9	67%	0.673	31%	0.309	S	S	*	.	H	α-helix	trans	-74.9	9.5	178.3	-23.8	75.6	-179.2	0	0	113.1	P539	P539-E541 WeakPolarHBondContact CB-OE2 3.23Å; P539-E541 PolarHBondContact O-N 3.09Å
542	K	90.2	Very high	89.1	Confident	79 Å²	79	62.2 Å²	62.2	34%	0.343	33%	0.334	S	S	.	.	H	α-helix	trans	-118.2	-17.7	174.2	-52.7	-64.9	153.6	-111.3	0	112.3	L538 P539 G540 G544 R545 V587	L538-K542 HydrophobicContact CB-CB 4.32Å; P539-K542 HydrophobicContact CB-CG 4.15Å; P539-K542 HydrophobicContact CG-CG 4.3Å; P539-K542 WeakPolarHBondContact O-CA 3.48Å; P539-K542 WeakPolarHBondContact O-CB 3.38Å; P539-K542 PolarHBondContact O-N 3.17Å; G540-K542 PolarHBondContact O-N 2.67Å; K542-G544 VanDerWaalsContact C-N 3.35Å; K542-G544 PolarHBondContact O-N 2.62Å; K542-R545 PolarHBondContact O-N 3.15Å; K542-V587 HydrophobicContact CG-CG1 4.14Å
543	L	89.3	Confident	88.8	Confident	75 Å²	75	65.4 Å²	65.4	39%	0.393	34%	0.34	S	S	.	.	H	α-helix	trans	-63.1	-39.1	174.9	-64	176.7	0	0	0	111.8	I535 L538 P539 G540 R545 V546 V547	I535-L543 HydrophobicContact CG2-CD2 4.19Å; L538-L543 HydrophobicContact CB-CD2 4Å; L538-L543 HydrophobicContact CD1-CD2 4.28Å; P539-L543 PolarHBondContact O-N 3.03Å; G540-L543 PolarHBondContact O-N 3.22Å; L543-R545 PolarHBondContact O-N 3.17Å; L543-R545 VanDerWaalsContact O-N 3.08Å; L543-V546 WeakPolarHBondContact O-CA 3.5Å; L543-V546 VanDerWaalsContact O-CB 3.26Å; L543-V546 WeakPolarHBondContact O-CB 3.31Å; L543-V546 PolarHBondContact O-N 3.01Å; L543-V547 PolarHBondContact O-N 3.06Å; L543-V547 VanDerWaalsContact O-N 3.16Å
544	G	88.5	Confident	88.4	Confident	52 Å²	52	62.2 Å²	62.2	54%	0.536	32%	0.323	S	S	.	.	H	α-helix	trans	-57.3	-26	175.1	0	0	0	0	0	114.4	K542 Q548	K542-G544 VanDerWaalsContact C-N 3.35Å; K542-G544 PolarHBondContact O-N 2.62Å; G544-Q548 WeakPolarHBondContact O-CB 3.35Å; G544-Q548 PolarHBondContact O-N 3.46Å; G544-Q548 VanDerWaalsContact O-N 3.1Å
545	R	89.8	Confident	87.3	Confident	97 Å²	97	65 Å²	65	37%	0.366	34%	0.343	S	S	.	.	H	α-helix	trans	-82	-25.3	174.3	-177.7	59.2	-172	174.9	9.7	113	K542 L543 Q548 I549 Y583	K542-R545 PolarHBondContact O-N 3.15Å; L543-R545 PolarHBondContact O-N 3.17Å; L543-R545 VanDerWaalsContact O-N 3.08Å; R545-Q548 VanDerWaalsContact CD-OE1 3.31Å; R545-I549 HydrophobicContact CG-CD1 4.37Å; R545-I549 WeakPolarHBondContact O-CD1 3.38Å; R545-I549 VanDerWaalsContact O-CG1 3.27Å; R545-I549 WeakPolarHBondContact O-CG1 3.37Å; R545-I549 PolarHBondContact O-N 3.06Å; R545-Y583 HydrophobicContact CB-CE1 4.05Å; R545-Y583 HydrophobicContact CB-CE2 4.25Å; R545-Y583 WeakPolarHBondContact CB-OH 3.39Å; R545-Y583 HydrophobicContact CG-CD2 4.15Å; R545-Y583 HydrophobicContact CG-CE1 4.04Å; R545-Y583 HydrophobicContact CG-CE2 3.56Å
546	V	91.9	Very high	86.2	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.018	37%	0.37	C	S	.	.	H	α-helix	trans	-62.6	-50	168.5	177.7	0	0	0	0	109.2	I535 L538 L543 Q548 I549 I550 I567 L580 Y583	I535-V546 HydrophobicContact CD1-CG1 4.33Å; I535-V546 HydrophobicContact CG2-CG1 4.37Å; L538-V546 HydrophobicContact CD1-CG2 3.49Å; L538-V546 VanDerWaalsContact CD1-CG2 3.49Å; L543-V546 WeakPolarHBondContact O-CA 3.5Å; L543-V546 VanDerWaalsContact O-CB 3.26Å; L543-V546 WeakPolarHBondContact O-CB 3.31Å; L543-V546 PolarHBondContact O-N 3.01Å; V546-Q548 VanDerWaalsContact C-N 3.34Å; V546-Q548 PolarHBondContact O-N 3.36Å; V546-I549 PolarHBondContact O-N 3.12Å; V546-I550 HydrophobicContact CG1-CD1 4.36Å; V546-I550 PolarHBondContact O-N 2.93Å; V546-I550 VanDerWaalsContact O-N 3.17Å; V546-I567 HydrophobicContact CG1-CD1 4.38Å; V546-L580 HydrophobicContact CG1-CD2 3.85Å; V546-Y583 HydrophobicContact CG2-CD1 4.16Å; V546-Y583 HydrophobicContact CG2-CE1 4.06Å
547	V	88.9	Confident	85.2	Confident	32 Å²	32	64.1 Å²	64.1	19%	0.194	34%	0.344	C	S	.	.	H	α-helix	trans	-55.5	-48.5	175.2	178	0	0	0	0	111.1	L543 I549 I550 Q551 I565	L543-V547 PolarHBondContact O-N 3.06Å; L543-V547 VanDerWaalsContact O-N 3.16Å; V547-I549 VanDerWaalsContact C-N 3.32Å; V547-I549 PolarHBondContact O-N 3.12Å; V547-I550 PolarHBondContact O-N 2.92Å; V547-I550 VanDerWaalsContact O-N 3.15Å; V547-Q551 HydrophobicContact CG1-CG 4.29Å; V547-Q551 PolarHBondContact O-N 3.14Å; V547-I565 HydrophobicContact CB-CD1 4.18Å; V547-I565 HydrophobicContact CG1-CD1 3.6Å; V547-I565 HydrophobicContact CG2-CD1 3.45Å; V547-I565 VanDerWaalsContact CG2-CD1 3.45Å
548	Q	87.3	Confident	83.9	Confident	87 Å²	87	66.8 Å²	66.8	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-33.1	179.8	-165	180	38.4	0	0	113.3	G544 R545 V546 Q552	G544-Q548 WeakPolarHBondContact O-CB 3.35Å; G544-Q548 PolarHBondContact O-N 3.46Å; G544-Q548 VanDerWaalsContact O-N 3.1Å; R545-Q548 VanDerWaalsContact CD-OE1 3.31Å; V546-Q548 VanDerWaalsContact C-N 3.34Å; V546-Q548 PolarHBondContact O-N 3.36Å; Q548-Q552 HydrophobicContact CG-CG 4.49Å; Q548-Q552 VanDerWaalsContact O-CB 3.23Å; Q548-Q552 WeakPolarHBondContact O-CB 3.39Å; Q548-Q552 WeakPolarHBondContact O-CG 3.39Å; Q548-Q552 PolarHBondContact O-N 3.03Å; Q548-Q552 VanDerWaalsContact O-N 3.1Å
549	I	89.7	Confident	82.6	Confident	7 Å²	7	73.5 Å²	73.5	4%	0.036	39%	0.387	C	S	.	.	H	α-helix	trans	-67.2	-41.1	174.4	-71.2	162.4	0	0	0	110.8	R545 V546 V547 Q552 R553 E579 L580 Y583	R545-I549 HydrophobicContact CG-CD1 4.37Å; R545-I549 WeakPolarHBondContact O-CD1 3.38Å; R545-I549 VanDerWaalsContact O-CG1 3.27Å; R545-I549 WeakPolarHBondContact O-CG1 3.37Å; R545-I549 PolarHBondContact O-N 3.06Å; V546-I549 PolarHBondContact O-N 3.12Å; V547-I549 VanDerWaalsContact C-N 3.32Å; V547-I549 PolarHBondContact O-N 3.12Å; I549-Q552 PolarHBondContact O-N 3.46Å; I549-R553 PolarHBondContact O-N 3.23Å; I549-E579 HydrophobicContact CG2-CB 4.39Å; I549-E579 HydrophobicContact CG2-CG 4.28Å; I549-L580 HydrophobicContact CB-CD2 3.93Å; I549-L580 HydrophobicContact CD1-CD2 4.39Å; I549-L580 HydrophobicContact CG2-CD2 3.68Å; I549-L580 HydrophobicContact CG2-CG 4.04Å; I549-Y583 HydrophobicContact CD1-CD1 4.02Å; I549-Y583 HydrophobicContact CD1-CD2 4.2Å; I549-Y583 HydrophobicContact CD1-CG 3.64Å
550	I	89.3	Confident	81.4	Confident	9 Å²	9	73.4 Å²	73.4	5%	0.046	39%	0.387	C	S	.	.	H	α-helix	trans	-64.8	-53.9	177.1	-64.4	167.9	0	0	0	109.8	V546 V547 Q552 R553 E554 H557 I567 L572 T576 L580	V546-I550 HydrophobicContact CG1-CD1 4.36Å; V546-I550 PolarHBondContact O-N 2.93Å; V546-I550 VanDerWaalsContact O-N 3.17Å; V547-I550 PolarHBondContact O-N 2.92Å; V547-I550 VanDerWaalsContact O-N 3.15Å; I550-Q552 PolarHBondContact O-N 3.4Å; I550-Q552 VanDerWaalsContact O-N 3.09Å; I550-R553 PolarHBondContact O-N 2.9Å; I550-E554 HydrophobicContact CG2-CB 4.34Å; I550-E554 HydrophobicContact CG2-CG 4.37Å; I550-E554 PolarHBondContact O-N 3.02Å; I550-H557 HydrophobicContact CG2-CB 3.8Å; I550-I567 HydrophobicContact CD1-CD1 3.75Å; I550-I567 HydrophobicContact CD1-CG1 4.06Å; I550-I567 HydrophobicContact CD1-CG2 4.03Å; I550-L572 HydrophobicContact CG2-CD2 4.06Å; I550-T576 HydrophobicContact CG1-CG2 4.48Å; I550-L580 HydrophobicContact CD1-CD1 4.28Å; I550-L580 HydrophobicContact CG1-CD1 4.02Å; I550-L580 HydrophobicContact CG1-CD2 4.26Å
551	Q	85.6	Confident	80.4	Confident	66 Å²	66	74.7 Å²	74.7	31%	0.308	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-18.1	179.6	-69.6	177.5	-21.6	0	0	114.7	V547	V547-Q551 HydrophobicContact CG1-CG 4.29Å; V547-Q551 PolarHBondContact O-N 3.14Å
