A0A093GTG2_STRCA Loading...

Protein C9orf72

AlphaFold DB , UniProt , Accession A0A093GTG2, Species STRCA (Struthio camelus australis), Gene n/a, Length 481 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	33.3	Very low	39.6	Very low	245 Å²	245	124.1 Å²	124.1	100%	1.207	80%	0.796	S	S	*	*				0	104.1	0	-65.5	-172.7	-158.9	0	0	107.1	A3	M1-A3 PolarHBondContact O-N 2.73Å
2	S	32.6	Very low	43	Very low	110 Å²	110	117.1 Å²	117.1	77%	0.769	75%	0.75	S	S	*	*			trans	-68.8	122.3	179.4	53.4	0	0	0	0	109.5	L4	S2-L4 PolarHBondContact O-N 2.86Å; S2-L4 VanDerWaalsContact O-N 3.12Å
3	A	35.3	Very low	46.4	Very low	97 Å²	97	112.2 Å²	112.2	80%	0.802	73%	0.727	S	S	*	*			trans	-60.6	114.3	166.9	0	0	0	0	0	107.8	M1 C5	M1-A3 PolarHBondContact O-N 2.73Å; A3-C5 PolarHBondContact O-N 3.4Å; A3-C5 VanDerWaalsContact O-N 3.1Å
4	L	34.2	Very low	49.5	Very low	166 Å²	166	109.4 Å²	109.4	87%	0.869	70%	0.698	S	S	*	*			trans	-60.9	108.2	174.4	-79.1	142.6	0	0	0	108.1	S2	S2-L4 PolarHBondContact O-N 2.86Å; S2-L4 VanDerWaalsContact O-N 3.12Å
5	C	33.3	Very low	52.3	Low	112 Å²	112	105.5 Å²	105.5	76%	0.757	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-53.6	137.4	160.7	-74.4	0	0	0	0	108.3	A3	A3-C5 PolarHBondContact O-N 3.4Å; A3-C5 VanDerWaalsContact O-N 3.1Å
6	P	33.5	Very low	54.7	Low	111 Å²	111	106.3 Å²	106.3	72%	0.721	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-56	148.4	169.3	-11.2	22.5	0	0	0	109.2
7	P	31.8	Very low	56.8	Low	109 Å²	109	100.7 Å²	100.7	71%	0.708	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-54.8	142.2	175	23.7	-32.1	0	0	0	109.6	S9	P7-S9 PolarHBondContact O-N 2.99Å
8	P	38.7	Very low	58.5	Low	128 Å²	128	100.4 Å²	100.4	83%	0.831	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-57.8	119.3	176.8	24	-31.1	0	0	0	107.7
9	S	44.8	Very low	59.9	Low	86 Å²	86	96.6 Å²	96.6	60%	0.601	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-54.5	144.4	167.6	-65.2	0	0	0	0	108	P7 A11	P7-S9 PolarHBondContact O-N 2.99Å; S9-A11 PolarHBondContact O-N 3.39Å
10	P	55.1	Low	60.7	Low	94 Å²	94	98.1 Å²	98.1	61%	0.61	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-50.7	131.6	177.2	20.3	-31	0	0	0	109	V12	P10-V12 PolarHBondContact O-N 3.21Å
11	A	63.5	Low	61.4	Low	107 Å²	107	96.2 Å²	96.2	88%	0.884	61%	0.609	S	S	*	*			trans	-55	115.8	-176.8	0	0	0	0	0	109.1	S9	S9-A11 PolarHBondContact O-N 3.39Å
12	V	80.3	Confident	63.8	Low	40 Å²	40	91.9 Å²	91.9	24%	0.242	59%	0.585	C	S	.	*			trans	-74.3	137.9	178.8	178	0	0	0	0	108.2	P10 K14 V41 I44 T60	P10-V12 PolarHBondContact O-N 3.21Å; V12-K14 PolarHBondContact O-N 3.28Å; V12-V41 HydrophobicContact CG1-CB 4.18Å; V12-V41 HydrophobicContact CG1-CG1 3.83Å; V12-I44 HydrophobicContact CB-CD1 4.24Å; V12-I44 HydrophobicContact CG1-CD1 3.96Å; V12-I44 HydrophobicContact CG1-CG1 3.98Å; V12-T60 HydrophobicContact CB-CG2 4.49Å; V12-T60 HydrophobicContact CG2-CG2 3.75Å
13	A	87.1	Confident	66.4	Low	54 Å²	54	87.5 Å²	87.5	45%	0.446	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-59.3	133.2	176.4	0	0	0	0	0	110.2	H43 I44	A13-H43 WeakPolarHBondContact CB-ND1 3.49Å; A13-H43 WeakPolarHBondContact O-CA 3.37Å; A13-H43 PolarHBondContact O-ND1 2.85Å; A13-I44 PolarHBondContact O-N 3.33Å
14	K	89.8	Confident	69.1	Low	73 Å²	73	83 Å²	83	32%	0.317	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	137.8	-174	-177.4	176.5	-179.1	169.6	0	110.5	V12 I44 D56	V12-K14 PolarHBondContact O-N 3.28Å; K14-I44 CarbonylContact C-O 3.58Å; K14-I44 VanDerWaalsContact CA-O 3.29Å; K14-I44 WeakPolarHBondContact CA-O 3.1Å; K14-I44 HydrophobicContact CB-CB 4.5Å; K14-I44 HydrophobicContact CG-CB 4.35Å; K14-I44 HydrophobicContact CG-CG2 4.4Å; K14-D56 IonicContact NZ-OD1 2.77Å; K14-D56 PolarHBondContact NZ-OD1 3.22Å; K14-D56 IonicContact NZ-OD2 3.35Å; K14-D56 PolarHBondContact NZ-OD2 2.84Å
15	T	91	Very high	71.8	Confident	50 Å²	50	75.4 Å²	75.4	31%	0.307	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124	170.1	-54.2	0	0	0	0	108.9	I17 H43 I44 A46	T15-I17 HydrophobicContact CG2-CG1 4.49Å; T15-H43 PolarHBondContact OG1-CE1 3.1Å; T15-H43 VanDerWaalsContact OG1-CE1 3.24Å; T15-H43 PolarHBondContact OG1-NE2 3.43Å; T15-I44 PolarHBondContact N-O 3.49Å; T15-A46 PolarHBondContact O-N 2.74Å
16	E	91.6	Very high	74.6	Confident	119 Å²	119	71.7 Å²	71.7	56%	0.556	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	130	172.2	-66	-173.4	170.7	0	0	110.2	A46	E16-A46 CarbonylContact C-O 3.49Å; E16-A46 VanDerWaalsContact CA-O 3.31Å; E16-A46 WeakPolarHBondContact CA-O 3.4Å
17	I	89.9	Confident	77.5	Confident	11 Å²	11	66.4 Å²	66.4	6%	0.056	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.5	-174.9	-59.6	160.9	0	0	0	108.7	T15 L19 W45 A46 P47 K48 I181 M184	T15-I17 HydrophobicContact CG2-CG1 4.49Å; I17-L19 HydrophobicContact CG2-CD2 3.74Å; I17-L19 HydrophobicContact CG2-CG 4.08Å; I17-L19 PolarHBondContact O-N 3.04Å; I17-W45 HydrophobicContact CD1-CB 3.77Å; I17-W45 HydrophobicContact CD1-CG 4.31Å; I17-A46 PolarHBondContact N-O 3.44Å; I17-P47 CarbonylContact O-C 3.59Å; I17-P47 WeakPolarHBondContact O-CA 3.37Å; I17-K48 PolarHBondContact O-N 3.33Å; I17-I181 HydrophobicContact CD1-CG1 3.77Å; I17-I181 HydrophobicContact CG1-CG1 4.18Å; I17-I181 HydrophobicContact CG2-CG1 4.31Å; I17-M184 HydrophobicContact CD1-CE 4.1Å; I17-M184 HydrophobicContact CD1-SD 3.36Å; I17-M184 WeakPolarHBondContact CD1-SD 3.37Å
18	S	87.9	Confident	80.5	Confident	96 Å²	96	61.3 Å²	61.3	67%	0.671	38%	0.383	S	S	*	.			trans	-80.7	109	171.6	-61.1	0	0	0	0	109
19	L	83.9	Confident	83.2	Confident	27 Å²	27	55.2 Å²	55.2	14%	0.141	34%	0.343	C	S	.	.			trans	-99.9	148.2	175.9	-62.8	173.5	0	0	0	110.4	I17 G21 S23 P47 M184 E185	I17-L19 HydrophobicContact CG2-CD2 3.74Å; I17-L19 HydrophobicContact CG2-CG 4.08Å; I17-L19 PolarHBondContact O-N 3.04Å; L19-G21 PolarHBondContact O-N 3.37Å; L19-S23 VanDerWaalsContact CD1-OG 3.32Å; L19-S23 WeakPolarHBondContact CD1-OG 3.5Å; L19-P47 HydrophobicContact CD1-CB 4.11Å; L19-M184 HydrophobicContact CD1-CB 4.14Å; L19-M184 HydrophobicContact CD1-CE 4.3Å; L19-M184 HydrophobicContact CD2-CB 4.17Å; L19-E185 HydrophobicContact CD2-CG 3.79Å
20	N	76.1	Confident	85.6	Confident	127 Å²	127	51.1 Å²	51.1	68%	0.679	32%	0.315	S	S	*	.	S	Bend	trans	-75.5	114.3	169.3	-69.9	-31.5	0	0	0	109.1	S188	N20-S188 PolarHBondContact O-OG 3.2Å
21	G	76.3	Confident	87.3	Confident	59 Å²	59	46.7 Å²	46.7	61%	0.608	29%	0.286	S	S	*	.	S	Bend	trans	91.6	-174.7	-179.1	0	0	0	0	0	114.1	L19	L19-G21 PolarHBondContact O-N 3.37Å
22	E	82.8	Confident	88.5	Confident	153 Å²	153	42.2 Å²	42.2	72%	0.715	25%	0.246	S	C	*	.			trans	-74.7	128.9	178.9	-171.4	179.4	-176.1	0	0	110.9	S188	E22-S188 PolarHBondContact O-OG 3.13Å
23	S	87.7	Confident	88.8	Confident	18 Å²	18	41.8 Å²	41.8	13%	0.126	24%	0.24	C	C	.	.			trans	-83.8	126.1	177.1	-164.4	0	0	0	0	110.8	L19 L25	L19-S23 VanDerWaalsContact CD1-OG 3.32Å; L19-S23 WeakPolarHBondContact CD1-OG 3.5Å; S23-L25 PolarHBondContact O-N 3.29Å; S23-L25 PolarHBondContact OG-N 3.46Å
24	P	91.1	Very high	88.6	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.026	23%	0.227	C	C	.	.	S	Bend	trans	-76	-3.8	170.8	33.2	-36.4	0	0	0	112.6	P117 E120 F123 L187 K191	P24-P117 WeakPolarHBondContact O-CD 3.27Å; P24-E120 HydrophobicContact CB-CG 4.47Å; P24-F123 HydrophobicContact CB-CD1 4.19Å; P24-F123 HydrophobicContact CB-CE1 3.72Å; P24-F123 HydrophobicContact CB-CZ 4.47Å; P24-F123 HydrophobicContact CG-CE1 3.76Å; P24-F123 HydrophobicContact CG-CZ 4.21Å; P24-L187 HydrophobicContact CG-CB 3.88Å; P24-K191 HydrophobicContact CG-CB 4.29Å
25	L	92.3	Very high	88	Confident	5 Å²	5	43.4 Å²	43.4	3%	0.026	25%	0.245	C	C	.	.			trans	-97	147.4	-178.3	-61.8	-178.3	0	0	0	111.2	S23 P47 I114 L116 M184 L187	S23-L25 PolarHBondContact O-N 3.29Å; S23-L25 PolarHBondContact OG-N 3.46Å; L25-P47 VanDerWaalsContact O-CG 3.31Å; L25-P47 WeakPolarHBondContact O-CG 3.5Å; L25-I114 HydrophobicContact CD1-CG2 4.3Å; L25-I114 HydrophobicContact CD2-CG2 3.25Å; L25-I114 HydrophobicContact CG-CG2 4.37Å; L25-L116 HydrophobicContact CD2-CD1 4.18Å; L25-L116 HydrophobicContact CD2-CD2 3.66Å; L25-L116 HydrophobicContact CD2-CG 3.54Å; L25-M184 HydrophobicContact CD1-CB 3.92Å; L25-M184 HydrophobicContact CD1-CE 4.05Å; L25-M184 HydrophobicContact CD1-CG 3.56Å; L25-L187 HydrophobicContact CD1-CD1 4.02Å; L25-L187 HydrophobicContact CD2-CD1 3.59Å; L25-L187 HydrophobicContact CG-CD1 4.04Å
26	L	92.7	Very high	87.3	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.178	27%	0.268	C	S	.	.	S	Bend	trans	-92.6	-43.3	167.1	-64.7	176.9	0	0	0	111.1	P47 L53 L54 V92 I115 P117	L26-P47 VanDerWaalsContact O-CD 3.31Å; L26-P47 WeakPolarHBondContact O-CD 3.44Å; L26-L53 HydrophobicContact CD1-CD2 4.17Å; L26-L53 HydrophobicContact CD2-CB 3.84Å; L26-L54 HydrophobicContact CD1-CD1 3.93Å; L26-L54 HydrophobicContact CD1-CG 4.29Å; L26-V92 HydrophobicContact CD1-CG1 3.58Å; L26-I115 HydrophobicContact CB-CG2 4.24Å; L26-I115 HydrophobicContact CD1-CG2 4.32Å; L26-I115 PolarHBondContact N-O 3.28Å; L26-P117 HydrophobicContact CD1-CG 4.17Å; L26-P117 HydrophobicContact CD2-CG 3.98Å; L26-P117 HydrophobicContact CG-CG 3.91Å
27	A	93.6	Very high	86.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	163	177	0	0	0	0	0	111.2	I44 W45 I59 I115	A27-I44 HydrophobicContact CB-CG2 4.14Å; A27-W45 CarbonylContact C-O 3.54Å; A27-W45 VanDerWaalsContact CA-O 3.31Å; A27-W45 WeakPolarHBondContact CA-O 3.42Å; A27-I59 HydrophobicContact CB-CD1 3.89Å; A27-I59 HydrophobicContact CB-CG2 4.42Å; A27-I115 PolarHBondContact N-O 2.95Å; A27-I115 PolarHBondContact O-N 3.5Å