552	Q	85	Confident	79.2	Confident	119 Å²	119	72.6 Å²	72.6	56%	0.556	38%	0.38	S	S	*	.	H	α-helix	trans	-86.4	-25.2	174.7	-79.6	179.1	-18.5	0	0	113.8	Q548 I549 I550	Q548-Q552 HydrophobicContact CG-CG 4.49Å; Q548-Q552 VanDerWaalsContact O-CB 3.23Å; Q548-Q552 WeakPolarHBondContact O-CB 3.39Å; Q548-Q552 WeakPolarHBondContact O-CG 3.39Å; Q548-Q552 PolarHBondContact O-N 3.03Å; Q548-Q552 VanDerWaalsContact O-N 3.1Å; I549-Q552 PolarHBondContact O-N 3.46Å; I550-Q552 PolarHBondContact O-N 3.4Å; I550-Q552 VanDerWaalsContact O-N 3.09Å
553	R	84.3	Confident	77.9	Confident	107 Å²	107	76 Å²	76	40%	0.404	40%	0.401	S	S	.	.	H	α-helix	trans	-114.2	-21.4	-176.8	-67.4	-166.1	174.9	-173	5.3	114.8	I549 I550 P555 T575 T576 E579	I549-R553 PolarHBondContact O-N 3.23Å; I550-R553 PolarHBondContact O-N 2.9Å; R553-P555 WeakPolarHBondContact O-CD 3.35Å; R553-T575 PolarHBondContact NH1-O 2.98Å; R553-T576 HydrophobicContact CB-CG2 4.29Å; R553-T576 VanDerWaalsContact CB-OG1 3.26Å; R553-T576 WeakPolarHBondContact CB-OG1 3.28Å; R553-E579 IonicContact CZ-OE2 3.72Å; R553-E579 VanDerWaalsContact NH1-CB 3.35Å; R553-E579 IonicContact NH1-OE2 2.74Å; R553-E579 IonicContact NH2-OE2 3.59Å; R553-E579 PolarHBondContact NH2-OE2 3.16Å
554	E	83.4	Confident	76.7	Confident	15 Å²	15	79.9 Å²	79.9	7%	0.07	42%	0.418	C	S	.	.			trans	-120.9	88	179.5	-49.3	-67.9	174.3	0	0	109	I550 S556 H557 L572 Q573 T576	I550-E554 HydrophobicContact CG2-CB 4.34Å; I550-E554 HydrophobicContact CG2-CG 4.37Å; I550-E554 PolarHBondContact O-N 3.02Å; E554-S556 PolarHBondContact O-N 3.22Å; E554-H557 PolarHBondContact O-N 3.02Å; E554-L572 HydrophobicContact CG-CD2 3.78Å; E554-Q573 VanDerWaalsContact OE1-CB 3.25Å; E554-Q573 WeakPolarHBondContact OE1-CB 3.49Å; E554-Q573 WeakPolarHBondContact OE1-CG 3.11Å; E554-Q573 PolarHBondContact OE1-N 3.08Å; E554-T576 HydrophobicContact CG-CG2 4Å; E554-T576 WeakPolarHBondContact OE1-CB 3.26Å; E554-T576 PolarHBondContact OE1-OG1 2.7Å
555	P	69.1	Low	75.8	Confident	95 Å²	95	79.9 Å²	79.9	62%	0.617	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-58.6	-21.5	-177.1	-26.4	35.9	0	0	0	114.3	R553 H557 R558	R553-P555 WeakPolarHBondContact O-CD 3.35Å; P555-H557 VanDerWaalsContact C-N 3.26Å; P555-H557 PolarHBondContact O-N 2.63Å; P555-R558 WeakPolarHBondContact O-CB 3.4Å; P555-R558 WeakPolarHBondContact O-CG 3.39Å; P555-R558 PolarHBondContact O-N 3.28Å
556	S	70.4	Confident	74.8	Confident	90 Å²	90	84 Å²	84	63%	0.629	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-62.9	-23	174.3	46.5	0	0	0	0	114.7	E554 R558	E554-S556 PolarHBondContact O-N 3.22Å; S556-R558 VanDerWaalsContact C-N 3.34Å
557	H	65.8	Low	74.1	Confident	35 Å²	35	85.8 Å²	85.8	16%	0.162	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-94.3	17.9	-179.4	-73.8	-84.2	0	0	0	113.6	I550 E554 P555	I550-H557 HydrophobicContact CG2-CB 3.8Å; E554-H557 PolarHBondContact O-N 3.02Å; P555-H557 VanDerWaalsContact C-N 3.26Å; P555-H557 PolarHBondContact O-N 2.63Å
558	R	62.5	Low	73.7	Confident	171 Å²	171	88.2 Å²	88.2	65%	0.645	45%	0.449	S	S	*	.	S	Bend	trans	-76	-28.4	178.7	-77.6	-177.5	160.5	-141.8	-5.9	114.1	P555 S556	P555-R558 WeakPolarHBondContact O-CB 3.4Å; P555-R558 WeakPolarHBondContact O-CG 3.39Å; P555-R558 PolarHBondContact O-N 3.28Å; S556-R558 VanDerWaalsContact C-N 3.34Å
559	D	62.6	Low	73.5	Confident	156 Å²	156	85.5 Å²	85.5	83%	0.834	44%	0.436	S	S	*	.	S	Bend	trans	-96.5	8.8	-174	-52.7	-42	0	0	0	113.2
560	C	62.8	Low	73	Confident	47 Å²	47	91 Å²	91	32%	0.318	46%	0.462	S	S	.	.	S	Bend	trans	-71.9	142.5	175	-61.2	0	0	0	0	111.4
561	N	64	Low	72.6	Confident	83 Å²	83	94.3 Å²	94.3	44%	0.444	48%	0.482	S	S	.	.			trans	-57.8	122.4	172.6	179.2	14.5	0	0	0	110.2	D563 E564 I565	N561-D563 PolarHBondContact O-N 3.05Å; N561-D563 PolarHBondContact OD1-N 2.98Å; N561-E564 CarbonylContact O-C 3.36Å; N561-E564 PolarHBondContact O-N 3Å; N561-I565 VanDerWaalsContact O-CG1 3.26Å; N561-I565 WeakPolarHBondContact O-CG1 3.47Å
562	P	63.9	Low	72.6	Confident	100 Å²	100	91.5 Å²	91.5	65%	0.649	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.3	179.8	25.1	-35.5	0	0	0	113.8
563	D	61.4	Low	72.7	Confident	149 Å²	149	91 Å²	91	80%	0.797	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-19.7	-178.4	-62.2	-28.9	0	0	0	113.5	N561	N561-D563 PolarHBondContact O-N 3.05Å; N561-D563 PolarHBondContact OD1-N 2.98Å
564	E	65.5	Low	72.9	Confident	157 Å²	157	89.4 Å²	89.4	73%	0.734	46%	0.464	S	S	*	.			trans	-144.5	99.9	179.7	-172.7	167.1	-142.8	0	0	110.8	N561	N561-E564 CarbonylContact O-C 3.36Å; N561-E564 PolarHBondContact O-N 3Å
565	I	68.4	Low	73.1	Confident	53 Å²	53	90.8 Å²	90.8	27%	0.272	47%	0.474	S	S	.	.			trans	-115.5	95.1	-172.6	-57.2	172	0	0	0	109.4	V547 N561 I567	V547-I565 HydrophobicContact CB-CD1 4.18Å; V547-I565 HydrophobicContact CG1-CD1 3.6Å; V547-I565 HydrophobicContact CG2-CD1 3.45Å; V547-I565 VanDerWaalsContact CG2-CD1 3.45Å; N561-I565 VanDerWaalsContact O-CG1 3.26Å; N561-I565 WeakPolarHBondContact O-CG1 3.47Å; I565-I567 HydrophobicContact CG2-CG1 4.05Å
566	E	70.1	Confident	74.2	Confident	182 Å²	182	86.3 Å²	86.3	85%	0.85	45%	0.445	S	S	*	.			trans	-78.6	118.6	172.1	-166.7	167.9	-136.1	0	0	109.9
567	I	76.2	Confident	75.3	Confident	42 Å²	42	82 Å²	82	22%	0.215	42%	0.415	C	S	.	.			trans	-103.2	103.1	-174.7	-56.7	171.9	0	0	0	109.4	V546 I550 I565 F569 L572	V546-I567 HydrophobicContact CG1-CD1 4.38Å; I550-I567 HydrophobicContact CD1-CD1 3.75Å; I550-I567 HydrophobicContact CD1-CG1 4.06Å; I550-I567 HydrophobicContact CD1-CG2 4.03Å; I565-I567 HydrophobicContact CG2-CG1 4.05Å; I567-F569 HydrophobicContact CB-CE2 4.1Å; I567-F569 HydrophobicContact CG2-CD2 4.2Å; I567-F569 HydrophobicContact CG2-CE2 3.82Å; I567-F569 HydrophobicContact CG2-CZ 4.02Å; I567-F569 VanDerWaalsContact O-CD2 3.24Å; I567-F569 WeakPolarHBondContact O-CD2 3.38Å; I567-F569 WeakPolarHBondContact O-CE2 3.49Å; I567-F569 PolarHBondContact O-N 2.85Å; I567-L572 HydrophobicContact CG2-CD1 3.71Å
568	D	79.7	Confident	76.6	Confident	83 Å²	83	82.3 Å²	82.3	44%	0.444	42%	0.415	S	S	.	.			trans	-79.4	106	172.5	-172.1	-10.8	0	0	0	110.8	E570 T571	D568-E570 PolarHBondContact O-N 3.28Å; D568-E570 WeakPolarHBondContact OD1-CA 3.49Å; D568-E570 VanDerWaalsContact OD1-CB 3.3Å; D568-E570 WeakPolarHBondContact OD1-CB 3.41Å; D568-E570 PolarHBondContact OD1-N 2.72Å; D568-T571 HydrophobicContact CB-CG2 4.24Å; D568-T571 PolarHBondContact O-N 2.8Å; D568-T571 PolarHBondContact O-OG1 2.84Å; D568-T571 VanDerWaalsContact O-OG1 3.06Å
569	F	83.4	Confident	78	Confident	29 Å²	29	76.3 Å²	76.3	13%	0.127	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.2	179.2	-71.5	-97.2	0	0	0	113.5	K528 L531 I535 I567 L577	K528-F569 HydrophobicContact CD-CB 4.43Å; K528-F569 WeakPolarHBondContact CE-O 2.99Å; K528-F569 PolarHBondContact NZ-O 2.84Å; L531-F569 HydrophobicContact CD2-CD1 4.48Å; L531-F569 HydrophobicContact CD2-CE1 3.99Å; L531-F569 HydrophobicContact CG-CE1 4.05Å; I535-F569 HydrophobicContact CD1-CE1 4.03Å; I535-F569 HydrophobicContact CD1-CZ 3.78Å; I567-F569 HydrophobicContact CB-CE2 4.1Å; I567-F569 HydrophobicContact CG2-CD2 4.2Å; I567-F569 HydrophobicContact CG2-CE2 3.82Å; I567-F569 HydrophobicContact CG2-CZ 4.02Å; I567-F569 VanDerWaalsContact O-CD2 3.24Å; I567-F569 WeakPolarHBondContact O-CD2 3.38Å; I567-F569 WeakPolarHBondContact O-CE2 3.49Å; I567-F569 PolarHBondContact O-N 2.85Å; F569-L577 HydrophobicContact CD1-CD2 3.76Å; F569-L577 HydrophobicContact CE1-CD2 4.44Å
570	E	80.4	Confident	79.5	Confident	122 Å²	122	68.9 Å²	68.9	57%	0.57	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-18.4	175.3	-113.7	54.4	-106.1	0	0	113.1	K528 D568	K528-E570 WeakPolarHBondContact CD-OE1 3.45Å; K528-E570 WeakPolarHBondContact CE-OE1 3.2Å; K528-E570 IonicContact NZ-OE1 2.79Å; K528-E570 PolarHBondContact NZ-OE1 2.94Å; D568-E570 PolarHBondContact O-N 3.28Å; D568-E570 WeakPolarHBondContact OD1-CA 3.49Å; D568-E570 VanDerWaalsContact OD1-CB 3.3Å; D568-E570 WeakPolarHBondContact OD1-CB 3.41Å; D568-E570 PolarHBondContact OD1-N 2.72Å
571	T	81.4	Confident	80.9	Confident	79 Å²	79	68.1 Å²	68.1	49%	0.485	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-28.7	176.2	60.6	0	0	0	0	114.4	D568	D568-T571 HydrophobicContact CB-CG2 4.24Å; D568-T571 PolarHBondContact O-N 2.8Å; D568-T571 PolarHBondContact O-OG1 2.84Å; D568-T571 VanDerWaalsContact O-OG1 3.06Å
572	L	84.7	Confident	82.3	Confident	7 Å²	7	70.2 Å²	70.2	4%	0.037	35%	0.351	C	S	.	.	S	Bend	trans	-63.2	140	179.8	-63.1	178.3	0	0	0	112.9	I550 E554 I567 T576 L577 L580	I550-L572 HydrophobicContact CG2-CD2 4.06Å; E554-L572 HydrophobicContact CG-CD2 3.78Å; I567-L572 HydrophobicContact CG2-CD1 3.71Å; L572-T576 HydrophobicContact CD2-CG2 4.43Å; L572-L577 HydrophobicContact CB-CD1 4.45Å; L572-L577 HydrophobicContact CB-CD2 3.92Å; L572-L577 HydrophobicContact CB-CG 3.9Å; L572-L577 HydrophobicContact CD1-CD2 3.84Å; L572-L580 HydrophobicContact CD1-CD1 3.97Å
573	Q	86.6	Confident	83.8	Confident	109 Å²	109	67.2 Å²	67.2	51%	0.509	33%	0.327	S	S	.	.			trans	-64.8	149.5	175.7	-64.7	-62.8	-27	0	0	112.4	E554 T575 T576 L577	E554-Q573 VanDerWaalsContact OE1-CB 3.25Å; E554-Q573 WeakPolarHBondContact OE1-CB 3.49Å; E554-Q573 WeakPolarHBondContact OE1-CG 3.11Å; E554-Q573 PolarHBondContact OE1-N 3.08Å; Q573-T575 WeakPolarHBondContact CB-OG1 3.31Å; Q573-T575 PolarHBondContact O-N 2.95Å; Q573-T576 WeakPolarHBondContact O-CB 3.36Å; Q573-T576 PolarHBondContact O-N 3.13Å; Q573-L577 WeakPolarHBondContact O-CB 3.24Å; Q573-L577 WeakPolarHBondContact O-CG 3.05Å; Q573-L577 PolarHBondContact O-N 2.94Å
574	H	87.9	Confident	85.4	Confident	73 Å²	73	60.2 Å²	60.2	34%	0.338	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-31.7	175.6	-65.2	115.8	0	0	0	113.2	M523 R578	M523-H574 PolarHBondContact N-CD2 2.79Å; H574-R578 WeakPolarHBondContact O-CG 3.37Å; H574-R578 PolarHBondContact O-N 2.75Å
575	T	89.6	Confident	86.6	Confident	45 Å²	45	57.4 Å²	57.4	28%	0.276	28%	0.275	S	S	.	.	H	α-helix	trans	-64.7	-44.6	173.4	52.7	0	0	0	0	111.9	V520 R553 Q573 E579	V520-T575 HydrophobicContact CB-CG2 4.28Å; V520-T575 HydrophobicContact CG2-CG2 4.07Å; R553-T575 PolarHBondContact NH1-O 2.98Å; Q573-T575 WeakPolarHBondContact CB-OG1 3.31Å; Q573-T575 PolarHBondContact O-N 2.95Å; T575-E579 PolarHBondContact O-N 2.81Å
576	T	91.7	Very high	87.7	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-48	174.9	-54.9	0	0	0	0	111.1	I550 R553 E554 L572 Q573 R578 E579 L580	I550-T576 HydrophobicContact CG1-CG2 4.48Å; R553-T576 HydrophobicContact CB-CG2 4.29Å; R553-T576 VanDerWaalsContact CB-OG1 3.26Å; R553-T576 WeakPolarHBondContact CB-OG1 3.28Å; E554-T576 HydrophobicContact CG-CG2 4Å; E554-T576 WeakPolarHBondContact OE1-CB 3.26Å; E554-T576 PolarHBondContact OE1-OG1 2.7Å; L572-T576 HydrophobicContact CD2-CG2 4.43Å; Q573-T576 WeakPolarHBondContact O-CB 3.36Å; Q573-T576 PolarHBondContact O-N 3.13Å; T576-R578 VanDerWaalsContact C-N 3.35Å; T576-R578 PolarHBondContact O-N 3.29Å; T576-E579 PolarHBondContact O-N 3.25Å; T576-E579 VanDerWaalsContact O-N 3.14Å; T576-L580 HydrophobicContact CG2-CD1 4.2Å; T576-L580 HydrophobicContact CG2-CG 4.44Å; T576-L580 WeakPolarHBondContact O-CG 3.25Å; T576-L580 PolarHBondContact O-N 2.82Å
577	L	93	Very high	88.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.8	-42.4	178.7	-74.8	174.8	0	0	0	112.9	M523 K528 L531 F569 L572 Q573 E581	M523-L577 HydrophobicContact CE-CB 3.69Å; M523-L577 HydrophobicContact CE-CD1 4.34Å; M523-L577 HydrophobicContact CE-CD2 3.85Å; M523-L577 HydrophobicContact CE-CG 4.18Å; M523-L577 HydrophobicContact SD-CB 4.36Å; K528-L577 HydrophobicContact CG-CD1 4.49Å; L531-L577 HydrophobicContact CD2-CD2 4.34Å; F569-L577 HydrophobicContact CD1-CD2 3.76Å; F569-L577 HydrophobicContact CE1-CD2 4.44Å; L572-L577 HydrophobicContact CB-CD1 4.45Å; L572-L577 HydrophobicContact CB-CD2 3.92Å; L572-L577 HydrophobicContact CB-CG 3.9Å; L572-L577 HydrophobicContact CD1-CD2 3.84Å; Q573-L577 WeakPolarHBondContact O-CB 3.24Å; Q573-L577 WeakPolarHBondContact O-CG 3.05Å; Q573-L577 PolarHBondContact O-N 2.94Å; L577-E581 WeakPolarHBondContact O-CB 3.33Å; L577-E581 PolarHBondContact O-N 3.01Å
578	R	92.9	Very high	89.3	Confident	41 Å²	41	48.8 Å²	48.8	16%	0.155	24%	0.24	C	C	.	.	H	α-helix	trans	-74.5	-28.9	176.7	-68.1	-64.1	-171.9	-170.8	-5.9	113.5	V520 R521 P522 E527 H574 T576 E581 K582	V520-R578 HydrophobicContact CG1-CB 3.92Å; V520-R578 HydrophobicContact CG1-CG 3.63Å; R521-R578 VanDerWaalsContact NH1-NH2 3.12Å; R521-R578 PolarHBondContact O-NE 2.9Å; R521-R578 PolarHBondContact O-NH2 2.66Å; P522-R578 PolarHBondContact O-NH2 2.86Å; E527-R578 VanDerWaalsContact CD-NH2 3.3Å; E527-R578 IonicContact OE1-CZ 3.14Å; E527-R578 IonicContact OE1-NH1 2.66Å; E527-R578 PolarHBondContact OE1-NH1 3.48Å; E527-R578 IonicContact OE1-NH2 3.78Å; E527-R578 PolarHBondContact OE1-NH2 2.97Å; E527-R578 VanDerWaalsContact OE1-NH2 3.11Å; E527-R578 IonicContact OE2-CZ 3.14Å; E527-R578 IonicContact OE2-NH1 2.86Å; E527-R578 IonicContact OE2-NH2 3.4Å; E527-R578 PolarHBondContact OE2-NH2 3.01Å; H574-R578 WeakPolarHBondContact O-CG 3.37Å; H574-R578 PolarHBondContact O-N 2.75Å; T576-R578 VanDerWaalsContact C-N 3.35Å; T576-R578 PolarHBondContact O-N 3.29Å; R578-E581 WeakPolarHBondContact CD-OE2 3.5Å; R578-E581 IonicContact CZ-OE2 3.87Å; R578-E581 IonicContact NE-OE2 3.99Å; R578-E581 IonicContact NH1-OE1 2.72Å; R578-E581 IonicContact NH1-OE2 2.8Å; R578-E581 PolarHBondContact NH1-OE2 3.46Å; R578-E581 PolarHBondContact O-N 3.35Å; R578-K582 VanDerWaalsContact O-CB 3.28Å; R578-K582 WeakPolarHBondContact O-CB 3.18Å; R578-K582 PolarHBondContact O-N 2.82Å
579	E	91.5	Very high	89.3	Confident	44 Å²	44	50.5 Å²	50.5	21%	0.206	25%	0.245	C	C	.	.	H	α-helix	trans	-73.9	-36.6	172.8	-164.8	70.1	-126.9	0	0	112	I549 R553 T575 T576 K582 Y583	I549-E579 HydrophobicContact CG2-CB 4.39Å; I549-E579 HydrophobicContact CG2-CG 4.28Å; R553-E579 IonicContact CZ-OE2 3.72Å; R553-E579 VanDerWaalsContact NH1-CB 3.35Å; R553-E579 IonicContact NH1-OE2 2.74Å; R553-E579 IonicContact NH2-OE2 3.59Å; R553-E579 PolarHBondContact NH2-OE2 3.16Å; T575-E579 PolarHBondContact O-N 2.81Å; T576-E579 PolarHBondContact O-N 3.25Å; T576-E579 VanDerWaalsContact O-N 3.14Å; E579-K582 VanDerWaalsContact CD-NZ 3.35Å; E579-K582 PolarHBondContact O-N 2.72Å; E579-K582 VanDerWaalsContact OE1-CD 3.32Å; E579-K582 WeakPolarHBondContact OE1-CD 3.35Å; E579-K582 VanDerWaalsContact OE1-CE 3.23Å; E579-K582 WeakPolarHBondContact OE1-CE 3.43Å; E579-K582 IonicContact OE1-NZ 2.7Å; E579-K582 PolarHBondContact OE1-NZ 2.72Å; E579-K582 IonicContact OE2-NZ 2.98Å; E579-K582 PolarHBondContact OE2-NZ 2.86Å; E579-Y583 WeakPolarHBondContact O-CB 3.47Å; E579-Y583 PolarHBondContact O-N 2.84Å