28	A	95.4	Very high	86.4	Confident	2 Å²	2	48.5 Å²	48.5	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.7	156.5	0	0	0	0	0	109.3	W45 S113 V180	A28-W45 HydrophobicContact CB-CB 4.35Å; A28-W45 HydrophobicContact CB-CE3 4.21Å; A28-W45 PolarHBondContact N-O 3.24Å; A28-W45 PolarHBondContact O-N 3.33Å; A28-S113 CarbonylContact C-O 3.43Å; A28-S113 WeakPolarHBondContact CA-O 3.48Å; A28-V180 HydrophobicContact CB-CG1 3.89Å
29	T	94.9	Very high	86.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.7	-175.1	64	0	0	0	0	111.2	H43 I44 I59 S113 I115	T29-H43 WeakPolarHBondContact CA-O 3.38Å; T29-I44 HydrophobicContact CG2-CG1 4.38Å; T29-I59 HydrophobicContact CG2-CG2 3.44Å; T29-I59 VanDerWaalsContact CG2-CG2 3.44Å; T29-S113 PolarHBondContact N-O 3.21Å; T29-S113 PolarHBondContact O-N 3.37Å; T29-S113 WeakPolarHBondContact OG1-CB 3.46Å; T29-I115 HydrophobicContact CG2-CD1 4.07Å
30	F	93.9	Very high	86.3	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.1	165	-177.9	-121.1	0	0	0	109.7	R42 H43 W45 F99 Y110 I172 I173 L176	F30-R42 HydrophobicContact CD1-CB 3.97Å; F30-R42 HydrophobicContact CD1-CG 4.42Å; F30-R42 PolarHBondContact O-N 3.11Å; F30-H43 PolarHBondContact N-O 2.65Å; F30-H43 PolarHBondContact O-N 3.42Å; F30-W45 HydrophobicContact CB-CH2 3.78Å; F30-W45 HydrophobicContact CB-CZ3 3.71Å; F30-F99 HydrophobicContact CE2-CE1 4.36Å; F30-F99 AromaticContact CE2-CZ 3.94Å; F30-F99 HydrophobicContact CE2-CZ 3.94Å; F30-Y110 HydrophobicContact CE1-CD1 4.15Å; F30-Y110 AromaticContact CE2-CD1 3.86Å; F30-Y110 HydrophobicContact CE2-CD1 3.86Å; F30-Y110 HydrophobicContact CE2-CG 4.23Å; F30-Y110 AromaticContact CZ-CD1 3.37Å; F30-Y110 HydrophobicContact CZ-CD1 3.37Å; F30-Y110 AromaticContact CZ-CE1 3.99Å; F30-Y110 HydrophobicContact CZ-CE1 3.99Å; F30-Y110 HydrophobicContact CZ-CG 4.08Å; F30-I172 HydrophobicContact CE1-CG2 3.98Å; F30-I172 HydrophobicContact CZ-CG2 4.48Å; F30-I173 HydrophobicContact CD1-CD1 3.83Å; F30-I173 HydrophobicContact CE1-CD1 4.5Å; F30-L176 HydrophobicContact CB-CD1 4.45Å; F30-L176 HydrophobicContact CD1-CD1 4.09Å; F30-L176 HydrophobicContact CD2-CD1 3.98Å; F30-L176 HydrophobicContact CE1-CD1 4.3Å; F30-L176 HydrophobicContact CE2-CD1 4.2Å; F30-L176 HydrophobicContact CG-CD1 3.92Å; F30-L176 HydrophobicContact CZ-CD1 4.35Å
31	A	91.8	Very high	87	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	157.9	-176.4	0	0	0	0	0	111.4	R40 V41 A63 L67 Y110 G111	A31-R40 CarbonylContact C-O 3.5Å; A31-R40 WeakPolarHBondContact CA-O 3.31Å; A31-R40 WeakPolarHBondContact CB-O 3.47Å; A31-V41 HydrophobicContact CB-CG2 4.39Å; A31-A63 HydrophobicContact CB-CB 4.37Å; A31-L67 HydrophobicContact CB-CD1 3.58Å; A31-Y110 CarbonylContact O-C 3.55Å; A31-Y110 VanDerWaalsContact O-CA 3.29Å; A31-Y110 WeakPolarHBondContact O-CA 3.5Å; A31-G111 PolarHBondContact N-O 3.36Å; A31-G111 PolarHBondContact O-N 2.89Å
32	Y	88.7	Confident	87.6	Confident	14 Å²	14	43.5 Å²	43.5	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	158.9	179	74.8	-68	0	0	0	110.8	D34 P39 R40 R42 T109	Y32-D34 HydrophobicContact CE2-CB 3.92Å; Y32-P39 WeakPolarHBondContact O-CA 3.48Å; Y32-R40 HydrophobicContact CD1-CB 4.11Å; Y32-R40 VanDerWaalsContact CD1-O 3.27Å; Y32-R40 WeakPolarHBondContact CD1-O 3.27Å; Y32-R40 HydrophobicContact CE1-CB 3.49Å; Y32-R40 VanDerWaalsContact CE1-CB 3.49Å; Y32-R40 PolarHBondContact N-O 3.45Å; Y32-R40 PolarHBondContact O-N 3.02Å; Y32-R40 PolarHBondContact OH-NH1 2.94Å; Y32-R42 HydrophobicContact CD1-CG 3.39Å; Y32-R42 HydrophobicContact CE1-CG 3.54Å; Y32-R42 HydrophobicContact CG-CG 4.36Å; Y32-R42 VanDerWaalsContact CZ-CZ 3.49Å; Y32-R42 PolarHBondContact OH-NH2 3.4Å; Y32-T109 CarbonylContact C-O 3.51Å; Y32-T109 VanDerWaalsContact CA-O 3.32Å; Y32-T109 WeakPolarHBondContact CA-O 3.29Å
33	W	86.5	Confident	88	Confident	31 Å²	31	36.9 Å²	36.9	12%	0.117	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.3	170.6	-170.9	-88.6	0	0	0	111.3	P39 L67 I71 T109	W33-P39 HydrophobicContact CE3-CB 4.33Å; W33-P39 HydrophobicContact CZ3-CB 4.5Å; W33-P39 HydrophobicContact CZ3-CG 4.38Å; W33-L67 WeakPolarHBondContact CZ3-O 3.37Å; W33-I71 HydrophobicContact CH2-CB 3.78Å; W33-I71 HydrophobicContact CH2-CD1 3.81Å; W33-I71 HydrophobicContact CH2-CG1 3.85Å; W33-I71 HydrophobicContact CZ2-CB 3.86Å; W33-I71 HydrophobicContact CZ2-CD1 3.38Å; W33-I71 HydrophobicContact CZ2-CG1 3.39Å; W33-I71 HydrophobicContact CZ3-CB 4.39Å; W33-T109 PolarHBondContact N-O 3.09Å
34	D	82.2	Confident	88.3	Confident	32 Å²	32	36 Å²	36	17%	0.171	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.4	168.7	-174.5	-60.7	0	0	0	108.9	Y32 I36 L37 G38 R40	Y32-D34 HydrophobicContact CE2-CB 3.92Å; D34-I36 PolarHBondContact O-N 3.04Å; D34-I36 VanDerWaalsContact O-N 3.16Å; D34-I36 WeakPolarHBondContact OD1-CA 3.28Å; D34-I36 WeakPolarHBondContact OD1-CB 3.32Å; D34-I36 PolarHBondContact OD1-N 3.06Å; D34-L37 HydrophobicContact CB-CB 4.22Å; D34-L37 PolarHBondContact OD1-N 3.35Å; D34-G38 WeakPolarHBondContact CA-O 3.34Å; D34-G38 WeakPolarHBondContact CB-O 3.35Å; D34-G38 PolarHBondContact N-O 3.36Å; D34-G38 VanDerWaalsContact O-CA 3.22Å; D34-G38 WeakPolarHBondContact O-CA 3.44Å; D34-G38 PolarHBondContact O-N 3.03Å; D34-R40 HydrophobicContact CB-CG 4.34Å; D34-R40 IonicContact OD2-NH1 2.84Å
35	N	76.9	Confident	88.5	Confident	129 Å²	129	35.9 Å²	35.9	69%	0.69	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.8	-174.7	-68.7	-34.2	0	0	0	113.9
36	I	77	Confident	88.5	Confident	156 Å²	156	36 Å²	36	80%	0.8	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-45.8	-179.8	-57.7	174.6	0	0	0	110.1	D34	D34-I36 PolarHBondContact O-N 3.04Å; D34-I36 VanDerWaalsContact O-N 3.16Å; D34-I36 WeakPolarHBondContact OD1-CA 3.28Å; D34-I36 WeakPolarHBondContact OD1-CB 3.32Å; D34-I36 PolarHBondContact OD1-N 3.06Å
37	L	79.1	Confident	88.5	Confident	116 Å²	116	34.8 Å²	34.8	61%	0.607	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-6.9	-170.4	-60.6	176.1	0	0	0	113.8	D34	D34-L37 HydrophobicContact CB-CB 4.22Å; D34-L37 PolarHBondContact OD1-N 3.35Å
38	G	82.8	Confident	88.2	Confident	14 Å²	14	41.6 Å²	41.6	14%	0.144	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.9	-154.4	-173.9	0	0	0	0	0	112.2	D34	D34-G38 WeakPolarHBondContact CA-O 3.34Å; D34-G38 WeakPolarHBondContact CB-O 3.35Å; D34-G38 PolarHBondContact N-O 3.36Å; D34-G38 VanDerWaalsContact O-CA 3.22Å; D34-G38 WeakPolarHBondContact O-CA 3.44Å; D34-G38 PolarHBondContact O-N 3.03Å
39	P	85.1	Confident	87.4	Confident	8 Å²	8	44.9 Å²	44.9	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	140.8	-176.3	31.1	-36.6	0	0	0	111.8	Y32 W33 N64 L67 N68	Y32-P39 WeakPolarHBondContact O-CA 3.48Å; W33-P39 HydrophobicContact CE3-CB 4.33Å; W33-P39 HydrophobicContact CZ3-CB 4.5Å; W33-P39 HydrophobicContact CZ3-CG 4.38Å; P39-N64 VanDerWaalsContact C-OD1 3.3Å; P39-N64 HydrophobicContact CB-CB 4.28Å; P39-N64 HydrophobicContact CG-CB 3.66Å; P39-N64 WeakPolarHBondContact CG-O 3.22Å; P39-N64 VanDerWaalsContact O-CG 3.25Å; P39-N64 PolarHBondContact O-ND2 3.08Å; P39-N64 PolarHBondContact O-OD1 3.02Å; P39-L67 HydrophobicContact CB-CB 3.67Å; P39-L67 HydrophobicContact CB-CD1 4.19Å; P39-N68 WeakPolarHBondContact CD-OD1 3.28Å; P39-N68 WeakPolarHBondContact CG-OD1 3.43Å
40	R	86.3	Confident	86	Confident	88 Å²	88	54.6 Å²	54.6	33%	0.332	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	143.9	-179.7	-65.7	-173.7	66.9	-165.4	1.7	110.9	A31 Y32 D34	A31-R40 CarbonylContact C-O 3.5Å; A31-R40 WeakPolarHBondContact CA-O 3.31Å; A31-R40 WeakPolarHBondContact CB-O 3.47Å; Y32-R40 HydrophobicContact CD1-CB 4.11Å; Y32-R40 VanDerWaalsContact CD1-O 3.27Å; Y32-R40 WeakPolarHBondContact CD1-O 3.27Å; Y32-R40 HydrophobicContact CE1-CB 3.49Å; Y32-R40 VanDerWaalsContact CE1-CB 3.49Å; Y32-R40 PolarHBondContact N-O 3.45Å; Y32-R40 PolarHBondContact O-N 3.02Å; Y32-R40 PolarHBondContact OH-NH1 2.94Å; D34-R40 HydrophobicContact CB-CG 4.34Å; D34-R40 IonicContact OD2-NH1 2.84Å
41	V	89.1	Confident	84.6	Confident	14 Å²	14	63 Å²	63	9%	0.085	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.7	171.3	-175.5	0	0	0	0	109.6	V12 A31 H43 I44 T60 A63	V12-V41 HydrophobicContact CG1-CB 4.18Å; V12-V41 HydrophobicContact CG1-CG1 3.83Å; A31-V41 HydrophobicContact CB-CG2 4.39Å; V41-H43 WeakPolarHBondContact CG1-O 3.5Å; V41-I44 HydrophobicContact CG1-CG1 3.85Å; V41-T60 HydrophobicContact CB-CG2 4.04Å; V41-T60 HydrophobicContact CG2-CG2 3.92Å; V41-A63 HydrophobicContact CG2-CB 3.4Å
42	R	88.9	Confident	83.5	Confident	95 Å²	95	67.9 Å²	67.9	36%	0.358	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-44.3	172.3	-75	-73.7	-178.7	171.2	-0.9	111.5	F30 Y32 W103	F30-R42 HydrophobicContact CD1-CB 3.97Å; F30-R42 HydrophobicContact CD1-CG 4.42Å; F30-R42 PolarHBondContact O-N 3.11Å; Y32-R42 HydrophobicContact CD1-CG 3.39Å; Y32-R42 HydrophobicContact CE1-CG 3.54Å; Y32-R42 HydrophobicContact CG-CG 4.36Å; Y32-R42 VanDerWaalsContact CZ-CZ 3.49Å; Y32-R42 PolarHBondContact OH-NH2 3.4Å; R42-W103 HydrophobicContact CG-CZ3 4.3Å
43	H	92.2	Very high	82.8	Confident	13 Å²	13	72.4 Å²	72.4	6%	0.06	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	147.6	-173.8	-159.6	78.7	0	0	0	112.8	A13 T15 T29 F30 V41 W45 I173	A13-H43 WeakPolarHBondContact CB-ND1 3.49Å; A13-H43 WeakPolarHBondContact O-CA 3.37Å; A13-H43 PolarHBondContact O-ND1 2.85Å; T15-H43 PolarHBondContact OG1-CE1 3.1Å; T15-H43 VanDerWaalsContact OG1-CE1 3.24Å; T15-H43 PolarHBondContact OG1-NE2 3.43Å; T29-H43 WeakPolarHBondContact CA-O 3.38Å; F30-H43 PolarHBondContact N-O 2.65Å; F30-H43 PolarHBondContact O-N 3.42Å; V41-H43 WeakPolarHBondContact CG1-O 3.5Å; H43-W45 HydrophobicContact CB-CH2 4.49Å; H43-W45 AromaticContact CD2-CD1 3.92Å; H43-W45 AromaticContact CD2-CD2 3.71Å; H43-W45 AromaticContact CD2-CE2 3.37Å; H43-W45 AromaticContact CD2-CZ2 3.71Å; H43-W45 AromaticContact CD2-NE1 3.5Å; H43-W45 AromaticContact NE2-CD1 3.94Å; H43-W45 AromaticContact NE2-NE1 3.66Å; H43-I173 HydrophobicContact CB-CD1 3.59Å; H43-I173 HydrophobicContact CB-CG1 4.25Å; H43-I173 HydrophobicContact CB-CG2 4.27Å