580	L	94.1	Very high	88.8	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-60.2	-47.2	168.2	-70.9	175.1	0	0	0	110.7	L531 V546 I549 I550 L572 T576 K582 Y583 V584	L531-L580 HydrophobicContact CD2-CB 3.92Å; V546-L580 HydrophobicContact CG1-CD2 3.85Å; I549-L580 HydrophobicContact CB-CD2 3.93Å; I549-L580 HydrophobicContact CD1-CD2 4.39Å; I549-L580 HydrophobicContact CG2-CD2 3.68Å; I549-L580 HydrophobicContact CG2-CG 4.04Å; I550-L580 HydrophobicContact CD1-CD1 4.28Å; I550-L580 HydrophobicContact CG1-CD1 4.02Å; I550-L580 HydrophobicContact CG1-CD2 4.26Å; L572-L580 HydrophobicContact CD1-CD1 3.97Å; T576-L580 HydrophobicContact CG2-CD1 4.2Å; T576-L580 HydrophobicContact CG2-CG 4.44Å; T576-L580 WeakPolarHBondContact O-CG 3.25Å; T576-L580 PolarHBondContact O-N 2.82Å; L580-K582 VanDerWaalsContact C-N 3.34Å; L580-K582 PolarHBondContact O-N 3.07Å; L580-Y583 PolarHBondContact O-N 3.28Å; L580-V584 VanDerWaalsContact O-CB 3.3Å; L580-V584 WeakPolarHBondContact O-CB 3.36Å; L580-V584 WeakPolarHBondContact O-CG2 3.3Å; L580-V584 PolarHBondContact O-N 3.36Å
581	E	93.8	Very high	87.9	Confident	30 Å²	30	54.3 Å²	54.3	14%	0.14	27%	0.266	C	S	.	.	H	α-helix	trans	-57.4	-45.1	175	-172.5	-174.8	-157.2	0	0	112.2	L531 L577 R578 K585	L531-E581 HydrophobicContact CD1-CB 4.24Å; L531-E581 HydrophobicContact CD2-CB 4.49Å; L577-E581 WeakPolarHBondContact O-CB 3.33Å; L577-E581 PolarHBondContact O-N 3.01Å; R578-E581 WeakPolarHBondContact CD-OE2 3.5Å; R578-E581 IonicContact CZ-OE2 3.87Å; R578-E581 IonicContact NE-OE2 3.99Å; R578-E581 IonicContact NH1-OE1 2.72Å; R578-E581 IonicContact NH1-OE2 2.8Å; R578-E581 PolarHBondContact NH1-OE2 3.46Å; R578-E581 PolarHBondContact O-N 3.35Å; E581-K585 HydrophobicContact CG-CD 3.99Å; E581-K585 VanDerWaalsContact CG-CE 3.45Å; E581-K585 VanDerWaalsContact O-CB 3.24Å; E581-K585 WeakPolarHBondContact O-CB 3.21Å; E581-K585 WeakPolarHBondContact O-CG 3.34Å; E581-K585 PolarHBondContact O-N 3.4Å; E581-K585 VanDerWaalsContact OE1-CE 3.27Å; E581-K585 WeakPolarHBondContact OE1-CE 3.27Å; E581-K585 IonicContact OE1-NZ 3.97Å; E581-K585 PolarHBondContact OE1-NZ 3.37Å; E581-K585 IonicContact OE2-NZ 3.18Å
582	K	93.3	Very high	86.5	Confident	128 Å²	128	57.5 Å²	57.5	56%	0.557	27%	0.273	S	S	*	.	H	α-helix	trans	-62.6	-45.2	176	176	177	158.2	-146.7	0	112.1	R578 E579 L580 S586	R578-K582 VanDerWaalsContact O-CB 3.28Å; R578-K582 WeakPolarHBondContact O-CB 3.18Å; R578-K582 PolarHBondContact O-N 2.82Å; E579-K582 VanDerWaalsContact CD-NZ 3.35Å; E579-K582 PolarHBondContact O-N 2.72Å; E579-K582 VanDerWaalsContact OE1-CD 3.32Å; E579-K582 WeakPolarHBondContact OE1-CD 3.35Å; E579-K582 VanDerWaalsContact OE1-CE 3.23Å; E579-K582 WeakPolarHBondContact OE1-CE 3.43Å; E579-K582 IonicContact OE1-NZ 2.7Å; E579-K582 PolarHBondContact OE1-NZ 2.72Å; E579-K582 IonicContact OE2-NZ 2.98Å; E579-K582 PolarHBondContact OE2-NZ 2.86Å; L580-K582 VanDerWaalsContact C-N 3.34Å; L580-K582 PolarHBondContact O-N 3.07Å; K582-S586 WeakPolarHBondContact O-CB 3.44Å; K582-S586 PolarHBondContact O-N 2.83Å
583	Y	94.8	Very high	84.7	Confident	36 Å²	36	59.7 Å²	59.7	14%	0.141	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-52.1	176.2	178.1	-108	0	0	0	111.8	L538 R545 V546 I549 E579 L580 K585 S586 V587	L538-Y583 HydrophobicContact CD1-CE1 4.28Å; R545-Y583 HydrophobicContact CB-CE1 4.05Å; R545-Y583 HydrophobicContact CB-CE2 4.25Å; R545-Y583 WeakPolarHBondContact CB-OH 3.39Å; R545-Y583 HydrophobicContact CG-CD2 4.15Å; R545-Y583 HydrophobicContact CG-CE1 4.04Å; R545-Y583 HydrophobicContact CG-CE2 3.56Å; V546-Y583 HydrophobicContact CG2-CD1 4.16Å; V546-Y583 HydrophobicContact CG2-CE1 4.06Å; I549-Y583 HydrophobicContact CD1-CD1 4.02Å; I549-Y583 HydrophobicContact CD1-CD2 4.2Å; I549-Y583 HydrophobicContact CD1-CG 3.64Å; E579-Y583 WeakPolarHBondContact O-CB 3.47Å; E579-Y583 PolarHBondContact O-N 2.84Å; L580-Y583 PolarHBondContact O-N 3.28Å; Y583-K585 PolarHBondContact O-N 3.39Å; Y583-S586 WeakPolarHBondContact O-CA 3.35Å; Y583-S586 WeakPolarHBondContact O-CB 3.38Å; Y583-S586 PolarHBondContact O-N 3.3Å; Y583-S586 PolarHBondContact O-OG 2.67Å; Y583-V587 HydrophobicContact CD2-CG2 4.43Å; Y583-V587 HydrophobicContact CE1-CG2 3.98Å; Y583-V587 HydrophobicContact CE2-CG2 3.83Å; Y583-V587 PolarHBondContact O-N 3.15Å
584	V	94.3	Very high	82.7	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-59.1	-46.8	-179.4	171.8	0	0	0	0	110.7	L531 D534 I535 L538 L580 S586 V587 L588	L531-V584 HydrophobicContact CD1-CB 4.07Å; L531-V584 HydrophobicContact CD1-CG1 4.32Å; L531-V584 HydrophobicContact CD1-CG2 3.86Å; D534-V584 HydrophobicContact CB-CG1 3.63Å; I535-V584 HydrophobicContact CD1-CG2 4.41Å; I535-V584 HydrophobicContact CG1-CG2 3.52Å; L538-V584 HydrophobicContact CD1-CG2 4.12Å; L538-V584 HydrophobicContact CD2-CG1 4.42Å; L580-V584 VanDerWaalsContact O-CB 3.3Å; L580-V584 WeakPolarHBondContact O-CB 3.36Å; L580-V584 WeakPolarHBondContact O-CG2 3.3Å; L580-V584 PolarHBondContact O-N 3.36Å; V584-S586 VanDerWaalsContact C-N 3.32Å; V584-S586 PolarHBondContact O-N 2.91Å; V584-V587 PolarHBondContact O-N 3.45Å; V584-L588 HydrophobicContact CG1-CD1 3.79Å; V584-L588 HydrophobicContact CG1-CG 4.36Å; V584-L588 WeakPolarHBondContact O-CB 3.04Å; V584-L588 WeakPolarHBondContact O-CG 3.41Å; V584-L588 PolarHBondContact O-N 2.71Å
585	K	91.9	Very high	80.5	Confident	99 Å²	99	58.7 Å²	58.7	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-41.7	172.7	-75.2	174.5	-175.7	172.2	0	111.7	E581 Y583 V587 L588 Q589	E581-K585 HydrophobicContact CG-CD 3.99Å; E581-K585 VanDerWaalsContact CG-CE 3.45Å; E581-K585 VanDerWaalsContact O-CB 3.24Å; E581-K585 WeakPolarHBondContact O-CB 3.21Å; E581-K585 WeakPolarHBondContact O-CG 3.34Å; E581-K585 PolarHBondContact O-N 3.4Å; E581-K585 VanDerWaalsContact OE1-CE 3.27Å; E581-K585 WeakPolarHBondContact OE1-CE 3.27Å; E581-K585 IonicContact OE1-NZ 3.97Å; E581-K585 PolarHBondContact OE1-NZ 3.37Å; E581-K585 IonicContact OE2-NZ 3.18Å; Y583-K585 PolarHBondContact O-N 3.39Å; K585-V587 PolarHBondContact O-N 3.3Å; K585-L588 PolarHBondContact O-N 2.8Å; K585-Q589 VanDerWaalsContact O-CB 3.22Å; K585-Q589 WeakPolarHBondContact O-CB 3.48Å; K585-Q589 WeakPolarHBondContact O-CG 3.42Å; K585-Q589 PolarHBondContact O-N 2.9Å
586	S	91.2	Very high	78.1	Confident	50 Å²	50	63.9 Å²	63.9	35%	0.35	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-38.4	179.3	82.8	0	0	0	0	113	K582 Y583 V584 K590	K582-S586 WeakPolarHBondContact O-CB 3.44Å; K582-S586 PolarHBondContact O-N 2.83Å; Y583-S586 WeakPolarHBondContact O-CA 3.35Å; Y583-S586 WeakPolarHBondContact O-CB 3.38Å; Y583-S586 PolarHBondContact O-N 3.3Å; Y583-S586 PolarHBondContact O-OG 2.67Å; V584-S586 VanDerWaalsContact C-N 3.32Å; V584-S586 PolarHBondContact O-N 2.91Å; S586-K590 WeakPolarHBondContact O-CB 3.49Å; S586-K590 WeakPolarHBondContact O-CG 3.18Å; S586-K590 PolarHBondContact O-N 3Å; S586-K590 VanDerWaalsContact O-N 3.12Å