44	I	93.8	Very high	82.6	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.8	176.2	-59.8	171.1	0	0	0	109.2	V12 A13 K14 T15 A27 T29 V41 A46 D56 I59 T60	V12-I44 HydrophobicContact CB-CD1 4.24Å; V12-I44 HydrophobicContact CG1-CD1 3.96Å; V12-I44 HydrophobicContact CG1-CG1 3.98Å; A13-I44 PolarHBondContact O-N 3.33Å; K14-I44 CarbonylContact C-O 3.58Å; K14-I44 VanDerWaalsContact CA-O 3.29Å; K14-I44 WeakPolarHBondContact CA-O 3.1Å; K14-I44 HydrophobicContact CB-CB 4.5Å; K14-I44 HydrophobicContact CG-CB 4.35Å; K14-I44 HydrophobicContact CG-CG2 4.4Å; T15-I44 PolarHBondContact N-O 3.49Å; A27-I44 HydrophobicContact CB-CG2 4.14Å; T29-I44 HydrophobicContact CG2-CG1 4.38Å; V41-I44 HydrophobicContact CG1-CG1 3.85Å; I44-A46 HydrophobicContact CG2-CB 4.35Å; I44-D56 HydrophobicContact CD1-CB 4.43Å; I44-I59 HydrophobicContact CD1-CG2 4.17Å; I44-I59 HydrophobicContact CG1-CG2 4.44Å; I44-T60 HydrophobicContact CD1-CG2 4.26Å
45	W	94.8	Very high	82.7	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.6	165.9	-62.1	-81.8	0	0	0	108.4	I17 A27 A28 F30 H43 L112 I173 L176 T177 V180 M184	I17-W45 HydrophobicContact CD1-CB 3.77Å; I17-W45 HydrophobicContact CD1-CG 4.31Å; A27-W45 CarbonylContact C-O 3.54Å; A27-W45 VanDerWaalsContact CA-O 3.31Å; A27-W45 WeakPolarHBondContact CA-O 3.42Å; A28-W45 HydrophobicContact CB-CB 4.35Å; A28-W45 HydrophobicContact CB-CE3 4.21Å; A28-W45 PolarHBondContact N-O 3.24Å; A28-W45 PolarHBondContact O-N 3.33Å; F30-W45 HydrophobicContact CB-CH2 3.78Å; F30-W45 HydrophobicContact CB-CZ3 3.71Å; H43-W45 HydrophobicContact CB-CH2 4.49Å; H43-W45 AromaticContact CD2-CD1 3.92Å; H43-W45 AromaticContact CD2-CD2 3.71Å; H43-W45 AromaticContact CD2-CE2 3.37Å; H43-W45 AromaticContact CD2-CZ2 3.71Å; H43-W45 AromaticContact CD2-NE1 3.5Å; H43-W45 AromaticContact NE2-CD1 3.94Å; H43-W45 AromaticContact NE2-NE1 3.66Å; W45-L112 HydrophobicContact CZ3-CD1 4.07Å; W45-I173 HydrophobicContact CH2-CD1 4.44Å; W45-I173 HydrophobicContact CZ2-CG2 4.17Å; W45-L176 HydrophobicContact CH2-CB 3.74Å; W45-L176 HydrophobicContact CH2-CD1 3.99Å; W45-L176 HydrophobicContact CZ2-CB 3.72Å; W45-T177 PolarHBondContact NE1-OG1 2.92Å; W45-V180 HydrophobicContact CB-CG1 4.21Å; W45-V180 HydrophobicContact CD2-CB 4.4Å; W45-V180 HydrophobicContact CD2-CG1 4.1Å; W45-V180 HydrophobicContact CD2-CG2 4.46Å; W45-V180 HydrophobicContact CE3-CG1 4.2Å; W45-V180 HydrophobicContact CE3-CG2 4.25Å; W45-V180 HydrophobicContact CG-CG1 4.12Å; W45-V180 HydrophobicContact CH2-CG2 4.45Å; W45-V180 HydrophobicContact CZ3-CG2 4.23Å; W45-M184 HydrophobicContact CB-SD 4.3Å
46	A	93.1	Very high	83.1	Confident	7 Å²	7	69.7 Å²	69.7	6%	0.058	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.1	-178.1	0	0	0	0	0	110.2	T15 E16 I17 I44	T15-A46 PolarHBondContact O-N 2.74Å; E16-A46 CarbonylContact C-O 3.49Å; E16-A46 VanDerWaalsContact CA-O 3.31Å; E16-A46 WeakPolarHBondContact CA-O 3.4Å; I17-A46 PolarHBondContact N-O 3.44Å; I44-A46 HydrophobicContact CG2-CB 4.35Å
47	P	91.9	Very high	83.5	Confident	10 Å²	10	64.4 Å²	64.4	7%	0.065	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	147.7	169.8	30	-31	0	0	0	109.9	I17 L19 L25 L26 T49 M184	I17-P47 CarbonylContact O-C 3.59Å; I17-P47 WeakPolarHBondContact O-CA 3.37Å; L19-P47 HydrophobicContact CD1-CB 4.11Å; L25-P47 VanDerWaalsContact O-CG 3.31Å; L25-P47 WeakPolarHBondContact O-CG 3.5Å; L26-P47 VanDerWaalsContact O-CD 3.31Å; L26-P47 WeakPolarHBondContact O-CD 3.44Å; P47-T49 HydrophobicContact CB-CG2 4.19Å; P47-T49 HydrophobicContact CG-CG2 4.13Å; P47-T49 PolarHBondContact O-N 2.94Å; P47-M184 HydrophobicContact CB-CE 4.3Å; P47-M184 HydrophobicContact CG-CE 4.44Å
48	K	87.8	Confident	83.8	Confident	143 Å²	143	61.6 Å²	61.6	62%	0.622	32%	0.321	S	S	*	.			trans	-77.1	89.4	174.3	-167.7	176.6	-174.9	177.8	0	109.5	I17	I17-K48 PolarHBondContact O-N 3.33Å
49	T	78.3	Confident	83.9	Confident	70 Å²	70	61.2 Å²	61.2	43%	0.429	32%	0.316	S	S	.	.			trans	-112.8	142.9	178.6	56.6	0	0	0	0	111.6	P47 Q51	P47-T49 HydrophobicContact CB-CG2 4.19Å; P47-T49 HydrophobicContact CG-CG2 4.13Å; P47-T49 PolarHBondContact O-N 2.94Å; T49-Q51 VanDerWaalsContact C-N 3.27Å; T49-Q51 PolarHBondContact O-N 3.49Å; T49-Q51 PolarHBondContact OG1-O 2.98Å; T49-Q51 VanDerWaalsContact OG1-O 3.11Å
50	E	66.3	Low	83.9	Confident	205 Å²	205	61.8 Å²	61.8	96%	0.958	32%	0.319	S	S	*	.	S	Bend	trans	-70.1	-24.9	178.5	-64.3	-170.9	168.6	0	0	112.7
51	Q	64.6	Low	83.9	Confident	177 Å²	177	63.9 Å²	63.9	83%	0.827	33%	0.331	S	S	*	.	S	Bend	trans	-110.5	115.6	174.5	-69	-179.3	-0.1	0	0	109.9	T49	T49-Q51 VanDerWaalsContact C-N 3.27Å; T49-Q51 PolarHBondContact O-N 3.49Å; T49-Q51 PolarHBondContact OG1-O 2.98Å; T49-Q51 VanDerWaalsContact OG1-O 3.11Å
52	V	68.7	Low	83.7	Confident	102 Å²	102	63.5 Å²	63.5	62%	0.618	33%	0.329	S	S	*	.			trans	-95.7	106.1	176.4	177.5	0	0	0	0	108	L54	V52-L54 WeakPolarHBondContact CG1-O 3.35Å
53	L	74.1	Confident	83.3	Confident	109 Å²	109	59.1 Å²	59.1	57%	0.571	31%	0.312	S	S	*	.	S	Bend	trans	-74.9	-26.1	-176.4	-157.7	121.6	0	0	0	113	L26	L26-L53 HydrophobicContact CD1-CD2 4.17Å; L26-L53 HydrophobicContact CD2-CB 3.84Å
54	L	80.7	Confident	82.7	Confident	11 Å²	11	60.6 Å²	60.6	6%	0.058	32%	0.321	C	S	.	.	S	Bend	trans	-133.6	137.4	179.5	-68.5	-179.8	0	0	0	110.6	L26 V52 E58 I59 L62 V92	L26-L54 HydrophobicContact CD1-CD1 3.93Å; L26-L54 HydrophobicContact CD1-CG 4.29Å; V52-L54 WeakPolarHBondContact CG1-O 3.35Å; L54-E58 HydrophobicContact CB-CB 4.49Å; L54-E58 HydrophobicContact CD2-CB 4.34Å; L54-I59 HydrophobicContact CB-CD1 4.46Å; L54-I59 HydrophobicContact CB-CG1 4.12Å; L54-I59 HydrophobicContact CD1-CG1 4.38Å; L54-L62 HydrophobicContact CD1-CD1 3.91Å; L54-V92 HydrophobicContact CD1-CG1 3.7Å
55	S	86.1	Confident	82.2	Confident	62 Å²	62	65.9 Å²	65.9	43%	0.434	35%	0.345	S	S	.	.			trans	-71.7	156.3	171.3	64.1	0	0	0	0	111.9	G57 E58 I59	S55-G57 PolarHBondContact O-N 2.65Å; S55-E58 PolarHBondContact N-OE2 3.07Å; S55-E58 WeakPolarHBondContact O-CB 3.5Å; S55-E58 PolarHBondContact O-N 2.94Å; S55-E58 WeakPolarHBondContact OG-CG 3.39Å; S55-E58 PolarHBondContact OG-N 3.37Å; S55-E58 PolarHBondContact OG-OE2 3.35Å; S55-E58 VanDerWaalsContact OG-OE2 3.06Å; S55-I59 PolarHBondContact O-N 2.87Å
56	D	84.7	Confident	81.6	Confident	62 Å²	62	66 Å²	66	33%	0.332	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-31.2	176	-63.7	-17.9	0	0	0	111.6	K14 I44 E58 I59 T60	K14-D56 IonicContact NZ-OD1 2.77Å; K14-D56 PolarHBondContact NZ-OD1 3.22Å; K14-D56 IonicContact NZ-OD2 3.35Å; K14-D56 PolarHBondContact NZ-OD2 2.84Å; I44-D56 HydrophobicContact CD1-CB 4.43Å; D56-E58 PolarHBondContact O-N 3.39Å; D56-I59 PolarHBondContact O-N 3.03Å; D56-T60 WeakPolarHBondContact O-CB 3.26Å; D56-T60 VanDerWaalsContact O-CG2 3.25Å; D56-T60 WeakPolarHBondContact O-CG2 3.39Å; D56-T60 PolarHBondContact O-N 3.41Å; D56-T60 PolarHBondContact O-OG1 2.74Å
57	G	84.6	Confident	81.1	Confident	46 Å²	46	65.8 Å²	65.8	47%	0.474	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-34.3	173.3	0	0	0	0	0	113.7	S55 T60 F61	S55-G57 PolarHBondContact O-N 2.65Å; G57-T60 WeakPolarHBondContact CA-OG1 3.48Å; G57-T60 PolarHBondContact O-OG1 3.49Å; G57-F61 WeakPolarHBondContact O-CB 3.49Å; G57-F61 PolarHBondContact O-N 2.96Å; G57-F61 VanDerWaalsContact O-N 3.12Å
58	E	86.2	Confident	80.6	Confident	57 Å²	57	69.2 Å²	69.2	27%	0.266	36%	0.362	S	S	.	.	H	α-helix	trans	-75.7	-40.7	175.1	-71.4	172.5	117.9	0	0	111.5	L54 S55 D56 T60 F61 L62 K90	L54-E58 HydrophobicContact CB-CB 4.49Å; L54-E58 HydrophobicContact CD2-CB 4.34Å; S55-E58 PolarHBondContact N-OE2 3.07Å; S55-E58 WeakPolarHBondContact O-CB 3.5Å; S55-E58 PolarHBondContact O-N 2.94Å; S55-E58 WeakPolarHBondContact OG-CG 3.39Å; S55-E58 PolarHBondContact OG-N 3.37Å; S55-E58 PolarHBondContact OG-OE2 3.35Å; S55-E58 VanDerWaalsContact OG-OE2 3.06Å; D56-E58 PolarHBondContact O-N 3.39Å; E58-T60 VanDerWaalsContact C-N 3.31Å; E58-T60 PolarHBondContact O-N 3.24Å; E58-F61 WeakPolarHBondContact O-CB 3.4Å; E58-F61 PolarHBondContact O-N 2.89Å; E58-L62 WeakPolarHBondContact O-CB 3.1Å; E58-L62 VanDerWaalsContact O-CG 3.23Å; E58-L62 WeakPolarHBondContact O-CG 3.44Å; E58-L62 PolarHBondContact O-N 3.36Å; E58-K90 IonicContact OE1-NZ 2.7Å; E58-K90 PolarHBondContact OE1-NZ 2.8Å
59	I	85.5	Confident	80.1	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	36%	0.362	C	S	.	.	H	α-helix	trans	-59.9	-44	176.1	-69.3	170.4	0	0	0	110.8	A27 T29 I44 L54 S55 D56 L62 A63 I115	A27-I59 HydrophobicContact CB-CD1 3.89Å; A27-I59 HydrophobicContact CB-CG2 4.42Å; T29-I59 HydrophobicContact CG2-CG2 3.44Å; T29-I59 VanDerWaalsContact CG2-CG2 3.44Å; I44-I59 HydrophobicContact CD1-CG2 4.17Å; I44-I59 HydrophobicContact CG1-CG2 4.44Å; L54-I59 HydrophobicContact CB-CD1 4.46Å; L54-I59 HydrophobicContact CB-CG1 4.12Å; L54-I59 HydrophobicContact CD1-CG1 4.38Å; S55-I59 PolarHBondContact O-N 2.87Å; D56-I59 PolarHBondContact O-N 3.03Å; I59-L62 PolarHBondContact O-N 2.89Å; I59-A63 PolarHBondContact O-N 2.97Å; I59-I115 HydrophobicContact CG2-CD1 3.94Å
60	T	85.3	Confident	80.2	Confident	20 Å²	20	63.2 Å²	63.2	12%	0.123	35%	0.347	C	S	.	.	H	α-helix	trans	-64.9	-42.5	176.6	49.9	0	0	0	0	112.1	V12 V41 I44 D56 G57 E58 L62 A63 N64	V12-T60 HydrophobicContact CB-CG2 4.49Å; V12-T60 HydrophobicContact CG2-CG2 3.75Å; V41-T60 HydrophobicContact CB-CG2 4.04Å; V41-T60 HydrophobicContact CG2-CG2 3.92Å; I44-T60 HydrophobicContact CD1-CG2 4.26Å; D56-T60 WeakPolarHBondContact O-CB 3.26Å; D56-T60 VanDerWaalsContact O-CG2 3.25Å; D56-T60 WeakPolarHBondContact O-CG2 3.39Å; D56-T60 PolarHBondContact O-N 3.41Å; D56-T60 PolarHBondContact O-OG1 2.74Å; G57-T60 WeakPolarHBondContact CA-OG1 3.48Å; G57-T60 PolarHBondContact O-OG1 3.49Å; E58-T60 VanDerWaalsContact C-N 3.31Å; E58-T60 PolarHBondContact O-N 3.24Å; T60-L62 VanDerWaalsContact C-N 3.33Å; T60-L62 PolarHBondContact O-N 3.46Å; T60-A63 PolarHBondContact O-N 3.13Å; T60-N64 PolarHBondContact O-N 2.95Å; T60-N64 PolarHBondContact O-OD1 3.38Å
61	F	84.8	Confident	80.3	Confident	131 Å²	131	58.8 Å²	58.8	58%	0.575	33%	0.329	S	S	*	.	H	α-helix	trans	-59.6	-42	173.7	178.7	-95.3	0	0	0	112.6	G57 E58 N64 H65	G57-F61 WeakPolarHBondContact O-CB 3.49Å; G57-F61 PolarHBondContact O-N 2.96Å; G57-F61 VanDerWaalsContact O-N 3.12Å; E58-F61 WeakPolarHBondContact O-CB 3.4Å; E58-F61 PolarHBondContact O-N 2.89Å; F61-N64 WeakPolarHBondContact O-CB 3.33Å; F61-N64 PolarHBondContact O-N 3.26Å; F61-H65 PolarHBondContact O-N 3.3Å; F61-H65 VanDerWaalsContact O-N 3.08Å
62	L	84.4	Confident	80.4	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-63.6	-47.4	177.2	-71.9	175.8	0	0	0	111.9	L54 E58 I59 T60 N64 H65 T66 L87 V92 I94	L54-L62 HydrophobicContact CD1-CD1 3.91Å; E58-L62 WeakPolarHBondContact O-CB 3.1Å; E58-L62 VanDerWaalsContact O-CG 3.23Å; E58-L62 WeakPolarHBondContact O-CG 3.44Å; E58-L62 PolarHBondContact O-N 3.36Å; I59-L62 PolarHBondContact O-N 2.89Å; T60-L62 VanDerWaalsContact C-N 3.33Å; T60-L62 PolarHBondContact O-N 3.46Å; L62-N64 VanDerWaalsContact C-N 3.25Å; L62-N64 PolarHBondContact O-N 2.99Å; L62-H65 WeakPolarHBondContact O-CB 3.36Å; L62-H65 PolarHBondContact O-N 3.45Å; L62-H65 VanDerWaalsContact O-N 3.1Å; L62-T66 PolarHBondContact O-N 3.1Å; L62-L87 HydrophobicContact CD2-CD1 3.44Å; L62-L87 VanDerWaalsContact CD2-CD1 3.44Å; L62-V92 HydrophobicContact CD1-CG2 3.96Å; L62-I94 HydrophobicContact CB-CD1 3.86Å; L62-I94 HydrophobicContact CD1-CD1 4.25Å; L62-I94 HydrophobicContact CD2-CD1 4.06Å; L62-I94 HydrophobicContact CG-CD1 4.28Å
63	A	80.5	Confident	80.5	Confident	2 Å²	2	54.9 Å²	54.9	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-39.2	176.3	0	0	0	0	0	111.5	A31 V41 I59 T60 H65 T66 L67	A31-A63 HydrophobicContact CB-CB 4.37Å; V41-A63 HydrophobicContact CG2-CB 3.4Å; I59-A63 PolarHBondContact O-N 2.97Å; T60-A63 PolarHBondContact O-N 3.13Å; A63-H65 VanDerWaalsContact C-N 3.33Å; A63-H65 PolarHBondContact O-N 2.81Å; A63-T66 PolarHBondContact O-N 3.32Å; A63-T66 PolarHBondContact O-OG1 3.41Å; A63-L67 PolarHBondContact O-N 3.27Å
64	N	81.5	Confident	80.1	Confident	45 Å²	45	57.5 Å²	57.5	24%	0.241	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-41.5	175.3	-70.3	-0.2	0	0	0	112.1	P39 T60 F61 L62 T66 L67 N68	P39-N64 VanDerWaalsContact C-OD1 3.3Å; P39-N64 HydrophobicContact CB-CB 4.28Å; P39-N64 HydrophobicContact CG-CB 3.66Å; P39-N64 WeakPolarHBondContact CG-O 3.22Å; P39-N64 VanDerWaalsContact O-CG 3.25Å; P39-N64 PolarHBondContact O-ND2 3.08Å; P39-N64 PolarHBondContact O-OD1 3.02Å; T60-N64 PolarHBondContact O-N 2.95Å; T60-N64 PolarHBondContact O-OD1 3.38Å; F61-N64 WeakPolarHBondContact O-CB 3.33Å; F61-N64 PolarHBondContact O-N 3.26Å; L62-N64 VanDerWaalsContact C-N 3.25Å; L62-N64 PolarHBondContact O-N 2.99Å; N64-T66 VanDerWaalsContact C-N 3.27Å; N64-T66 PolarHBondContact O-N 3.44Å; N64-L67 PolarHBondContact O-N 3.37Å; N64-N68 WeakPolarHBondContact O-CB 3.19Å; N64-N68 PolarHBondContact O-N 2.92Å; N64-N68 PolarHBondContact O-ND2 3.37Å
65	H	82.3	Confident	79.6	Confident	112 Å²	112	58.1 Å²	58.1	52%	0.519	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-33.6	177.4	-159.4	80.5	0	0	0	112.7	F61 L62 A63 L67	F61-H65 PolarHBondContact O-N 3.3Å; F61-H65 VanDerWaalsContact O-N 3.08Å; L62-H65 WeakPolarHBondContact O-CB 3.36Å; L62-H65 PolarHBondContact O-N 3.45Å; L62-H65 VanDerWaalsContact O-N 3.1Å; A63-H65 VanDerWaalsContact C-N 3.33Å; A63-H65 PolarHBondContact O-N 2.81Å; H65-L67 PolarHBondContact O-N 3.35Å
66	T	82.6	Confident	78.7	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-34.8	178.8	64.5	0	0	0	0	113.7	L62 A63 N64 F85 I94	L62-T66 PolarHBondContact O-N 3.1Å; A63-T66 PolarHBondContact O-N 3.32Å; A63-T66 PolarHBondContact O-OG1 3.41Å; N64-T66 VanDerWaalsContact C-N 3.27Å; N64-T66 PolarHBondContact O-N 3.44Å; T66-F85 HydrophobicContact CG2-CD2 4Å; T66-F85 HydrophobicContact CG2-CE2 3.78Å; T66-I94 HydrophobicContact CG2-CD1 4.41Å; T66-I94 HydrophobicContact CG2-CG2 3.94Å
67	L	83.3	Confident	77.8	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-95.1	-21.5	-177	-74.7	176.5	0	0	0	114	A31 W33 P39 A63 N64 H65 G69 E70 I98 T109	A31-L67 HydrophobicContact CB-CD1 3.58Å; W33-L67 WeakPolarHBondContact CZ3-O 3.37Å; P39-L67 HydrophobicContact CB-CB 3.67Å; P39-L67 HydrophobicContact CB-CD1 4.19Å; A63-L67 PolarHBondContact O-N 3.27Å; N64-L67 PolarHBondContact O-N 3.37Å; H65-L67 PolarHBondContact O-N 3.35Å; L67-G69 PolarHBondContact O-N 3.1Å; L67-E70 WeakPolarHBondContact O-CB 3.45Å; L67-E70 PolarHBondContact O-N 3.48Å; L67-I98 HydrophobicContact CD2-CD1 4.49Å; L67-I98 HydrophobicContact CD2-CG1 4.3Å; L67-I98 HydrophobicContact CD2-CG2 4.09Å; L67-T109 HydrophobicContact CD2-CG2 4.23Å
68	N	80.4	Confident	77	Confident	83 Å²	83	61.3 Å²	61.3	44%	0.444	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-52.7	-31	-179.4	-90.1	-26.4	0	0	0	114.6	P39 N64 E70	P39-N68 WeakPolarHBondContact CD-OD1 3.28Å; P39-N68 WeakPolarHBondContact CG-OD1 3.43Å; N64-N68 WeakPolarHBondContact O-CB 3.19Å; N64-N68 PolarHBondContact O-N 2.92Å; N64-N68 PolarHBondContact O-ND2 3.37Å; N68-E70 VanDerWaalsContact C-N 3.31Å; N68-E70 PolarHBondContact O-N 3.22Å
69	G	77.6	Confident	76.9	Confident	60 Å²	60	59.9 Å²	59.9	62%	0.619	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-78.7	-5.6	177.8	0	0	0	0	0	115.4	L67	L67-G69 PolarHBondContact O-N 3.1Å
70	E	80.4	Confident	77.1	Confident	26 Å²	26	61.1 Å²	61.1	12%	0.121	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-101.2	8.7	-168.9	-60.7	-64.4	120.2	0	0	114.3	L67 N68 L72 R73 K83 I98 T109	L67-E70 WeakPolarHBondContact O-CB 3.45Å; L67-E70 PolarHBondContact O-N 3.48Å; N68-E70 VanDerWaalsContact C-N 3.31Å; N68-E70 PolarHBondContact O-N 3.22Å; E70-L72 PolarHBondContact O-N 3.5Å; E70-L72 VanDerWaalsContact O-N 3.1Å; E70-R73 HydrophobicContact CB-CB 4.29Å; E70-R73 WeakPolarHBondContact O-CB 3.46Å; E70-R73 PolarHBondContact O-N 2.59Å; E70-R73 WeakPolarHBondContact OE2-CD 3.31Å; E70-R73 IonicContact OE2-CZ 2.71Å; E70-R73 IonicContact OE2-NH1 3.02Å; E70-R73 PolarHBondContact OE2-NH1 2.93Å; E70-K83 WeakPolarHBondContact OE1-CE 3.4Å; E70-K83 IonicContact OE1-NZ 2.96Å; E70-K83 PolarHBondContact OE1-NZ 2.74Å; E70-I98 HydrophobicContact CG-CD1 3.93Å; E70-I98 HydrophobicContact CG-CG2 4.03Å; E70-T109 HydrophobicContact CB-CG2 4.27Å
71	I	67.6	Low	77.4	Confident	113 Å²	113	63.4 Å²	63.4	58%	0.579	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.8	-175	-163.7	172.3	0	0	0	114.1	W33	W33-I71 HydrophobicContact CH2-CB 3.78Å; W33-I71 HydrophobicContact CH2-CD1 3.81Å; W33-I71 HydrophobicContact CH2-CG1 3.85Å; W33-I71 HydrophobicContact CZ2-CB 3.86Å; W33-I71 HydrophobicContact CZ2-CD1 3.38Å; W33-I71 HydrophobicContact CZ2-CG1 3.39Å; W33-I71 HydrophobicContact CZ3-CB 4.39Å
72	L	66.7	Low	77.8	Confident	158 Å²	158	60 Å²	60	83%	0.827	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	23.3	176.6	-63.9	175	0	0	0	112.3	E70 N74	E70-L72 PolarHBondContact O-N 3.5Å; E70-L72 VanDerWaalsContact O-N 3.1Å; L72-N74 PolarHBondContact O-N 2.84Å
73	R	71.1	Confident	78.3	Confident	39 Å²	39	62.1 Å²	62.1	15%	0.147	35%	0.349	C	S	.	.			trans	-55.5	113.2	179.1	180	-173.1	174.3	83.7	10.5	109.7	E70 A75 D81 I98 D100	E70-R73 HydrophobicContact CB-CB 4.29Å; E70-R73 WeakPolarHBondContact O-CB 3.46Å; E70-R73 PolarHBondContact O-N 2.59Å; E70-R73 WeakPolarHBondContact OE2-CD 3.31Å; E70-R73 IonicContact OE2-CZ 2.71Å; E70-R73 IonicContact OE2-NH1 3.02Å; E70-R73 PolarHBondContact OE2-NH1 2.93Å; R73-A75 HydrophobicContact CG-CB 4.05Å; R73-D81 IonicContact CZ-OD2 2.6Å; R73-D81 IonicContact NH1-OD2 2.67Å; R73-D81 PolarHBondContact NH1-OD2 2.96Å; R73-D81 IonicContact NH2-OD2 2.63Å; R73-D81 PolarHBondContact NH2-OD2 2.96Å; R73-I98 PolarHBondContact NH2-O 2.83Å; R73-D100 WeakPolarHBondContact CD-OD1 3.46Å; R73-D100 IonicContact NE-OD1 3.97Å; R73-D100 PolarHBondContact NE-OD1 3.3Å; R73-D100 VanDerWaalsContact NE-OD1 3.11Å
74	N	65.6	Low	78.9	Confident	163 Å²	163	65.7 Å²	65.7	87%	0.872	36%	0.364	S	S	*	.			trans	-113.5	66.4	172.4	-171.7	22.1	0	0	0	108.5	L72	L72-N74 PolarHBondContact O-N 2.84Å
75	A	69.8	Low	79.5	Confident	25 Å²	25	66.2 Å²	66.2	21%	0.207	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-82	151.2	-179.9	0	0	0	0	0	110.4	R73 A79	R73-A75 HydrophobicContact CG-CB 4.05Å; A75-A79 HydrophobicContact CB-CB 4.06Å
76	E	67.3	Low	80	Confident	152 Å²	152	63.9 Å²	63.9	71%	0.71	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-55.4	143.1	168.2	-67.2	-173.7	175.7	0	0	109.5	G78 A79	E76-G78 PolarHBondContact O-N 2.83Å; E76-A79 WeakPolarHBondContact O-CB 3.27Å; E76-A79 PolarHBondContact O-N 2.9Å
77	S	66	Low	80.4	Confident	63 Å²	63	65.9 Å²	65.9	44%	0.441	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	134.9	176.6	-178.3	0	0	0	0	109.6	A79 M479	S77-A79 VanDerWaalsContact C-N 3.3Å; S77-A79 PolarHBondContact O-N 3.25Å; S77-M479 CarbonylContact C-O 3.34Å; S77-M479 WeakPolarHBondContact CB-O 3.25Å; S77-M479 PolarHBondContact OG-O 3.11Å