587	V	90.5	Very high	75.3	Confident	15 Å²	15	72.9 Å²	72.9	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-72.8	-47.9	177.1	179	0	0	0	0	110.7	L538 K542 Y583 V584 K585 Q589 K590 T591	L538-V587 HydrophobicContact CD2-CB 3.7Å; L538-V587 HydrophobicContact CD2-CG1 3.67Å; L538-V587 HydrophobicContact CD2-CG2 4.34Å; K542-V587 HydrophobicContact CG-CG1 4.14Å; Y583-V587 HydrophobicContact CD2-CG2 4.43Å; Y583-V587 HydrophobicContact CE1-CG2 3.98Å; Y583-V587 HydrophobicContact CE2-CG2 3.83Å; Y583-V587 PolarHBondContact O-N 3.15Å; V584-V587 PolarHBondContact O-N 3.45Å; K585-V587 PolarHBondContact O-N 3.3Å; V587-Q589 VanDerWaalsContact C-N 3.28Å; V587-Q589 PolarHBondContact O-N 3.39Å; V587-K590 PolarHBondContact O-N 3.5Å; V587-T591 PolarHBondContact O-N 2.99Å; V587-T591 PolarHBondContact O-OG1 2.99Å
588	L	88.3	Confident	72.4	Confident	30 Å²	30	83 Å²	83	16%	0.157	41%	0.405	C	S	.	.	H	α-helix	trans	-69.2	-23.4	-179.7	-63.9	-179.7	0	0	0	113.3	D534 K537 L538 V584 K585 T591 K592	D534-L588 HydrophobicContact CB-CD1 3.77Å; K537-L588 HydrophobicContact CB-CD1 4.42Å; K537-L588 HydrophobicContact CB-CD2 3.89Å; L538-L588 HydrophobicContact CD2-CD2 4.26Å; L538-L588 HydrophobicContact CD2-CG 4.25Å; V584-L588 HydrophobicContact CG1-CD1 3.79Å; V584-L588 HydrophobicContact CG1-CG 4.36Å; V584-L588 WeakPolarHBondContact O-CB 3.04Å; V584-L588 WeakPolarHBondContact O-CG 3.41Å; V584-L588 PolarHBondContact O-N 2.71Å; K585-L588 PolarHBondContact O-N 2.8Å; L588-T591 PolarHBondContact O-OG1 3.26Å; L588-K592 WeakPolarHBondContact O-CB 3.43Å; L588-K592 VanDerWaalsContact O-CG 3.27Å; L588-K592 WeakPolarHBondContact O-CG 3.45Å; L588-K592 PolarHBondContact O-N 2.82Å
589	Q	80.5	Confident	69.7	Low	120 Å²	120	87.1 Å²	87.1	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-76.6	-35.5	167.9	-74.8	-178.7	14.8	0	0	112.3	K585 V587 K592 S593 R596	K585-Q589 VanDerWaalsContact O-CB 3.22Å; K585-Q589 WeakPolarHBondContact O-CB 3.48Å; K585-Q589 WeakPolarHBondContact O-CG 3.42Å; K585-Q589 PolarHBondContact O-N 2.9Å; V587-Q589 VanDerWaalsContact C-N 3.28Å; V587-Q589 PolarHBondContact O-N 3.39Å; Q589-K592 CarbonylContact O-C 3.6Å; Q589-K592 PolarHBondContact O-N 3.48Å; Q589-S593 PolarHBondContact O-N 3.31Å; Q589-S593 PolarHBondContact O-OG 3.21Å; Q589-S593 VanDerWaalsContact O-OG 3.12Å; Q589-R596 PolarHBondContact O-NH2 3.25Å
590	K	72.6	Confident	66.9	Low	156 Å²	156	94.8 Å²	94.8	68%	0.678	47%	0.467	S	S	*	.	H	α-helix	trans	-69.2	-42	176.7	-83.3	-177.4	176.5	-177.9	0	112.8	S586 V587 K592 S593 G594	S586-K590 WeakPolarHBondContact O-CB 3.49Å; S586-K590 WeakPolarHBondContact O-CG 3.18Å; S586-K590 PolarHBondContact O-N 3Å; S586-K590 VanDerWaalsContact O-N 3.12Å; V587-K590 PolarHBondContact O-N 3.5Å; K590-K592 VanDerWaalsContact C-N 3.3Å; K590-K592 PolarHBondContact O-N 2.9Å; K590-S593 WeakPolarHBondContact CA-OG 3.29Å; K590-S593 PolarHBondContact O-N 3.31Å; K590-S593 PolarHBondContact O-OG 2.99Å; K590-G594 PolarHBondContact O-N 3.24Å; K590-G594 VanDerWaalsContact O-N 3.14Å
591	T	61.6	Low	64	Low	74 Å²	74	104.8 Å²	104.8	45%	0.454	51%	0.511	S	S	.	.	H	α-helix	trans	-60.1	-44.3	170.6	55.9	0	0	0	0	110.3	V587 L588 S593 G594	V587-T591 PolarHBondContact O-N 2.99Å; V587-T591 PolarHBondContact O-OG1 2.99Å; L588-T591 PolarHBondContact O-OG1 3.26Å; T591-S593 PolarHBondContact O-N 2.66Å; T591-G594 PolarHBondContact O-N 2.75Å; T591-G594 VanDerWaalsContact O-N 3.16Å
592	K	53	Low	61	Low	147 Å²	147	106.2 Å²	106.2	64%	0.639	53%	0.533	S	S	*	.	H	α-helix	trans	-68.6	-6.7	172.4	-71.5	179.5	178.1	-177.9	0	115.3	L588 Q589 K590 R596	L588-K592 WeakPolarHBondContact O-CB 3.43Å; L588-K592 VanDerWaalsContact O-CG 3.27Å; L588-K592 WeakPolarHBondContact O-CG 3.45Å; L588-K592 PolarHBondContact O-N 2.82Å; Q589-K592 CarbonylContact O-C 3.6Å; Q589-K592 PolarHBondContact O-N 3.48Å; K590-K592 VanDerWaalsContact C-N 3.3Å; K590-K592 PolarHBondContact O-N 2.9Å; K592-R596 WeakPolarHBondContact O-CG 3.19Å; K592-R596 PolarHBondContact O-NE 2.99Å
593	S	45.1	Very low	58.2	Low	53 Å²	53	109 Å²	109	37%	0.371	55%	0.553	S	S	.	*	H	α-helix	trans	-101.8	-9.6	167.4	41.3	0	0	0	0	114.6	Q589 K590 T591 S595 R596	Q589-S593 PolarHBondContact O-N 3.31Å; Q589-S593 PolarHBondContact O-OG 3.21Å; Q589-S593 VanDerWaalsContact O-OG 3.12Å; K590-S593 WeakPolarHBondContact CA-OG 3.29Å; K590-S593 PolarHBondContact O-N 3.31Å; K590-S593 PolarHBondContact O-OG 2.99Å; T591-S593 PolarHBondContact O-N 2.66Å; S593-S595 PolarHBondContact O-N 2.96Å; S593-R596 PolarHBondContact O-N 3.01Å
594	G	44.5	Very low	55.2	Low	58 Å²	58	112.8 Å²	112.8	60%	0.598	58%	0.584	S	S	*	*	H	α-helix	trans	-54.3	-42.5	164.1	0	0	0	0	0	111.8	K590 T591 R596	K590-G594 PolarHBondContact O-N 3.24Å; K590-G594 VanDerWaalsContact O-N 3.14Å; T591-G594 PolarHBondContact O-N 2.75Å; T591-G594 VanDerWaalsContact O-N 3.16Å; G594-R596 VanDerWaalsContact C-N 3.32Å; G594-R596 PolarHBondContact O-N 2.76Å
595	S	42.5	Very low	52.4	Low	102 Å²	102	116.5 Å²	116.5	71%	0.713	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-5.7	175.1	-45.7	0	0	0	0	114.9	S593 K597	S593-S595 PolarHBondContact O-N 2.96Å; S595-K597 PolarHBondContact O-N 2.84Å
596	R	39.3	Very low	49.9	Very low	154 Å²	154	117.8 Å²	117.8	58%	0.581	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	23.7	-175.5	-75	-175.2	-85.3	164.9	-0.1	114.5	Q589 K592 S593 G594 Y598	Q589-R596 PolarHBondContact O-NH2 3.25Å; K592-R596 WeakPolarHBondContact O-CG 3.19Å; K592-R596 PolarHBondContact O-NE 2.99Å; S593-R596 PolarHBondContact O-N 3.01Å; G594-R596 VanDerWaalsContact C-N 3.32Å; G594-R596 PolarHBondContact O-N 2.76Å; R596-Y598 PolarHBondContact O-N 2.76Å; R596-Y598 VanDerWaalsContact O-N 3.17Å
597	K	32.9	Very low	47.6	Very low	191 Å²	191	120 Å²	120	83%	0.83	65%	0.653	S	S	*	*			trans	-67.3	-2.8	168.9	-86.6	-174.6	172.7	179.9	0	114.7	S595	S595-K597 PolarHBondContact O-N 2.84Å
598	Y	32.6	Very low	44.9	Very low	211 Å²	211	125.8 Å²	125.8	83%	0.827	69%	0.69	S	S	*	*	S	Bend	trans	-100	39.9	-178.5	-81.4	-77.8	0	0	0	115	R596	R596-Y598 PolarHBondContact O-N 2.76Å; R596-Y598 VanDerWaalsContact O-N 3.17Å
599	V	36.3	Very low	43.1	Very low	129 Å²	129	127.6 Å²	127.6	78%	0.782	72%	0.716	S	S	*	*	S	Bend	trans	-139.7	132.2	156.9	-172.6	0	0	0	0	109.2
600	K	31.6	Very low	41.4	Very low	205 Å²	205	127.4 Å²	127.4	89%	0.891	71%	0.714	S	S	*	*	S	Bend	trans	67.3	61.3	167.4	-156.8	172.5	-175.9	175	0	118
601	K	34.5	Very low	40.5	Very low	211 Å²	211	123.5 Å²	123.5	92%	0.917	70%	0.703	S	S	*	*			trans	-152.9	127.6	140.8	-164.6	174.1	-175.5	-179.8	0	112.5
602	G	30.8	Very low	39.7	Very low	59 Å²	59	128.9 Å²	128.9	61%	0.608	72%	0.715	S	S	*	*			trans	71.1	115.6	152.3	0	0	0	0	0	119.2	S604	G602-S604 PolarHBondContact O-N 3.49Å
603	L	33.7	Very low	39.7	Very low	188 Å²	188	129.5 Å²	129.5	98%	0.984	72%	0.72	S	S	*	*	S	Bend	trans	-72.3	99.2	150	-88.9	61.6	0	0	0	108.1
604	S	30.9	Very low	40.5	Very low	114 Å²	114	131 Å²	131	80%	0.797	72%	0.721	S	S	*	*			trans	-169.6	117.6	168.1	55.7	0	0	0	0	110.2	G602	G602-S604 PolarHBondContact O-N 3.49Å
605	G	35.9	Very low	40.8	Very low	80 Å²	80	131.9 Å²	131.9	83%	0.825	72%	0.717	S	S	*	*	S	Bend	trans	117.4	17	172.7	0	0	0	0	0	117.4
606	V	40.3	Very low	41.3	Very low	127 Å²	127	130.4 Å²	130.4	77%	0.77	70%	0.7	S	S	*	*			trans	-113.5	125.9	166.3	179.8	0	0	0	0	107.9
607	P	42.5	Very low	42.7	Very low	97 Å²	97	130 Å²	130	63%	0.63	70%	0.702	S	S	*	*			trans	-67	136	172.6	28.4	-33.4	0	0	0	109.6	G609	P607-G609 PolarHBondContact O-N 3.48Å
608	P	33.6	Very low	44.4	Very low	136 Å²	136	125.6 Å²	125.6	88%	0.883	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	130	-176.4	27.4	-34.2	0	0	0	110.8