78	G	69.1	Low	80.7	Confident	22 Å²	22	69 Å²	69	23%	0.227	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	-4.1	-177.2	0	0	0	0	0	115.9	E76 R143 M479	E76-G78 PolarHBondContact O-N 2.83Å; G78-R143 VanDerWaalsContact C-NH1 3.27Å; G78-R143 PolarHBondContact O-NH1 3.05Å; G78-M479 PolarHBondContact N-O 3.43Å
79	A	82.6	Confident	81.1	Confident	27 Å²	27	74.1 Å²	74.1	22%	0.223	42%	0.415	C	S	.	.			trans	-66	140.8	178.7	0	0	0	0	0	112.7	A75 E76 S77 R143	A75-A79 HydrophobicContact CB-CB 4.06Å; E76-A79 WeakPolarHBondContact O-CB 3.27Å; E76-A79 PolarHBondContact O-N 2.9Å; S77-A79 VanDerWaalsContact C-N 3.3Å; S77-A79 PolarHBondContact O-N 3.25Å; A79-R143 PolarHBondContact O-NH2 3.09Å
80	I	89.9	Confident	81.5	Confident	31 Å²	31	75.3 Å²	75.3	16%	0.159	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	113.1	172.6	-59.6	166.7	0	0	0	106.5	L97 I98 F99 T136 I139 R140	I80-L97 HydrophobicContact CG2-CB 4Å; I80-L97 HydrophobicContact CG2-CD2 3.9Å; I80-L97 HydrophobicContact CG2-CG 4.21Å; I80-I98 WeakPolarHBondContact CA-O 3.08Å; I80-F99 HydrophobicContact CG1-CB 4.09Å; I80-F99 HydrophobicContact CG2-CB 4.39Å; I80-T136 HydrophobicContact CD1-CG2 3.84Å; I80-I139 HydrophobicContact CD1-CB 4.05Å; I80-I139 HydrophobicContact CD1-CG2 3.56Å; I80-I139 HydrophobicContact CG1-CG2 3.95Å; I80-I139 HydrophobicContact CG2-CD1 3.96Å; I80-R140 HydrophobicContact CD1-CG 4.19Å
81	D	91.4	Very high	82.1	Confident	68 Å²	68	83 Å²	83	36%	0.364	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.3	-177.7	-64.5	-43.8	0	0	0	110.9	R73 L97 I98	R73-D81 IonicContact CZ-OD2 2.6Å; R73-D81 IonicContact NH1-OD2 2.67Å; R73-D81 PolarHBondContact NH1-OD2 2.96Å; R73-D81 IonicContact NH2-OD2 2.63Å; R73-D81 PolarHBondContact NH2-OD2 2.96Å; D81-L97 CarbonylContact O-C 3.54Å; D81-L97 WeakPolarHBondContact O-CA 3.42Å; D81-I98 PolarHBondContact N-O 3.29Å; D81-I98 PolarHBondContact O-N 3Å
82	V	93.8	Very high	83.3	Confident	61 Å²	61	77.6 Å²	77.6	37%	0.37	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	125.9	176.1	-176.1	0	0	0	0	108.7	V95 L97 V132	V82-V95 HydrophobicContact CG1-CG1 4.31Å; V82-L97 HydrophobicContact CG1-CD1 4.49Å; V82-L97 HydrophobicContact CG2-CD1 4.46Å; V82-L97 HydrophobicContact CG2-CG 4.08Å; V82-V132 HydrophobicContact CG1-CG2 3.84Å; V82-V132 HydrophobicContact CG2-CG1 3.58Å; V82-V132 HydrophobicContact CG2-CG2 4.26Å
83	K	93.8	Very high	84.7	Confident	51 Å²	51	70 Å²	70	22%	0.222	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134	169.4	-65.1	-162.9	-176.6	171.5	0	110.9	E70 F85 V95 S96 I98	E70-K83 WeakPolarHBondContact OE1-CE 3.4Å; E70-K83 IonicContact OE1-NZ 2.96Å; E70-K83 PolarHBondContact OE1-NZ 2.74Å; K83-F85 HydrophobicContact CB-CD2 4.21Å; K83-F85 HydrophobicContact CB-CE2 3.48Å; K83-F85 VanDerWaalsContact CB-CE2 3.48Å; K83-F85 HydrophobicContact CB-CZ 3.93Å; K83-F85 HydrophobicContact CD-CE2 3.83Å; K83-F85 HydrophobicContact CD-CZ 3.53Å; K83-F85 HydrophobicContact CG-CE2 4.34Å; K83-F85 HydrophobicContact CG-CZ 4.38Å; K83-V95 WeakPolarHBondContact O-CA 3.3Å; K83-S96 PolarHBondContact N-O 3.11Å; K83-S96 PolarHBondContact O-N 3.23Å; K83-I98 HydrophobicContact CD-CD1 3.53Å; K83-I98 VanDerWaalsContact CE-CD1 3.47Å; K83-I98 HydrophobicContact CG-CD1 3.9Å
84	F	94.7	Very high	85.8	Confident	76 Å²	76	68.3 Å²	68.3	33%	0.333	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	116.1	177.7	-174.9	-94.9	0	0	0	109.3	V86 I93 V95 L121 Y124 L125	F84-V86 HydrophobicContact CD1-CG2 4.2Å; F84-V86 HydrophobicContact CE1-CG2 3.47Å; F84-V86 VanDerWaalsContact CE1-CG2 3.47Å; F84-V86 HydrophobicContact CZ-CG2 4.14Å; F84-I93 HydrophobicContact CD2-CG2 4.3Å; F84-I93 HydrophobicContact CE1-CG2 4.34Å; F84-I93 HydrophobicContact CE2-CG2 3.44Å; F84-I93 VanDerWaalsContact CE2-CG2 3.44Å; F84-I93 HydrophobicContact CZ-CG2 3.46Å; F84-I93 VanDerWaalsContact CZ-CG2 3.46Å; F84-V95 HydrophobicContact CD2-CG2 3.48Å; F84-V95 VanDerWaalsContact CD2-CG2 3.48Å; F84-V95 HydrophobicContact CE2-CG2 3.72Å; F84-L121 HydrophobicContact CE1-CD1 4.2Å; F84-L121 HydrophobicContact CZ-CD1 3.63Å; F84-Y124 HydrophobicContact CD2-CE1 4.34Å; F84-Y124 AromaticContact CE2-CD1 3.94Å; F84-Y124 HydrophobicContact CE2-CD1 3.94Å; F84-Y124 AromaticContact CE2-CE1 3.8Å; F84-Y124 HydrophobicContact CE2-CE1 3.8Å; F84-L125 HydrophobicContact CZ-CD2 4.33Å
85	F	92.8	Very high	87.3	Confident	56 Å²	56	60.5 Å²	60.5	25%	0.246	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.8	-179.2	-59.8	-81.9	0	0	0	110.6	T66 K83 I93 I94	T66-F85 HydrophobicContact CG2-CD2 4Å; T66-F85 HydrophobicContact CG2-CE2 3.78Å; K83-F85 HydrophobicContact CB-CD2 4.21Å; K83-F85 HydrophobicContact CB-CE2 3.48Å; K83-F85 VanDerWaalsContact CB-CE2 3.48Å; K83-F85 HydrophobicContact CB-CZ 3.93Å; K83-F85 HydrophobicContact CD-CE2 3.83Å; K83-F85 HydrophobicContact CD-CZ 3.53Å; K83-F85 HydrophobicContact CG-CE2 4.34Å; K83-F85 HydrophobicContact CG-CZ 4.38Å; F85-I93 CarbonylContact O-C 3.52Å; F85-I93 VanDerWaalsContact O-CA 3.27Å; F85-I93 WeakPolarHBondContact O-CA 3.04Å; F85-I94 HydrophobicContact CB-CB 4.29Å; F85-I94 HydrophobicContact CD2-CB 4.43Å; F85-I94 PolarHBondContact N-O 2.75Å; F85-I94 PolarHBondContact O-N 2.91Å
86	V	93.6	Very high	88.5	Confident	64 Å²	64	59.3 Å²	59.3	39%	0.388	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	108.5	168.5	-175.4	0	0	0	0	107.5	F84 I93 Q118	F84-V86 HydrophobicContact CD1-CG2 4.2Å; F84-V86 HydrophobicContact CE1-CG2 3.47Å; F84-V86 VanDerWaalsContact CE1-CG2 3.47Å; F84-V86 HydrophobicContact CZ-CG2 4.14Å; V86-I93 HydrophobicContact CG2-CG1 4.45Å; V86-Q118 HydrophobicContact CG1-CG 4.22Å
87	L	91.3	Very high	89.9	Confident	45 Å²	45	52.1 Å²	52.1	24%	0.236	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	89.3	-176.7	-64.2	175	0	0	0	109.5	L62 E89 K90 R91 V92 I94	L62-L87 HydrophobicContact CD2-CD1 3.44Å; L62-L87 VanDerWaalsContact CD2-CD1 3.44Å; L87-E89 VanDerWaalsContact C-N 3.29Å; L87-E89 PolarHBondContact O-N 3.33Å; L87-K90 CarbonylContact O-C 3.6Å; L87-K90 PolarHBondContact O-N 2.93Å; L87-R91 PolarHBondContact O-N 3.42Å; L87-V92 HydrophobicContact CB-CG2 4.07Å; L87-V92 HydrophobicContact CD1-CG2 4.35Å; L87-V92 PolarHBondContact N-O 2.64Å; L87-V92 PolarHBondContact O-N 3.29Å; L87-I94 HydrophobicContact CD1-CD1 3.67Å
88	A	89.3	Confident	91.1	Very high	65 Å²	65	49.1 Å²	49.1	54%	0.537	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-61.1	-34.9	-176.3	0	0	0	0	0	113.4	K90 R91	A88-K90 VanDerWaalsContact C-N 3.29Å; A88-K90 PolarHBondContact O-N 3.29Å; A88-R91 PolarHBondContact O-N 3.43Å
89	E	88	Confident	92.2	Very high	192 Å²	192	48.3 Å²	48.3	90%	0.897	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-62.2	-36.9	178.9	-63.6	-179.4	179.9	0	0	112.6	L87	L87-E89 VanDerWaalsContact C-N 3.29Å; L87-E89 PolarHBondContact O-N 3.33Å
90	K	87.4	Confident	92.5	Very high	85 Å²	85	48.2 Å²	48.2	37%	0.37	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-99.1	0.2	177.6	-67.7	-62.3	-169.9	173.4	0	113	E58 L87 A88 V92	E58-K90 IonicContact OE1-NZ 2.7Å; E58-K90 PolarHBondContact OE1-NZ 2.8Å; L87-K90 CarbonylContact O-C 3.6Å; L87-K90 PolarHBondContact O-N 2.93Å; A88-K90 VanDerWaalsContact C-N 3.29Å; A88-K90 PolarHBondContact O-N 3.29Å; K90-V92 HydrophobicContact CB-CG2 3.95Å; K90-V92 PolarHBondContact O-N 2.92Å
91	R	91.9	Very high	92.2	Very high	186 Å²	186	47.1 Å²	47.1	70%	0.702	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	43.2	-177.8	-58.3	-179.4	179.3	178.6	-0.5	112.9	L87 A88 Q118	L87-R91 PolarHBondContact O-N 3.42Å; A88-R91 PolarHBondContact O-N 3.43Å; R91-Q118 VanDerWaalsContact C-CB 3.46Å; R91-Q118 HydrophobicContact CB-CB 4.45Å; R91-Q118 WeakPolarHBondContact O-CB 3.32Å; R91-Q118 PolarHBondContact O-N 3.24Å
92	V	93.9	Very high	91.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158.1	178.3	-66.7	0	0	0	0	113	L26 L54 L62 L87 K90 I94 I115 L116	L26-V92 HydrophobicContact CD1-CG1 3.58Å; L54-V92 HydrophobicContact CD1-CG1 3.7Å; L62-V92 HydrophobicContact CD1-CG2 3.96Å; L87-V92 HydrophobicContact CB-CG2 4.07Å; L87-V92 HydrophobicContact CD1-CG2 4.35Å; L87-V92 PolarHBondContact N-O 2.64Å; L87-V92 PolarHBondContact O-N 3.29Å; K90-V92 HydrophobicContact CB-CG2 3.95Å; K90-V92 PolarHBondContact O-N 2.92Å; V92-I94 HydrophobicContact CG2-CG1 4.45Å; V92-I115 HydrophobicContact CB-CG2 4.29Å; V92-I115 HydrophobicContact CG1-CG2 4.32Å; V92-L116 CarbonylContact C-O 3.57Å; V92-L116 VanDerWaalsContact CA-O 3.27Å; V92-L116 WeakPolarHBondContact CA-O 3.29Å; V92-L116 WeakPolarHBondContact CB-O 3.43Å
93	I	95.3	Very high	90.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138	168.8	-59.6	153	0	0	0	107.1	F84 F85 V86 V95 I115 L116 L121	F84-I93 HydrophobicContact CD2-CG2 4.3Å; F84-I93 HydrophobicContact CE1-CG2 4.34Å; F84-I93 HydrophobicContact CE2-CG2 3.44Å; F84-I93 VanDerWaalsContact CE2-CG2 3.44Å; F84-I93 HydrophobicContact CZ-CG2 3.46Å; F84-I93 VanDerWaalsContact CZ-CG2 3.46Å; F85-I93 CarbonylContact O-C 3.52Å; F85-I93 VanDerWaalsContact O-CA 3.27Å; F85-I93 WeakPolarHBondContact O-CA 3.04Å; V86-I93 HydrophobicContact CG2-CG1 4.45Å; I93-V95 HydrophobicContact CG2-CG2 4.48Å; I93-I115 WeakPolarHBondContact O-CA 3.46Å; I93-L116 PolarHBondContact N-O 3.38Å; I93-L116 PolarHBondContact O-N 3.01Å; I93-L121 VanDerWaalsContact CD1-CA 3.48Å; I93-L121 HydrophobicContact CD1-CB 3.61Å; I93-L121 HydrophobicContact CD1-CD1 3.65Å; I93-L121 HydrophobicContact CD1-CG 4.19Å; I93-L121 HydrophobicContact CG1-CD1 4.25Å
94	I	95.1	Very high	89.3	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.9	177.4	-51.9	172.9	0	0	0	108.3	L62 T66 F85 L87 V92 I115	L62-I94 HydrophobicContact CB-CD1 3.86Å; L62-I94 HydrophobicContact CD1-CD1 4.25Å; L62-I94 HydrophobicContact CD2-CD1 4.06Å; L62-I94 HydrophobicContact CG-CD1 4.28Å; T66-I94 HydrophobicContact CG2-CD1 4.41Å; T66-I94 HydrophobicContact CG2-CG2 3.94Å; F85-I94 HydrophobicContact CB-CB 4.29Å; F85-I94 HydrophobicContact CD2-CB 4.43Å; F85-I94 PolarHBondContact N-O 2.75Å; F85-I94 PolarHBondContact O-N 2.91Å; L87-I94 HydrophobicContact CD1-CD1 3.67Å; V92-I94 HydrophobicContact CG2-CG1 4.45Å; I94-I115 HydrophobicContact CG1-CG1 4.41Å; I94-I115 HydrophobicContact CG1-CG2 4.44Å; I94-I115 HydrophobicContact CG2-CG1 4.42Å
95	V	96.4	Very high	87.8	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	115.5	168.8	-172.9	0	0	0	0	107.6	V82 K83 F84 I93 L97 S113 I114 Y124	V82-V95 HydrophobicContact CG1-CG1 4.31Å; K83-V95 WeakPolarHBondContact O-CA 3.3Å; F84-V95 HydrophobicContact CD2-CG2 3.48Å; F84-V95 VanDerWaalsContact CD2-CG2 3.48Å; F84-V95 HydrophobicContact CE2-CG2 3.72Å; I93-V95 HydrophobicContact CG2-CG2 4.48Å; V95-L97 HydrophobicContact CG1-CD1 4.41Å; V95-S113 CarbonylContact O-C 3.4Å; V95-S113 VanDerWaalsContact O-CA 3.22Å; V95-S113 WeakPolarHBondContact O-CA 3.48Å; V95-I114 PolarHBondContact N-O 3.49Å; V95-I114 PolarHBondContact O-N 3.31Å; V95-Y124 HydrophobicContact CG2-CD1 4.38Å; V95-Y124 HydrophobicContact CG2-CE1 3.46Å; V95-Y124 VanDerWaalsContact CG2-CE1 3.46Å; V95-Y124 HydrophobicContact CG2-CE2 4.39Å; V95-Y124 VanDerWaalsContact CG2-CZ 3.47Å; V95-Y124 VanDerWaalsContact CG2-OH 3.31Å; V95-Y124 WeakPolarHBondContact CG2-OH 3.49Å
96	S	95.2	Very high	86.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.4	-176.1	-166.4	0	0	0	0	109.9	K83 S113	K83-S96 PolarHBondContact N-O 3.11Å; K83-S96 PolarHBondContact O-N 3.23Å; S96-S113 VanDerWaalsContact CB-OG 3.31Å; S96-S113 WeakPolarHBondContact CB-OG 3.36Å; S96-S113 PolarHBondContact OG-OG 2.91Å
97	L	95.3	Very high	86	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.3	168.2	-80.2	74.6	0	0	0	108.1	I80 D81 V82 V95 G111 L112 L135 T136 I139	I80-L97 HydrophobicContact CG2-CB 4Å; I80-L97 HydrophobicContact CG2-CD2 3.9Å; I80-L97 HydrophobicContact CG2-CG 4.21Å; D81-L97 CarbonylContact O-C 3.54Å; D81-L97 WeakPolarHBondContact O-CA 3.42Å; V82-L97 HydrophobicContact CG1-CD1 4.49Å; V82-L97 HydrophobicContact CG2-CD1 4.46Å; V82-L97 HydrophobicContact CG2-CG 4.08Å; V95-L97 HydrophobicContact CG1-CD1 4.41Å; L97-G111 WeakPolarHBondContact O-CA 3.47Å; L97-L112 PolarHBondContact N-O 3.45Å; L97-L112 PolarHBondContact O-N 3.3Å; L97-L135 HydrophobicContact CD1-CB 4.09Å; L97-L135 HydrophobicContact CD1-CD1 3.73Å; L97-L135 HydrophobicContact CD2-CB 3.71Å; L97-L135 HydrophobicContact CG-CB 4.47Å; L97-T136 WeakPolarHBondContact CD2-OG1 3.08Å; L97-I139 HydrophobicContact CB-CD1 3.35Å; L97-I139 HydrophobicContact CD2-CD1 3.74Å; L97-I139 HydrophobicContact CG-CD1 4.19Å
98	I	93	Very high	85.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.6	-174.7	-57.8	172.4	0	0	0	108.4	L67 E70 R73 I80 D81 K83 T109 Y110	L67-I98 HydrophobicContact CD2-CD1 4.49Å; L67-I98 HydrophobicContact CD2-CG1 4.3Å; L67-I98 HydrophobicContact CD2-CG2 4.09Å; E70-I98 HydrophobicContact CG-CD1 3.93Å; E70-I98 HydrophobicContact CG-CG2 4.03Å; R73-I98 PolarHBondContact NH2-O 2.83Å; I80-I98 WeakPolarHBondContact CA-O 3.08Å; D81-I98 PolarHBondContact N-O 3.29Å; D81-I98 PolarHBondContact O-N 3Å; K83-I98 HydrophobicContact CD-CD1 3.53Å; K83-I98 VanDerWaalsContact CE-CD1 3.47Å; K83-I98 HydrophobicContact CG-CD1 3.9Å; I98-T109 HydrophobicContact CG2-CG2 3.61Å; I98-Y110 WeakPolarHBondContact CA-O 3.43Å
99	F	91.2	Very high	85.7	Confident	6 Å²	6	46.6 Å²	46.6	3%	0.026	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	147.9	-169.1	72.7	-92.4	0	0	0	110.9	F30 I80 Y110 L112 I139 R143 M146	F30-F99 HydrophobicContact CE2-CE1 4.36Å; F30-F99 AromaticContact CE2-CZ 3.94Å; F30-F99 HydrophobicContact CE2-CZ 3.94Å; I80-F99 HydrophobicContact CG1-CB 4.09Å; I80-F99 HydrophobicContact CG2-CB 4.39Å; F99-Y110 HydrophobicContact CE2-CD2 4.23Å; F99-Y110 HydrophobicContact CE2-CG 4.22Å; F99-Y110 HydrophobicContact CZ-CG 4.25Å; F99-Y110 PolarHBondContact N-O 3.06Å; F99-Y110 PolarHBondContact O-N 3.47Å; F99-L112 HydrophobicContact CE1-CB 4.4Å; F99-I139 HydrophobicContact CB-CG2 3.85Å; F99-I139 HydrophobicContact CD1-CB 4.42Å; F99-I139 HydrophobicContact CD1-CD1 3.67Å; F99-I139 HydrophobicContact CD1-CG1 3.85Å; F99-I139 HydrophobicContact CD1-CG2 3.67Å; F99-I139 HydrophobicContact CD2-CG2 3.59Å; F99-I139 HydrophobicContact CE1-CB 4.48Å; F99-I139 HydrophobicContact CE1-CD1 3.96Å; F99-I139 HydrophobicContact CE1-CG1 3.73Å; F99-I139 HydrophobicContact CE1-CG2 4Å; F99-I139 HydrophobicContact CE2-CG2 3.93Å; F99-I139 HydrophobicContact CG-CD1 4.42Å; F99-I139 HydrophobicContact CG-CG1 4.49Å; F99-I139 HydrophobicContact CG-CG2 3.42Å; F99-I139 VanDerWaalsContact CG-CG2 3.42Å; F99-I139 HydrophobicContact CZ-CG1 4.28Å; F99-I139 HydrophobicContact CZ-CG2 4.1Å; F99-R143 VanDerWaalsContact CB-NH2 3.34Å; F99-R143 HydrophobicContact CD2-CG 4.05Å; F99-R143 HydrophobicContact CE2-CG 4.19Å; F99-M146 HydrophobicContact CE2-CE 3.59Å; F99-M146 HydrophobicContact CZ-CE 4.21Å
100	D	88.1	Confident	85.9	Confident	24 Å²	24	37.7 Å²	37.7	13%	0.128	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	142.2	173	-61.5	6	0	0	0	110.3	R73 R107 R143	R73-D100 WeakPolarHBondContact CD-OD1 3.46Å; R73-D100 IonicContact NE-OD1 3.97Å; R73-D100 PolarHBondContact NE-OD1 3.3Å; R73-D100 VanDerWaalsContact NE-OD1 3.11Å; D100-R107 IonicContact OD2-CZ 3.86Å; D100-R107 IonicContact OD2-NE 2.57Å; D100-R107 IonicContact OD2-NH2 2.69Å; D100-R107 PolarHBondContact OD2-NH2 3.24Å; D100-R143 VanDerWaalsContact N-NH2 3.18Å; D100-R143 PolarHBondContact O-NE 2.98Å; D100-R143 PolarHBondContact O-NH2 3.16Å
101	G	83.8	Confident	86.1	Confident	8 Å²	8	33.7 Å²	33.7	8%	0.082	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	167	174.9	0	0	0	0	0	110.8	R107 S108	G101-R107 WeakPolarHBondContact O-CA 3.45Å; G101-S108 PolarHBondContact N-O 3.46Å; G101-S108 PolarHBondContact O-N 2.91Å
102	N	79.3	Confident	86.3	Confident	30 Å²	30	25 Å²	25	16%	0.16	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	106.9	173.4	-173.5	-22.4	0	0	0	108.3	D106 M146 R150	N102-D106 WeakPolarHBondContact CA-O 3.48Å; N102-D106 PolarHBondContact OD1-O 3.48Å; N102-M146 CarbonylContact O-C 3.57Å; N102-M146 VanDerWaalsContact O-CB 3.3Å; N102-M146 WeakPolarHBondContact O-CB 3.3Å; N102-R150 WeakPolarHBondContact ND2-CD 3.46Å
103	W	72.8	Confident	86.4	Confident	24 Å²	24	25 Å²	25	9%	0.091	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.8	-177.9	-170.9	35.8	0	0	0	108.7	R42 G105 D106 Y110 M146 E149 I172	R42-W103 HydrophobicContact CG-CZ3 4.3Å; W103-G105 PolarHBondContact O-N 2.81Å; W103-D106 PolarHBondContact N-O 3.38Å; W103-D106 PolarHBondContact O-N 2.91Å; W103-Y110 VanDerWaalsContact CB-OH 3.24Å; W103-Y110 WeakPolarHBondContact CB-OH 3.48Å; W103-Y110 HydrophobicContact CE3-CE1 4.16Å; W103-M146 HydrophobicContact CB-CB 4.31Å; W103-M146 HydrophobicContact CB-CG 4.18Å; W103-M146 HydrophobicContact CB-SD 4.1Å; W103-M146 HydrophobicContact CG-CG 4.27Å; W103-E149 VanDerWaalsContact CD1-OE2 3.23Å; W103-E149 PolarHBondContact NE1-OE2 2.75Å; W103-I172 HydrophobicContact CH2-CG2 4.46Å; W103-I172 HydrophobicContact CZ2-CG2 4.29Å
104	N	66.4	Low	86.4	Confident	77 Å²	77	25.2 Å²	25.2	41%	0.412	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	27.9	-175.3	-61.8	-10.4	0	0	0	114.8	D106	N104-D106 VanDerWaalsContact C-N 3.33Å; N104-D106 PolarHBondContact O-N 2.87Å
105	G	64.1	Low	86.4	Confident	39 Å²	39	25.1 Å²	25.1	40%	0.402	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-14.7	175.4	0	0	0	0	0	115.2	W103	W103-G105 PolarHBondContact O-N 2.81Å
106	D	68.9	Low	86.4	Confident	109 Å²	109	25.1 Å²	25.1	58%	0.583	13%	0.133	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.2	177.5	-76.3	-24.3	0	0	0	111.6	N102 W103 N104	N102-D106 WeakPolarHBondContact CA-O 3.48Å; N102-D106 PolarHBondContact OD1-O 3.48Å; W103-D106 PolarHBondContact N-O 3.38Å; W103-D106 PolarHBondContact O-N 2.91Å; N104-D106 VanDerWaalsContact C-N 3.33Å; N104-D106 PolarHBondContact O-N 2.87Å
107	R	80.1	Confident	86.3	Confident	159 Å²	159	26.1 Å²	26.1	60%	0.6	14%	0.14	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.7	168.3	-177.4	178	175	172.7	-2.4	108.3	D100 G101	D100-R107 IonicContact OD2-CZ 3.86Å; D100-R107 IonicContact OD2-NE 2.57Å; D100-R107 IonicContact OD2-NH2 2.69Å; D100-R107 PolarHBondContact OD2-NH2 3.24Å; G101-R107 WeakPolarHBondContact O-CA 3.45Å
108	S	85.4	Confident	86.3	Confident	16 Å²	16	29.3 Å²	29.3	11%	0.112	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	160.6	178.4	-67.6	0	0	0	0	111.4	G101 Y110	G101-S108 PolarHBondContact N-O 3.46Å; G101-S108 PolarHBondContact O-N 2.91Å; S108-Y110 VanDerWaalsContact O-CD2 3.23Å; S108-Y110 WeakPolarHBondContact O-CD2 3.39Å; S108-Y110 WeakPolarHBondContact O-CE2 3.34Å
109	T	88.9	Confident	86.4	Confident	22 Å²	22	34 Å²	34	14%	0.135	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.1	170.9	-50.4	0	0	0	0	109.1	Y32 W33 L67 E70 I98	Y32-T109 CarbonylContact C-O 3.51Å; Y32-T109 VanDerWaalsContact CA-O 3.32Å; Y32-T109 WeakPolarHBondContact CA-O 3.29Å; W33-T109 PolarHBondContact N-O 3.09Å; L67-T109 HydrophobicContact CD2-CG2 4.23Å; E70-T109 HydrophobicContact CB-CG2 4.27Å; I98-T109 HydrophobicContact CG2-CG2 3.61Å