609	G	49.9	Very low	45.7	Very low	68 Å²	68	117.7 Å²	117.7	70%	0.701	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.8	-47.9	170.7	0	0	0	0	0	115.1	P607 T611	P607-G609 PolarHBondContact O-N 3.48Å; G609-T611 PolarHBondContact O-N 3.48Å
610	K	44.5	Very low	46.8	Very low	116 Å²	116	114.8 Å²	114.8	50%	0.504	64%	0.637	S	S	.	*			trans	-72.5	121.5	-170.3	-76.1	-172.3	173.6	-177.5	0	113.5	E618	K610-E618 IonicContact NZ-OE1 2.73Å; K610-E618 PolarHBondContact NZ-OE1 2.74Å; K610-E618 IonicContact NZ-OE2 2.73Å; K610-E618 PolarHBondContact NZ-OE2 3.2Å
611	T	53.8	Low	48.6	Very low	74 Å²	74	109.5 Å²	109.5	45%	0.454	62%	0.616	S	S	.	*			trans	-72.2	165.2	172	64.1	0	0	0	0	112.6	G609 E613 E614 C615	G609-T611 PolarHBondContact O-N 3.48Å; T611-E613 PolarHBondContact O-N 2.99Å; T611-E613 PolarHBondContact OG1-N 3.26Å; T611-E614 VanDerWaalsContact CB-OE2 3.3Å; T611-E614 WeakPolarHBondContact CB-OE2 3.39Å; T611-E614 WeakPolarHBondContact CG2-OE2 3.43Å; T611-E614 PolarHBondContact N-OE2 3.5Å; T611-E614 PolarHBondContact O-N 2.87Å; T611-E614 WeakPolarHBondContact OG1-CG 3.38Å; T611-E614 PolarHBondContact OG1-N 3.33Å; T611-E614 VanDerWaalsContact OG1-N 3.14Å; T611-E614 PolarHBondContact OG1-OE2 3.46Å; T611-C615 PolarHBondContact O-N 2.97Å
612	R	45.5	Very low	50.1	Low	187 Å²	187	103 Å²	103	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-58.4	-31.5	170.1	178.4	177.4	174.7	173.2	0.7	112.3	M616	R612-M616 VanDerWaalsContact O-CG 3.23Å; R612-M616 WeakPolarHBondContact O-CG 3.48Å; R612-M616 PolarHBondContact O-N 2.85Å
613	E	52.5	Low	51.2	Low	159 Å²	159	101.7 Å²	101.7	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-75.2	-41.2	-178.2	-172.1	161.3	-172.7	0	0	111.7	T611 C615 M616 K617	T611-E613 PolarHBondContact O-N 2.99Å; T611-E613 PolarHBondContact OG1-N 3.26Å; E613-C615 PolarHBondContact O-N 2.81Å; E613-M616 WeakPolarHBondContact O-CB 3.17Å; E613-M616 PolarHBondContact O-N 2.88Å; E613-M616 VanDerWaalsContact O-N 3.15Å; E613-K617 WeakPolarHBondContact O-CB 3.5Å; E613-K617 PolarHBondContact O-N 2.72Å
614	E	62.2	Low	52.5	Low	85 Å²	85	96 Å²	96	40%	0.397	54%	0.536	S	S	.	.	H	α-helix	trans	-62.5	-40.7	172.7	-72.1	160.8	104.7	0	0	112.2	T611 M616 K617 E618	T611-E614 VanDerWaalsContact CB-OE2 3.3Å; T611-E614 WeakPolarHBondContact CB-OE2 3.39Å; T611-E614 WeakPolarHBondContact CG2-OE2 3.43Å; T611-E614 PolarHBondContact N-OE2 3.5Å; T611-E614 PolarHBondContact O-N 2.87Å; T611-E614 WeakPolarHBondContact OG1-CG 3.38Å; T611-E614 PolarHBondContact OG1-N 3.33Å; T611-E614 VanDerWaalsContact OG1-N 3.14Å; T611-E614 PolarHBondContact OG1-OE2 3.46Å; E614-M616 VanDerWaalsContact C-N 3.27Å; E614-M616 PolarHBondContact O-N 3.1Å; E614-K617 PolarHBondContact O-N 3.1Å; E614-K617 VanDerWaalsContact O-N 3.15Å; E614-E618 VanDerWaalsContact O-CB 3.25Å; E614-E618 WeakPolarHBondContact O-CB 3.47Å; E614-E618 PolarHBondContact O-N 2.82Å
615	C	52.2	Low	54.2	Low	77 Å²	77	93.7 Å²	93.7	52%	0.52	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-36.4	174.1	-178.1	0	0	0	0	112.4	T611 E613 K619	T611-C615 PolarHBondContact O-N 2.97Å; E613-C615 PolarHBondContact O-N 2.81Å; C615-K619 WeakPolarHBondContact O-CB 3.39Å; C615-K619 PolarHBondContact O-N 3Å; C615-K619 VanDerWaalsContact O-N 3.17Å
616	M	52.5	Low	55.1	Low	70 Å²	70	94.3 Å²	94.3	35%	0.345	49%	0.492	S	S	.	.	H	α-helix	trans	-71.2	-37.7	174.4	-67.5	-78.4	-65.3	0	0	111.9	I69 I107 R612 E613 E614 T620	I69-M616 HydrophobicContact CG2-CE 4.24Å; I107-M616 HydrophobicContact CG2-CE 3.69Å; R612-M616 VanDerWaalsContact O-CG 3.23Å; R612-M616 WeakPolarHBondContact O-CG 3.48Å; R612-M616 PolarHBondContact O-N 2.85Å; E613-M616 WeakPolarHBondContact O-CB 3.17Å; E613-M616 PolarHBondContact O-N 2.88Å; E613-M616 VanDerWaalsContact O-N 3.15Å; E614-M616 VanDerWaalsContact C-N 3.27Å; E614-M616 PolarHBondContact O-N 3.1Å; M616-T620 WeakPolarHBondContact O-CB 3.27Å; M616-T620 PolarHBondContact O-N 3.43Å; M616-T620 PolarHBondContact O-OG1 2.69Å
617	K	68.5	Low	55.7	Low	146 Å²	146	90.9 Å²	90.9	64%	0.635	47%	0.469	S	S	*	.	H	α-helix	trans	-68.2	-48.4	177.5	-171.3	-175.7	177.2	-172.2	0	111.9	E613 E614 K619 T620 E621	E613-K617 WeakPolarHBondContact O-CB 3.5Å; E613-K617 PolarHBondContact O-N 2.72Å; E614-K617 PolarHBondContact O-N 3.1Å; E614-K617 VanDerWaalsContact O-N 3.15Å; K617-K619 VanDerWaalsContact C-N 3.33Å; K617-K619 PolarHBondContact O-N 2.82Å; K617-T620 CarbonylContact O-C 3.57Å; K617-T620 WeakPolarHBondContact O-CA 3.33Å; K617-T620 WeakPolarHBondContact O-CB 3.33Å; K617-T620 PolarHBondContact O-N 3.43Å; K617-E621 PolarHBondContact O-N 3.44Å
618	E	68.9	Low	56.6	Low	99 Å²	99	91.8 Å²	91.8	46%	0.463	46%	0.46	S	S	.	.	H	α-helix	trans	-56.7	-45	175.5	179.9	169.3	-149.9	0	0	111.3	K610 E614 T620 E621 E622	K610-E618 IonicContact NZ-OE1 2.73Å; K610-E618 PolarHBondContact NZ-OE1 2.74Å; K610-E618 IonicContact NZ-OE2 2.73Å; K610-E618 PolarHBondContact NZ-OE2 3.2Å; E614-E618 VanDerWaalsContact O-CB 3.25Å; E614-E618 WeakPolarHBondContact O-CB 3.47Å; E614-E618 PolarHBondContact O-N 2.82Å; E618-T620 VanDerWaalsContact C-N 3.34Å; E618-T620 PolarHBondContact O-N 3.04Å; E618-E621 PolarHBondContact O-N 3.25Å; E618-E622 PolarHBondContact O-N 3.26Å
619	K	58.5	Low	57.6	Low	44 Å²	44	92.9 Å²	92.9	19%	0.191	45%	0.453	C	S	.	.	H	α-helix	trans	-63.4	-37.3	172.7	-171	-176.7	179.3	-168.1	0	112.6	Y106 I107 N109 C615 K617 L623	Y106-K619 WeakPolarHBondContact O-CE 3.36Å; Y106-K619 PolarHBondContact O-NZ 2.99Å; I107-K619 PolarHBondContact O-NZ 2.91Å; N109-K619 PolarHBondContact O-NZ 3.12Å; C615-K619 WeakPolarHBondContact O-CB 3.39Å; C615-K619 PolarHBondContact O-N 3Å; C615-K619 VanDerWaalsContact O-N 3.17Å; K617-K619 VanDerWaalsContact C-N 3.33Å; K617-K619 PolarHBondContact O-N 2.82Å; K619-L623 HydrophobicContact CG-CD1 4.27Å; K619-L623 WeakPolarHBondContact O-CB 3.33Å; K619-L623 VanDerWaalsContact O-CD1 3.28Å; K619-L623 WeakPolarHBondContact O-CD1 3.45Å; K619-L623 WeakPolarHBondContact O-CG 3.45Å; K619-L623 PolarHBondContact O-N 2.88Å; K619-L623 VanDerWaalsContact O-N 3.15Å
620	T	59.7	Low	57.6	Low	68 Å²	68	93.4 Å²	93.4	42%	0.417	44%	0.439	S	S	.	.	H	α-helix	trans	-66.8	-39.6	176.8	-57.2	0	0	0	0	111.1	M616 K617 E618 L623 E624	M616-T620 WeakPolarHBondContact O-CB 3.27Å; M616-T620 PolarHBondContact O-N 3.43Å; M616-T620 PolarHBondContact O-OG1 2.69Å; K617-T620 CarbonylContact O-C 3.57Å; K617-T620 WeakPolarHBondContact O-CA 3.33Å; K617-T620 WeakPolarHBondContact O-CB 3.33Å; K617-T620 PolarHBondContact O-N 3.43Å; E618-T620 VanDerWaalsContact C-N 3.34Å; E618-T620 PolarHBondContact O-N 3.04Å; T620-L623 PolarHBondContact O-N 3Å; T620-E624 WeakPolarHBondContact O-CB 3.23Å; T620-E624 PolarHBondContact O-N 3.36Å
621	E	70.5	Confident	57.2	Low	95 Å²	95	89.8 Å²	89.8	44%	0.444	43%	0.434	S	S	.	.	H	α-helix	trans	-71.8	-38.4	177.6	-170.4	169.5	177.3	0	0	112.6	K617 E618 L623 E624 N625	K617-E621 PolarHBondContact O-N 3.44Å; E618-E621 PolarHBondContact O-N 3.25Å; E621-L623 VanDerWaalsContact C-N 3.29Å; E621-L623 PolarHBondContact O-N 3.36Å; E621-E624 PolarHBondContact O-N 3.42Å; E621-N625 WeakPolarHBondContact O-CB 3.29Å; E621-N625 VanDerWaalsContact O-CG 3.23Å; E621-N625 PolarHBondContact O-N 2.87Å; E621-N625 PolarHBondContact O-ND2 3.17Å