110	Y	90.8	Very high	86.5	Confident	5 Å²	5	35 Å²	35	2%	0.02	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	156.9	177.4	-61.3	-88.7	0	0	0	110.8	F30 A31 I98 F99 W103 S108 M146	F30-Y110 HydrophobicContact CE1-CD1 4.15Å; F30-Y110 AromaticContact CE2-CD1 3.86Å; F30-Y110 HydrophobicContact CE2-CD1 3.86Å; F30-Y110 HydrophobicContact CE2-CG 4.23Å; F30-Y110 AromaticContact CZ-CD1 3.37Å; F30-Y110 HydrophobicContact CZ-CD1 3.37Å; F30-Y110 AromaticContact CZ-CE1 3.99Å; F30-Y110 HydrophobicContact CZ-CE1 3.99Å; F30-Y110 HydrophobicContact CZ-CG 4.08Å; A31-Y110 CarbonylContact O-C 3.55Å; A31-Y110 VanDerWaalsContact O-CA 3.29Å; A31-Y110 WeakPolarHBondContact O-CA 3.5Å; I98-Y110 WeakPolarHBondContact CA-O 3.43Å; F99-Y110 HydrophobicContact CE2-CD2 4.23Å; F99-Y110 HydrophobicContact CE2-CG 4.22Å; F99-Y110 HydrophobicContact CZ-CG 4.25Å; F99-Y110 PolarHBondContact N-O 3.06Å; F99-Y110 PolarHBondContact O-N 3.47Å; W103-Y110 VanDerWaalsContact CB-OH 3.24Å; W103-Y110 WeakPolarHBondContact CB-OH 3.48Å; W103-Y110 HydrophobicContact CE3-CE1 4.16Å; S108-Y110 VanDerWaalsContact O-CD2 3.23Å; S108-Y110 WeakPolarHBondContact O-CD2 3.39Å; S108-Y110 WeakPolarHBondContact O-CE2 3.34Å; Y110-M146 HydrophobicContact CE2-SD 4.29Å
111	G	92.9	Very high	86.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	125	174.9	0	0	0	0	0	110.7	A31 L97	A31-G111 PolarHBondContact N-O 3.36Å; A31-G111 PolarHBondContact O-N 2.89Å; L97-G111 WeakPolarHBondContact O-CA 3.47Å
112	L	95.7	Very high	87.3	Confident	3 Å²	3	38 Å²	38	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.4	167.8	-176.6	62.1	0	0	0	108.2	W45 L97 F99 L135 I138 I139 V180	W45-L112 HydrophobicContact CZ3-CD1 4.07Å; L97-L112 PolarHBondContact N-O 3.45Å; L97-L112 PolarHBondContact O-N 3.3Å; F99-L112 HydrophobicContact CE1-CB 4.4Å; L112-L135 HydrophobicContact CD2-CD2 3.72Å; L112-L135 HydrophobicContact CG-CD2 4.25Å; L112-I138 HydrophobicContact CD2-CG2 4.27Å; L112-I139 HydrophobicContact CB-CD1 4.36Å; L112-I139 HydrophobicContact CD2-CG1 4.27Å; L112-V180 HydrophobicContact CD1-CG2 4.37Å
113	S	95.9	Very high	88.1	Confident	1 Å²	1	38 Å²	38	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.5	-172.9	-46.6	0	0	0	0	112.3	A28 T29 V95 S96	A28-S113 CarbonylContact C-O 3.43Å; A28-S113 WeakPolarHBondContact CA-O 3.48Å; T29-S113 PolarHBondContact N-O 3.21Å; T29-S113 PolarHBondContact O-N 3.37Å; T29-S113 WeakPolarHBondContact OG1-CB 3.46Å; V95-S113 CarbonylContact O-C 3.4Å; V95-S113 VanDerWaalsContact O-CA 3.22Å; V95-S113 WeakPolarHBondContact O-CA 3.48Å; S96-S113 VanDerWaalsContact CB-OG 3.31Å; S96-S113 WeakPolarHBondContact CB-OG 3.36Å; S96-S113 PolarHBondContact OG-OG 2.91Å
114	I	95.8	Very high	89.2	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132.6	167.6	-61.5	-176.2	0	0	0	108.1	L25 V95 L116 L135 V183	L25-I114 HydrophobicContact CD1-CG2 4.3Å; L25-I114 HydrophobicContact CD2-CG2 3.25Å; L25-I114 HydrophobicContact CG-CG2 4.37Å; V95-I114 PolarHBondContact N-O 3.49Å; V95-I114 PolarHBondContact O-N 3.31Å; I114-L116 HydrophobicContact CG2-CD1 3.76Å; I114-L116 HydrophobicContact CG2-CG 4.33Å; I114-L135 HydrophobicContact CD1-CD1 3.69Å; I114-L135 HydrophobicContact CD1-CD2 4.18Å; I114-L135 HydrophobicContact CD1-CG 4.28Å; I114-L135 HydrophobicContact CG1-CD1 3.99Å; I114-V183 HydrophobicContact CD1-CG1 3.79Å
115	I	95.3	Very high	90.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.6	-177.8	-52.6	177.7	0	0	0	108.9	L26 A27 T29 I59 V92 I93 I94	L26-I115 HydrophobicContact CB-CG2 4.24Å; L26-I115 HydrophobicContact CD1-CG2 4.32Å; L26-I115 PolarHBondContact N-O 3.28Å; A27-I115 PolarHBondContact N-O 2.95Å; A27-I115 PolarHBondContact O-N 3.5Å; T29-I115 HydrophobicContact CG2-CD1 4.07Å; I59-I115 HydrophobicContact CG2-CD1 3.94Å; V92-I115 HydrophobicContact CB-CG2 4.29Å; V92-I115 HydrophobicContact CG1-CG2 4.32Å; I93-I115 WeakPolarHBondContact O-CA 3.46Å; I94-I115 HydrophobicContact CG1-CG1 4.41Å; I94-I115 HydrophobicContact CG1-CG2 4.44Å; I94-I115 HydrophobicContact CG2-CG1 4.42Å
116	L	95	Very high	92	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	155.3	178.5	-56.5	97.4	0	0	0	110.7	L25 V92 I93 I114 Y124	L25-L116 HydrophobicContact CD2-CD1 4.18Å; L25-L116 HydrophobicContact CD2-CD2 3.66Å; L25-L116 HydrophobicContact CD2-CG 3.54Å; V92-L116 CarbonylContact C-O 3.57Å; V92-L116 VanDerWaalsContact CA-O 3.27Å; V92-L116 WeakPolarHBondContact CA-O 3.29Å; V92-L116 WeakPolarHBondContact CB-O 3.43Å; I93-L116 PolarHBondContact N-O 3.38Å; I93-L116 PolarHBondContact O-N 3.01Å; I114-L116 HydrophobicContact CG2-CD1 3.76Å; I114-L116 HydrophobicContact CG2-CG 4.33Å; L116-Y124 HydrophobicContact CD1-CD2 4.03Å; L116-Y124 HydrophobicContact CD1-CE2 4.28Å; L116-Y124 HydrophobicContact CD1-CG 4.43Å; L116-Y124 HydrophobicContact CD2-CD2 3.87Å; L116-Y124 HydrophobicContact CD2-CG 4.31Å
117	P	94.3	Very high	93.3	Very high	21 Å²	21	32.2 Å²	32.2	14%	0.136	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	146.9	166.3	-16.6	31.5	0	0	0	111	P24 L26 S119 E120	P24-P117 WeakPolarHBondContact O-CD 3.27Å; L26-P117 HydrophobicContact CD1-CG 4.17Å; L26-P117 HydrophobicContact CD2-CG 3.98Å; L26-P117 HydrophobicContact CG-CG 3.91Å; P117-S119 WeakPolarHBondContact CB-OG 3.3Å; P117-S119 PolarHBondContact O-N 3.01Å; P117-E120 HydrophobicContact CB-CG 4.39Å; P117-E120 HydrophobicContact CG-CG 4.3Å; P117-E120 WeakPolarHBondContact O-CB 3.2Å; P117-E120 PolarHBondContact O-N 2.86Å
118	Q	94.6	Very high	94	Very high	66 Å²	66	27.4 Å²	27.4	31%	0.308	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-62.5	-26.4	177.5	-174.9	-177.6	6.3	0	0	112.7	V86 R91 E120 L121	V86-Q118 HydrophobicContact CG1-CG 4.22Å; R91-Q118 VanDerWaalsContact C-CB 3.46Å; R91-Q118 HydrophobicContact CB-CB 4.45Å; R91-Q118 WeakPolarHBondContact O-CB 3.32Å; R91-Q118 PolarHBondContact O-N 3.24Å; Q118-E120 PolarHBondContact O-N 3.22Å; Q118-L121 WeakPolarHBondContact O-CB 3.39Å; Q118-L121 PolarHBondContact O-N 3.1Å
119	S	94.3	Very high	94.3	Very high	99 Å²	99	32.8 Å²	32.8	69%	0.692	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-59	-24	173.2	52	0	0	0	0	113	P117 L121	P117-S119 WeakPolarHBondContact CB-OG 3.3Å; P117-S119 PolarHBondContact O-N 3.01Å; S119-L121 VanDerWaalsContact C-N 3.34Å
120	E	94.7	Very high	94.5	Very high	28 Å²	28	32.3 Å²	32.3	13%	0.131	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-90.4	9.6	-178.2	-60.4	-57.9	151.1	0	0	113.5	P24 P117 Q118 G122 F123 Y124 K191	P24-E120 HydrophobicContact CB-CG 4.47Å; P117-E120 HydrophobicContact CB-CG 4.39Å; P117-E120 HydrophobicContact CG-CG 4.3Å; P117-E120 WeakPolarHBondContact O-CB 3.2Å; P117-E120 PolarHBondContact O-N 2.86Å; Q118-E120 PolarHBondContact O-N 3.22Å; E120-G122 PolarHBondContact O-N 3.27Å; E120-F123 HydrophobicContact CB-CD1 4.36Å; E120-F123 WeakPolarHBondContact O-CB 3.5Å; E120-F123 PolarHBondContact O-N 3.06Å; E120-F123 VanDerWaalsContact O-N 3.12Å; E120-F123 WeakPolarHBondContact OE2-CB 3.45Å; E120-Y124 PolarHBondContact O-N 3.25Å; E120-K191 IonicContact OE1-NZ 3.48Å; E120-K191 PolarHBondContact OE1-NZ 3.34Å; E120-K191 IonicContact OE2-NZ 2.76Å; E120-K191 PolarHBondContact OE2-NZ 3.46Å
121	L	95.1	Very high	94.6	Very high	51 Å²	51	32.1 Å²	32.1	27%	0.267	18%	0.176	S	C	.	.	H	α-helix	trans	-55.5	-50.9	-178.9	-173.7	57.6	0	0	0	112.7	F84 I93 Q118 S119 F123 Y124 L125	F84-L121 HydrophobicContact CE1-CD1 4.2Å; F84-L121 HydrophobicContact CZ-CD1 3.63Å; I93-L121 VanDerWaalsContact CD1-CA 3.48Å; I93-L121 HydrophobicContact CD1-CB 3.61Å; I93-L121 HydrophobicContact CD1-CD1 3.65Å; I93-L121 HydrophobicContact CD1-CG 4.19Å; I93-L121 HydrophobicContact CG1-CD1 4.25Å; Q118-L121 WeakPolarHBondContact O-CB 3.39Å; Q118-L121 PolarHBondContact O-N 3.1Å; S119-L121 VanDerWaalsContact C-N 3.34Å; L121-F123 PolarHBondContact O-N 3.19Å; L121-Y124 PolarHBondContact O-N 2.97Å; L121-L125 HydrophobicContact CD1-CD1 4.19Å; L121-L125 HydrophobicContact CD1-CD2 4.28Å; L121-L125 HydrophobicContact CD1-CG 4.02Å; L121-L125 HydrophobicContact CG-CD1 4.1Å; L121-L125 HydrophobicContact CG-CG 4.35Å; L121-L125 WeakPolarHBondContact O-CG 3.24Å; L121-L125 PolarHBondContact O-N 2.88Å
122	G	93.8	Very high	94.7	Very high	43 Å²	43	32.9 Å²	32.9	44%	0.443	18%	0.181	S	C	.	.	H	α-helix	trans	-68.8	-20.1	-178.9	0	0	0	0	0	113.8	E120	E120-G122 PolarHBondContact O-N 3.27Å
123	F	95.1	Very high	94.5	Very high	29 Å²	29	36.4 Å²	36.4	13%	0.127	20%	0.2	C	C	.	.	H	α-helix	trans	-78.8	-44.2	172	162.9	-103.4	0	0	0	111.2	P24 E120 L121 L127 L187 M190 K191	P24-F123 HydrophobicContact CB-CD1 4.19Å; P24-F123 HydrophobicContact CB-CE1 3.72Å; P24-F123 HydrophobicContact CB-CZ 4.47Å; P24-F123 HydrophobicContact CG-CE1 3.76Å; P24-F123 HydrophobicContact CG-CZ 4.21Å; E120-F123 HydrophobicContact CB-CD1 4.36Å; E120-F123 WeakPolarHBondContact O-CB 3.5Å; E120-F123 PolarHBondContact O-N 3.06Å; E120-F123 VanDerWaalsContact O-N 3.12Å; E120-F123 WeakPolarHBondContact OE2-CB 3.45Å; L121-F123 PolarHBondContact O-N 3.19Å; F123-L127 HydrophobicContact CE1-CD1 4.24Å; F123-L127 HydrophobicContact CE2-CD1 3.87Å; F123-L127 HydrophobicContact CZ-CD1 3.69Å; F123-L187 HydrophobicContact CE1-CD2 4.31Å; F123-L187 HydrophobicContact CZ-CD2 4.4Å; F123-L187 WeakPolarHBondContact CZ-O 3.41Å; F123-M190 HydrophobicContact CE2-CB 3.97Å; F123-M190 HydrophobicContact CZ-CB 4.01Å; F123-K191 HydrophobicContact CD2-CD 4.3Å; F123-K191 HydrophobicContact CE2-CB 4.11Å; F123-K191 HydrophobicContact CE2-CD 4.34Å; F123-K191 HydrophobicContact CZ-CB 4Å