622	E	65.1	Low	56.1	Low	75 Å²	75	89.5 Å²	89.5	35%	0.35	45%	0.447	S	S	.	.	H	α-helix	trans	-56.2	-44.1	169.8	-171.4	-162.7	170.6	0	0	111.1	E618 N625 R626	E618-E622 PolarHBondContact O-N 3.26Å; E622-N625 PolarHBondContact O-N 3Å; E622-R626 PolarHBondContact O-N 3.01Å; E622-R626 IonicContact OE1-CZ 2.78Å; E622-R626 IonicContact OE1-NH1 3.23Å; E622-R626 PolarHBondContact OE1-NH1 3.23Å; E622-R626 IonicContact OE1-NH2 2.72Å; E622-R626 PolarHBondContact OE1-NH2 3.15Å
623	L	53.7	Low	55.7	Low	30 Å²	30	85 Å²	85	16%	0.157	44%	0.436	C	S	.	.	H	α-helix	trans	-68.9	-42.8	177.8	-69.9	163.8	0	0	0	112.2	Y106 K619 T620 E621 N625 R626 L627	Y106-L623 VanDerWaalsContact CB-CD1 3.41Å; Y106-L623 HydrophobicContact CD1-CD2 4.47Å; Y106-L623 HydrophobicContact CD2-CD2 4.32Å; Y106-L623 HydrophobicContact CG-CD1 4.41Å; Y106-L623 HydrophobicContact CG-CD2 3.94Å; K619-L623 HydrophobicContact CG-CD1 4.27Å; K619-L623 WeakPolarHBondContact O-CB 3.33Å; K619-L623 VanDerWaalsContact O-CD1 3.28Å; K619-L623 WeakPolarHBondContact O-CD1 3.45Å; K619-L623 WeakPolarHBondContact O-CG 3.45Å; K619-L623 PolarHBondContact O-N 2.88Å; K619-L623 VanDerWaalsContact O-N 3.15Å; T620-L623 PolarHBondContact O-N 3Å; E621-L623 VanDerWaalsContact C-N 3.29Å; E621-L623 PolarHBondContact O-N 3.36Å; L623-N625 VanDerWaalsContact C-N 3.28Å; L623-N625 PolarHBondContact O-N 3.15Å; L623-R626 PolarHBondContact O-N 2.78Å; L623-L627 WeakPolarHBondContact O-CB 3.39Å; L623-L627 VanDerWaalsContact O-CG 3.23Å; L623-L627 WeakPolarHBondContact O-CG 3.43Å; L623-L627 PolarHBondContact O-N 3.29Å
624	E	61.2	Low	54.8	Low	68 Å²	68	83 Å²	83	32%	0.318	44%	0.436	S	S	.	.	H	α-helix	trans	-63.1	-36.2	176.5	-159.8	-172.8	127	0	0	111.7	T620 E621 L627 R628	T620-E624 WeakPolarHBondContact O-CB 3.23Å; T620-E624 PolarHBondContact O-N 3.36Å; E621-E624 PolarHBondContact O-N 3.42Å; E624-L627 PolarHBondContact O-N 3.37Å; E624-R628 VanDerWaalsContact CD-NH2 3.32Å; E624-R628 PolarHBondContact O-N 2.9Å; E624-R628 IonicContact OE1-CZ 3.26Å; E624-R628 IonicContact OE1-NH1 2.69Å; E624-R628 PolarHBondContact OE1-NH1 3.31Å; E624-R628 IonicContact OE1-NH2 2.74Å; E624-R628 PolarHBondContact OE1-NH2 3.45Å
625	N	66.2	Low	53.3	Low	66 Å²	66	88.9 Å²	88.9	35%	0.353	46%	0.464	S	S	.	.	H	α-helix	trans	-72.2	-41.9	176	-69.1	-24.3	0	0	0	112.2	E621 E622 L623 L627 R628 E629	E621-N625 WeakPolarHBondContact O-CB 3.29Å; E621-N625 VanDerWaalsContact O-CG 3.23Å; E621-N625 PolarHBondContact O-N 2.87Å; E621-N625 PolarHBondContact O-ND2 3.17Å; E622-N625 PolarHBondContact O-N 3Å; L623-N625 VanDerWaalsContact C-N 3.28Å; L623-N625 PolarHBondContact O-N 3.15Å; N625-L627 VanDerWaalsContact C-N 3.26Å; N625-L627 PolarHBondContact O-N 3.43Å; N625-R628 WeakPolarHBondContact O-CA 3.25Å; N625-R628 WeakPolarHBondContact O-CB 3.5Å; N625-R628 PolarHBondContact O-N 3.4Å; N625-R628 VanDerWaalsContact O-N 3.08Å; N625-R628 VanDerWaalsContact OD1-CZ 3.31Å; N625-R628 PolarHBondContact OD1-NE 3.17Å; N625-R628 PolarHBondContact OD1-NH2 3.28Å; N625-E629 PolarHBondContact O-N 3.47Å
626	R	55.3	Low	52.2	Low	93 Å²	93	88.5 Å²	88.5	35%	0.351	47%	0.473	S	S	.	.	H	α-helix	trans	-60.5	-35.7	169.1	-76.9	-163.1	-177.7	103.5	13.1	112.8	E622 L623 R628 E629 I630	E622-R626 PolarHBondContact O-N 3.01Å; E622-R626 IonicContact OE1-CZ 2.78Å; E622-R626 IonicContact OE1-NH1 3.23Å; E622-R626 PolarHBondContact OE1-NH1 3.23Å; E622-R626 IonicContact OE1-NH2 2.72Å; E622-R626 PolarHBondContact OE1-NH2 3.15Å; L623-R626 PolarHBondContact O-N 2.78Å; R626-R628 VanDerWaalsContact C-N 3.32Å; R626-E629 PolarHBondContact O-N 2.72Å; R626-I630 WeakPolarHBondContact O-CG1 3.3Å; R626-I630 PolarHBondContact O-N 2.9Å
627	L	52.2	Low	51.3	Low	55 Å²	55	88.2 Å²	88.2	29%	0.288	48%	0.482	S	S	.	.	H	α-helix	trans	-69.4	-28.5	175	-73.2	168.8	0	0	0	112.5	E123 L623 E624 N625 G631	E123-L627 WeakPolarHBondContact OE1-CD2 3.28Å; L623-L627 WeakPolarHBondContact O-CB 3.39Å; L623-L627 VanDerWaalsContact O-CG 3.23Å; L623-L627 WeakPolarHBondContact O-CG 3.43Å; L623-L627 PolarHBondContact O-N 3.29Å; E624-L627 PolarHBondContact O-N 3.37Å; N625-L627 VanDerWaalsContact C-N 3.26Å; N625-L627 PolarHBondContact O-N 3.43Å; L627-G631 WeakPolarHBondContact O-CA 3.36Å; L627-G631 PolarHBondContact O-N 3.46Å; L627-G631 VanDerWaalsContact O-N 3.12Å
628	R	61.5	Low	49.6	Very low	117 Å²	117	87.6 Å²	87.6	44%	0.442	49%	0.493	S	S	.	.	H	α-helix	trans	-69.2	-46.2	167.8	-78.2	-175.9	-99.2	-88.6	-0.7	111.9	E624 N625 R626 I630 G631	E624-R628 VanDerWaalsContact CD-NH2 3.32Å; E624-R628 PolarHBondContact O-N 2.9Å; E624-R628 IonicContact OE1-CZ 3.26Å; E624-R628 IonicContact OE1-NH1 2.69Å; E624-R628 PolarHBondContact OE1-NH1 3.31Å; E624-R628 IonicContact OE1-NH2 2.74Å; E624-R628 PolarHBondContact OE1-NH2 3.45Å; N625-R628 WeakPolarHBondContact O-CA 3.25Å; N625-R628 WeakPolarHBondContact O-CB 3.5Å; N625-R628 PolarHBondContact O-N 3.4Å; N625-R628 VanDerWaalsContact O-N 3.08Å; N625-R628 VanDerWaalsContact OD1-CZ 3.31Å; N625-R628 PolarHBondContact OD1-NE 3.17Å; N625-R628 PolarHBondContact OD1-NH2 3.28Å; R626-R628 VanDerWaalsContact C-N 3.32Å; R628-I630 PolarHBondContact O-N 3.25Å; R628-G631 PolarHBondContact O-N 3.19Å; R628-G631 VanDerWaalsContact O-N 3.13Å
629	E	56	Low	48.1	Very low	159 Å²	159	86.4 Å²	86.4	74%	0.743	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-39.5	-179.9	-70.5	176.3	156.7	0	0	113	N625 R626	N625-E629 PolarHBondContact O-N 3.47Å; R626-E629 PolarHBondContact O-N 2.72Å
630	I	49.8	Very low	47.2	Very low	79 Å²	79	91.3 Å²	91.3	41%	0.405	53%	0.526	S	S	.	.	H	α-helix	trans	-80.8	-19.6	177.1	-61.8	169.3	0	0	0	111.5	M120 R626 R628 G632	M120-I630 HydrophobicContact CE-CD1 3.84Å; R626-I630 WeakPolarHBondContact O-CG1 3.3Å; R626-I630 PolarHBondContact O-N 2.9Å; R628-I630 PolarHBondContact O-N 3.25Å; I630-G632 VanDerWaalsContact C-N 3.29Å; I630-G632 PolarHBondContact O-N 3.39Å; I630-G632 VanDerWaalsContact O-N 3.1Å
631	G	36.4	Very low	46.2	Very low	39 Å²	39	96.5 Å²	96.5	40%	0.402	55%	0.545	S	S	.	.			trans	-81.4	28.5	-170.7	0	0	0	0	0	116.9	L627 R628 L633	L627-G631 WeakPolarHBondContact O-CA 3.36Å; L627-G631 PolarHBondContact O-N 3.46Å; L627-G631 VanDerWaalsContact O-N 3.12Å; R628-G631 PolarHBondContact O-N 3.19Å; R628-G631 VanDerWaalsContact O-N 3.13Å; G631-L633 PolarHBondContact O-N 2.8Å
632	G	30.8	Very low	44.6	Very low	69 Å²	69	99.9 Å²	99.9	71%	0.711	57%	0.566	S	S	*	*			trans	-71.2	77.7	-174.2	0	0	0	0	0	115.3	I630	I630-G632 VanDerWaalsContact C-N 3.29Å; I630-G632 PolarHBondContact O-N 3.39Å; I630-G632 VanDerWaalsContact O-N 3.1Å
633	L	36	Very low	43.2	Very low	93 Å²	93	97.8 Å²	97.8	49%	0.487	56%	0.561	S	S	.	*			trans	-141.7	154.9	171	-85.8	109.8	0	0	0	112.5	K131 G631 Q635	K131-L633 HydrophobicContact CD-CD1 4.48Å; K131-L633 HydrophobicContact CD-CD2 3.54Å; K131-L633 HydrophobicContact CG-CD2 3.89Å; G631-L633 PolarHBondContact O-N 2.8Å; L633-Q635 PolarHBondContact O-N 2.73Å
634	P	33.6	Very low	42.5	Very low	115 Å²	115	103.3 Å²	103.3	75%	0.747	59%	0.586	S	S	*	*			trans	-69.4	130.6	-159	25.2	-34.6	0	0	0	113.8	G636	P634-G636 VanDerWaalsContact C-N 3.35Å; P634-G636 PolarHBondContact O-N 3.14Å
635	Q	31.2	Very low	41.3	Very low	209 Å²	209	104.6 Å²	104.6	98%	0.977	60%	0.595	S	S	*	*	S	Bend	trans	-65.2	92.7	162.5	-66	171.6	-14.5	0	0	108.5	L633	L633-Q635 PolarHBondContact O-N 2.73Å
636	G	29.1	Very low	39.8	Very low	69 Å²	69	107.3 Å²	107.3	71%	0.711	62%	0.616	S	S	*	*			trans	-171.5	1	-175.6	0	0	0	0	0	116.7	P634	P634-G636 VanDerWaalsContact C-N 3.35Å; P634-G636 PolarHBondContact O-N 3.14Å
637	A	34.1	Very low	39.2	Very low	64 Å²	64	112.4 Å²	112.4	53%	0.529	64%	0.641	S	S	.	*			trans	-98.6	118.1	173.3	0	0	0	0	0	110.1	G639	A637-G639 PolarHBondContact O-N 2.73Å
638	P	32.2	Very low	38.6	Very low	134 Å²	134	119.9 Å²	119.9	87%	0.87	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	121.9	178.8	27.5	-33.3	0	0	0	110.2
639	G	37	Very low	37.4	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	139.8	-8.6	178.3	0	0	0	0	0	116.3	A637	A637-G639 PolarHBondContact O-N 2.73Å
640	Y	39.3	Very low	36.4	Very low	147 Å²	147	121.3 Å²	121.3	58%	0.576	70%	0.695	S	S	*	*			trans	-113.7	100.2	-178.2	-72.4	-77.6	0	0	0	113.1
641	H	38.7	Very low	35.8	Very low	177 Å²	177	121.1 Å²	121.1	82%	0.819	71%	0.713	S	S	*	*			trans	-126.6	99	166	-85.6	-90.3	0	0	0	111.3	A643	H641-A643 PolarHBondContact O-N 2.76Å
642	N	38.4	Very low	36	Very low	166 Å²	166	125.3 Å²	125.3	89%	0.888	73%	0.731	S	S	*	*			trans	-83.1	92.3	162.7	-91.3	-22.4	0	0	0	109	H644	N642-H644 VanDerWaalsContact C-N 3.33Å; N642-H644 PolarHBondContact O-N 2.65Å
643	A	34.8	Very low	36.4	Very low	30 Å²	30	130.2 Å²	130.2	25%	0.248	74%	0.741	C	S	.	*			trans	-80.2	69.5	-176	0	0	0	0	0	113.2	H641	H641-A643 PolarHBondContact O-N 2.76Å
644	H	38.2	Very low	36.6	Very low	146 Å²	146	137.2 Å²	137.2	68%	0.676	76%	0.761	S	S	*	*			trans	-143.4	75.6	177.5	-98.5	57.6	0	0	0	113	N642	N642-H644 VanDerWaalsContact C-N 3.33Å; N642-H644 PolarHBondContact O-N 2.65Å
645	N	37.3	Very low	37	Very low	96 Å²	96	139.7 Å²	139.7	51%	0.513	77%	0.767	S	S	.	*			trans	-162.5	118.3	145.2	-152.5	-28.1	0	0	0	111.5
646	P	34.9	Very low	37.4	Very low	123 Å²	123	135 Å²	135	80%	0.799	76%	0.757	S	S	*	*			trans	-88.9	122.8	179.1	33.1	-31.7	0	0	0	112.5
647	K	42.3	Very low	38.2	Very low	200 Å²	200	136.1 Å²	136.1	87%	0.87	76%	0.76	S	S	*	*			trans	-131.2	134.5	161.8	-75.2	-165.4	174.6	-175.5	0	112
648	K	38.5	Very low	38.5	Very low	212 Å²	212	138 Å²	138	92%	0.922	77%	0.769	S	S	*	*			trans	-81.6	131.9	176.5	-55.9	174.5	-179.6	178.3	0	110.4
649	S	36.4	Very low	38.9	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	76%	0.763	S	S	*	*				-172.6	155.4	129.5	54	0	0	0	0	110.4
650	H	36.1	Very low	39.1	Very low	188 Å²	188	138.5 Å²	138.5	87%	0.87	76%	0.764	S	S	*	*			trans	-78.9	148.7	177.8	-71.6	-101.1	0	0	0	111.6
651	G	35.5	Very low	39.3	Very low	75 Å²	75	137 Å²	137	77%	0.773	78%	0.775	S	S	*	*			trans	-156.1	76.3	175.2	0	0	0	0	0	111.6	N653	G651-N653 PolarHBondContact O-N 3.34Å
652	T	41.6	Very low	39.4	Very low	128 Å²	128	133.4 Å²	133.4	79%	0.785	77%	0.77	S	S	*	*			trans	-80.7	107	-175.2	48.4	0	0	0	0	112.6	R654	T652-R654 PolarHBondContact O-N 3.25Å
653	N	38.9	Very low	39.7	Very low	171 Å²	171	131.1 Å²	131.1	91%	0.914	77%	0.767	S	S	*	*			trans	-93.5	86.2	168.8	-88.1	-25.5	0	0	0	111.6	G651	G651-N653 PolarHBondContact O-N 3.34Å
654	R	40.7	Very low	40	Very low	240 Å²	240	136.8 Å²	136.8	91%	0.906	79%	0.793	S	S	*	*			trans	-126.2	128.4	157.3	-92.6	-170.3	172.4	-168.8	-0.8	109.9	T652 S656	T652-R654 PolarHBondContact O-N 3.25Å; R654-S656 PolarHBondContact O-N 3.39Å
655	L	42.1	Very low	40.5	Very low	167 Å²	167	135.9 Å²	135.9	87%	0.874	80%	0.803	S	S	*	*			trans	-24.7	110.4	179.9	-56.3	171.9	0	0	0	117
656	S	39.6	Very low	40.8	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	82%	0.822	S	S	*	*			trans	37	112	135.1	60.3	0	0	0	0	120.9	R654	R654-S656 PolarHBondContact O-N 3.39Å
657	A	44.7	Very low	41.5	Very low	92 Å²	92	140.4 Å²	140.4	76%	0.76	82%	0.824	S	S	*	*				-169.4	140.1	119.2	0	0	0	0	0	113.6
658	S	40.8	Very low	41.7	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	82%	0.815	S	S	*	*			trans	49.1	108.8	152	52.7	0	0	0	0	122.9
659	S	41	Very low	42.1	Very low	106 Å²	106	131 Å²	131	74%	0.741	81%	0.806	S	S	*	*				76.2	118.2	119.2	-49.5	0	0	0	0	123.1
660	S	41.4	Very low	42.4	Very low	113 Å²	113	132 Å²	132	79%	0.79	80%	0.801	S	S	*	*			trans	52.2	140.3	137.9	55.3	0	0	0	0	121.3
661	S	43.3	Very low	42.9	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	79%	0.792	S	S	*	*			cis	-160.3	173.2	3.2	43.6	0	0	0	0	111.8
662	S	40.3	Very low	43.5	Very low	102 Å²	102	129.5 Å²	129.5	71%	0.713	79%	0.794	S	S	*	*			trans	-63.4	153.2	-178	52.7	0	0	0	0	116.5
663	S	44.6	Very low	43.8	Very low	118 Å²	118	132 Å²	132	83%	0.825	80%	0.797	S	S	*	*				-169.8	149.3	114.4	-97.7	0	0	0	0	112.4
664	D	42.1	Very low	44.5	Very low	148 Å²	148	129.3 Å²	129.3	79%	0.791	79%	0.791	S	S	*	*			trans	-89.5	164	-176.7	-46.9	-92.4	0	0	0	113.4
665	S	48.9	Very low	44.9	Very low	127 Å²	127	125.5 Å²	125.5	89%	0.888	79%	0.789	S	S	*	*			trans	-164.7	130.2	154.2	-78.2	0	0	0	0	111
666	E	43.5	Very low	45.4	Very low	194 Å²	194	121.4 Å²	121.4	91%	0.907	77%	0.774	S	S	*	*			trans	-108.9	159.7	172.1	-58.3	-164.2	151.8	0	0	111
667	S	49.3	Very low	46	Very low	120 Å²	120	121.5 Å²	121.5	84%	0.839	78%	0.775	S	S	*	*			trans	-157.9	163.5	164.7	-163.5	0	0	0	0	111.6
668	T	46.9	Very low	46.4	Very low	112 Å²	112	123.8 Å²	123.8	69%	0.687	77%	0.774	S	S	*	*			trans	-143.1	154.4	-150.9	54.5	0	0	0	0	114.9
669	S	45.5	Very low	47	Very low	104 Å²	104	122.1 Å²	122.1	73%	0.727	76%	0.762	S	S	*	*			trans	66.9	169.2	160.4	-48.5	0	0	0	0	116.1
670	D	43.9	Very low	47.5	Very low	136 Å²	136	126 Å²	126	73%	0.727	77%	0.766	S	S	*	*			cis	-140.2	147.4	0.1	-106.7	-42.7	0	0	0	107.4
671	S	45.5	Very low	48	Very low	95 Å²	95	125.6 Å²	125.6	66%	0.664	76%	0.763	S	S	*	*				83.8	153	66.8	-55.3	0	0	0	0	116.1
672	S	48.6	Very low	48.8	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	77%	0.767	S	S	*	*			trans	84.3	157.7	176.4	-29.9	0	0	0	0	117.8
673	E	48.2	Very low	49.6	Very low	181 Å²	181	131 Å²	131	85%	0.846	77%	0.767	S	S	*	*				-176.9	178.4	-57.5	-108	-174	171.6	0	0	110.1
674	S	53.5	Low	50	Low	113 Å²	113	134.1 Å²	134.1	79%	0.79	77%	0.769	S	S	*	*			trans	82.8	125.7	172.6	-43	0	0	0	0	116.8
675	D	50.1	Low	50.5	Low	161 Å²	161	136.5 Å²	136.5	86%	0.861	80%	0.797	S	S	*	*				82.3	142.8	62.3	-112.4	-10	0	0	0	114
676	S	51	Low	50.6	Low	81 Å²	81	137 Å²	137	57%	0.566	79%	0.793	S	S	*	*			cis	-160	175	-4	75.9	0	0	0	0	111.1
677	S	53.5	Low	51	Low	113 Å²	113	134 Å²	134	79%	0.79	79%	0.787	S	S	*	*			trans	67	161.8	151.7	-56	0	0	0	0	119.9
678	D	53.2	Low	51.1	Low	140 Å²	140	134.8 Å²	134.8	75%	0.749	78%	0.784	S	S	*	*			cis	-165.5	167.2	-32.6	178.8	37.9	0	0	0	109.2
679	S	51.9	Low	51.3	Low	67 Å²	67	136.1 Å²	136.1	47%	0.469	79%	0.789	S	S	.	*			trans	65.9	98.5	145.4	-96.6	0	0	0	0	121
680	K	52.8	Low	51.7	Low	188 Å²	188	138.1 Å²	138.1	82%	0.817	79%	0.793	S	S	*	*				145.9	140.5	98.5	-71.5	-119.2	165.7	48.1	0	114.3
681	S	51.9	Low	52.2	Low	105 Å²	105	138.3 Å²	138.3	73%	0.734	80%	0.798	S	S	*	*			trans	-89.8	145.3	169.1	54.5	0	0	0	0	112
682	Y	59.4	Low	52.7	Low	227 Å²	227	141.4 Å²	141.4	89%	0.89	81%	0.807	S	S	*	*			trans	-141	147.5	145.9	-110.5	-84.5	0	0	0	109.2
683	S	57	Low	53	Low	103 Å²	103	143.2 Å²	143.2	72%	0.72	81%	0.806	S	S	*	*			trans	-153.3	118.3	-173.7	56.2	0	0	0	0	110.5
684	E	52.8	Low	53.4	Low	185 Å²	185	140.1 Å²	140.1	86%	0.864	80%	0.803	S	S	*	*			trans	-164	153.1	164.1	-116.1	174.5	124	0	0	109.9
685	S	54.3	Low	53.4	Low	198 Å²	198	142.5 Å²	142.5	100%	1.385	80%	0.804	S	S	*	*			trans	71.6	0	-169.7	-50.5	0	0	0	0	115.5

Retrieved 685 of 685 residues in 174.1 ms (Link to these results)

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