124	Y	95.7	Very high	94.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-75.5	-36.7	-174	178.6	-95.8	0	0	0	113.8	F84 V95 L116 E120 L121 L127 H128 C131	F84-Y124 HydrophobicContact CD2-CE1 4.34Å; F84-Y124 AromaticContact CE2-CD1 3.94Å; F84-Y124 HydrophobicContact CE2-CD1 3.94Å; F84-Y124 AromaticContact CE2-CE1 3.8Å; F84-Y124 HydrophobicContact CE2-CE1 3.8Å; V95-Y124 HydrophobicContact CG2-CD1 4.38Å; V95-Y124 HydrophobicContact CG2-CE1 3.46Å; V95-Y124 VanDerWaalsContact CG2-CE1 3.46Å; V95-Y124 HydrophobicContact CG2-CE2 4.39Å; V95-Y124 VanDerWaalsContact CG2-CZ 3.47Å; V95-Y124 VanDerWaalsContact CG2-OH 3.31Å; V95-Y124 WeakPolarHBondContact CG2-OH 3.49Å; L116-Y124 HydrophobicContact CD1-CD2 4.03Å; L116-Y124 HydrophobicContact CD1-CE2 4.28Å; L116-Y124 HydrophobicContact CD1-CG 4.43Å; L116-Y124 HydrophobicContact CD2-CD2 3.87Å; L116-Y124 HydrophobicContact CD2-CG 4.31Å; E120-Y124 PolarHBondContact O-N 3.25Å; L121-Y124 PolarHBondContact O-N 2.97Å; Y124-L127 CarbonylContact O-C 3.56Å; Y124-L127 WeakPolarHBondContact O-CA 3.49Å; Y124-L127 PolarHBondContact O-N 3.18Å; Y124-H128 HydrophobicContact CD1-CB 4.48Å; Y124-H128 HydrophobicContact CE1-CB 3.86Å; Y124-H128 AromaticContact CE1-ND1 3.43Å; Y124-H128 WeakPolarHBondContact CE1-ND1 3.12Å; Y124-H128 AromaticContact CZ-ND1 3.71Å; Y124-H128 PolarHBondContact O-N 3.28Å; Y124-H128 PolarHBondContact OH-ND1 2.69Å; Y124-C131 HydrophobicContact CE2-CB 4.14Å
125	L	95.5	Very high	94.2	Very high	94 Å²	94	37.7 Å²	37.7	49%	0.492	20%	0.204	S	C	.	.	H	α-helix	trans	-53.6	-45.4	-171.7	-78.4	174.6	0	0	0	114.6	F84 L121 L127 H128	F84-L125 HydrophobicContact CZ-CD2 4.33Å; L121-L125 HydrophobicContact CD1-CD1 4.19Å; L121-L125 HydrophobicContact CD1-CD2 4.28Å; L121-L125 HydrophobicContact CD1-CG 4.02Å; L121-L125 HydrophobicContact CG-CD1 4.1Å; L121-L125 HydrophobicContact CG-CG 4.35Å; L121-L125 WeakPolarHBondContact O-CG 3.24Å; L121-L125 PolarHBondContact O-N 2.88Å; L125-L127 VanDerWaalsContact C-N 3.28Å; L125-L127 PolarHBondContact O-N 3.31Å; L125-H128 VanDerWaalsContact O-CB 3.29Å; L125-H128 WeakPolarHBondContact O-CB 3.41Å; L125-H128 PolarHBondContact O-N 2.75Å
126	P	94.8	Very high	94	Very high	30 Å²	30	38.7 Å²	38.7	20%	0.195	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-37.9	174.5	-24.9	36.1	0	0	0	113.1	H128 K261 C262	P126-H128 VanDerWaalsContact C-N 3.29Å; P126-H128 PolarHBondContact O-N 3.17Å; P126-K261 HydrophobicContact CB-CB 3.93Å; P126-K261 HydrophobicContact CG-CB 3.93Å; P126-K261 HydrophobicContact CG-CD 3.92Å; P126-C262 WeakPolarHBondContact CB-SG 3.49Å; P126-C262 PolarHBondContact O-SG 2.89Å
127	L	95.4	Very high	93.7	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-80.6	-7.8	-177.5	-57.4	175.4	0	0	0	113.4	F123 Y124 L125 R129 V130 C131 L187 M190 L278	F123-L127 HydrophobicContact CE1-CD1 4.24Å; F123-L127 HydrophobicContact CE2-CD1 3.87Å; F123-L127 HydrophobicContact CZ-CD1 3.69Å; Y124-L127 CarbonylContact O-C 3.56Å; Y124-L127 WeakPolarHBondContact O-CA 3.49Å; Y124-L127 PolarHBondContact O-N 3.18Å; L125-L127 VanDerWaalsContact C-N 3.28Å; L125-L127 PolarHBondContact O-N 3.31Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 3.02Å; L127-V130 WeakPolarHBondContact O-CB 3.14Å; L127-V130 PolarHBondContact O-N 3.27Å; L127-C131 PolarHBondContact O-N 2.82Å; L127-L187 HydrophobicContact CB-CD2 4.49Å; L127-L187 HydrophobicContact CD1-CD2 3.77Å; L127-M190 HydrophobicContact CD1-CB 3.76Å; L127-M190 HydrophobicContact CD1-CG 4.03Å; L127-M190 HydrophobicContact CD2-CE 3.78Å; L127-M190 HydrophobicContact CD2-CG 4.18Å; L127-L278 HydrophobicContact CD2-CD2 4.4Å
128	H	95.4	Very high	93.5	Very high	58 Å²	58	38.6 Å²	38.6	27%	0.269	21%	0.208	S	C	.	.	H	α-helix	trans	-51.7	-48.1	-173.5	177.5	58.8	0	0	0	112.5	Y124 L125 P126 V130 C131 V132	Y124-H128 HydrophobicContact CD1-CB 4.48Å; Y124-H128 HydrophobicContact CE1-CB 3.86Å; Y124-H128 AromaticContact CE1-ND1 3.43Å; Y124-H128 WeakPolarHBondContact CE1-ND1 3.12Å; Y124-H128 AromaticContact CZ-ND1 3.71Å; Y124-H128 PolarHBondContact O-N 3.28Å; Y124-H128 PolarHBondContact OH-ND1 2.69Å; L125-H128 VanDerWaalsContact O-CB 3.29Å; L125-H128 WeakPolarHBondContact O-CB 3.41Å; L125-H128 PolarHBondContact O-N 2.75Å; P126-H128 VanDerWaalsContact C-N 3.29Å; P126-H128 PolarHBondContact O-N 3.17Å; H128-V130 PolarHBondContact O-N 2.94Å; H128-C131 PolarHBondContact O-N 2.58Å; H128-V132 WeakPolarHBondContact CE1-CG2 3.17Å; H128-V132 WeakPolarHBondContact O-CB 3.2Å; H128-V132 VanDerWaalsContact O-CG2 3.28Å; H128-V132 WeakPolarHBondContact O-CG2 3.45Å; H128-V132 PolarHBondContact O-N 2.67Å
129	R	92	Very high	93.4	Very high	129 Å²	129	35.6 Å²	35.6	49%	0.487	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-44.2	179.8	-175.6	174	178.3	175.5	-2	112	L127 C131 V132 D133	L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 3.02Å; R129-C131 VanDerWaalsContact C-N 3.34Å; R129-C131 PolarHBondContact O-N 3.47Å; R129-V132 PolarHBondContact O-N 3.28Å; R129-D133 WeakPolarHBondContact CG-OD2 3.41Å; R129-D133 IonicContact NE-OD2 2.64Å; R129-D133 WeakPolarHBondContact O-CB 3.39Å; R129-D133 VanDerWaalsContact O-CG 3.31Å; R129-D133 PolarHBondContact O-N 3.39Å
130	V	92.2	Very high	93.1	Very high	12 Å²	12	35.1 Å²	35.1	7%	0.073	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-46.5	178	-177.7	0	0	0	0	110.5	L127 H128 R134 L186 G277	L127-V130 WeakPolarHBondContact O-CB 3.14Å; L127-V130 PolarHBondContact O-N 3.27Å; H128-V130 PolarHBondContact O-N 2.94Å; V130-R134 VanDerWaalsContact O-CB 3.3Å; V130-R134 WeakPolarHBondContact O-CB 3.29Å; V130-R134 PolarHBondContact O-N 3.28Å; V130-L186 HydrophobicContact CG1-CD2 3.98Å; V130-G277 VanDerWaalsContact CG2-O 3.26Å; V130-G277 WeakPolarHBondContact CG2-O 3.48Å
131	C	94.2	Very high	92.7	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-45.5	177.6	-67.4	0	0	0	0	112.4	Y124 L127 H128 R129 R134 L135	Y124-C131 HydrophobicContact CE2-CB 4.14Å; L127-C131 PolarHBondContact O-N 2.82Å; H128-C131 PolarHBondContact O-N 2.58Å; R129-C131 VanDerWaalsContact C-N 3.34Å; R129-C131 PolarHBondContact O-N 3.47Å; C131-R134 PolarHBondContact O-N 2.75Å; C131-L135 WeakPolarHBondContact O-CB 3.43Å; C131-L135 VanDerWaalsContact O-CG 3.27Å; C131-L135 WeakPolarHBondContact O-CG 3.27Å; C131-L135 PolarHBondContact O-N 3.21Å
132	V	94.4	Very high	92.3	Very high	17 Å²	17	32.3 Å²	32.3	10%	0.103	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-48.1	-180	165.7	0	0	0	0	111.1	V82 H128 R129 R134 L135 T136	V82-V132 HydrophobicContact CG1-CG2 3.84Å; V82-V132 HydrophobicContact CG2-CG1 3.58Å; V82-V132 HydrophobicContact CG2-CG2 4.26Å; H128-V132 WeakPolarHBondContact CE1-CG2 3.17Å; H128-V132 WeakPolarHBondContact O-CB 3.2Å; H128-V132 VanDerWaalsContact O-CG2 3.28Å; H128-V132 WeakPolarHBondContact O-CG2 3.45Å; H128-V132 PolarHBondContact O-N 2.67Å; R129-V132 PolarHBondContact O-N 3.28Å; V132-R134 VanDerWaalsContact C-N 3.28Å; V132-R134 PolarHBondContact O-N 3.04Å; V132-L135 PolarHBondContact O-N 2.97Å; V132-T136 VanDerWaalsContact O-CB 3.26Å; V132-T136 WeakPolarHBondContact O-CB 3.17Å; V132-T136 PolarHBondContact O-N 2.61Å; V132-T136 PolarHBondContact O-OG1 2.88Å
133	D	90.5	Very high	92	Very high	76 Å²	76	30.9 Å²	30.9	41%	0.406	14%	0.144	S	C	.	.	H	α-helix	trans	-62.3	-40.1	-179.8	-71.6	-20.7	0	0	0	110.5	R129 T136 H137	R129-D133 WeakPolarHBondContact CG-OD2 3.41Å; R129-D133 IonicContact NE-OD2 2.64Å; R129-D133 WeakPolarHBondContact O-CB 3.39Å; R129-D133 VanDerWaalsContact O-CG 3.31Å; R129-D133 PolarHBondContact O-N 3.39Å; D133-T136 PolarHBondContact O-N 2.99Å; D133-H137 PolarHBondContact O-N 3.39Å; D133-H137 VanDerWaalsContact O-N 3.08Å
134	R	91.5	Very high	91.4	Very high	30 Å²	30	29.7 Å²	29.7	11%	0.113	14%	0.139	C	C	.	.	H	α-helix	trans	-65.5	-50.3	176.9	-168.7	60.6	176.9	-145.2	0.3	112.1	V130 C131 V132 T136 H137 I138 V183 S276	V130-R134 VanDerWaalsContact O-CB 3.3Å; V130-R134 WeakPolarHBondContact O-CB 3.29Å; V130-R134 PolarHBondContact O-N 3.28Å; C131-R134 PolarHBondContact O-N 2.75Å; V132-R134 VanDerWaalsContact C-N 3.28Å; V132-R134 PolarHBondContact O-N 3.04Å; R134-T136 VanDerWaalsContact C-N 3.28Å; R134-T136 PolarHBondContact O-N 2.94Å; R134-H137 PolarHBondContact O-N 3.2Å; R134-I138 HydrophobicContact CG-CD1 4.34Å; R134-I138 VanDerWaalsContact O-CG1 3.29Å; R134-I138 WeakPolarHBondContact O-CG1 3.25Å; R134-I138 PolarHBondContact O-N 2.91Å; R134-I138 VanDerWaalsContact O-N 3.08Å; R134-V183 HydrophobicContact CB-CG2 4.47Å; R134-V183 HydrophobicContact CG-CG2 3.63Å; R134-S276 PolarHBondContact NH1-OG 2.98Å
135	L	93.8	Very high	90.8	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-35.9	177	-68.3	175	0	0	0	112	L97 L112 I114 C131 V132 H137 I138 I139	L97-L135 HydrophobicContact CD1-CB 4.09Å; L97-L135 HydrophobicContact CD1-CD1 3.73Å; L97-L135 HydrophobicContact CD2-CB 3.71Å; L97-L135 HydrophobicContact CG-CB 4.47Å; L112-L135 HydrophobicContact CD2-CD2 3.72Å; L112-L135 HydrophobicContact CG-CD2 4.25Å; I114-L135 HydrophobicContact CD1-CD1 3.69Å; I114-L135 HydrophobicContact CD1-CD2 4.18Å; I114-L135 HydrophobicContact CD1-CG 4.28Å; I114-L135 HydrophobicContact CG1-CD1 3.99Å; C131-L135 WeakPolarHBondContact O-CB 3.43Å; C131-L135 VanDerWaalsContact O-CG 3.27Å; C131-L135 WeakPolarHBondContact O-CG 3.27Å; C131-L135 PolarHBondContact O-N 3.21Å; V132-L135 PolarHBondContact O-N 2.97Å; L135-H137 VanDerWaalsContact C-N 3.33Å; L135-H137 PolarHBondContact O-N 3.31Å; L135-I138 HydrophobicContact CD2-CD1 4.28Å; L135-I138 WeakPolarHBondContact O-CB 3.23Å; L135-I138 PolarHBondContact O-N 3.47Å; L135-I139 VanDerWaalsContact O-CG1 3.27Å; L135-I139 WeakPolarHBondContact O-CG1 3.42Å; L135-I139 PolarHBondContact O-N 2.92Å
136	T	92.3	Very high	90.1	Very high	22 Å²	22	26.8 Å²	26.8	14%	0.135	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-43.7	175.5	-61	0	0	0	0	111	I80 L97 V132 D133 R134 I139 R140	I80-T136 HydrophobicContact CD1-CG2 3.84Å; L97-T136 WeakPolarHBondContact CD2-OG1 3.08Å; V132-T136 VanDerWaalsContact O-CB 3.26Å; V132-T136 WeakPolarHBondContact O-CB 3.17Å; V132-T136 PolarHBondContact O-N 2.61Å; V132-T136 PolarHBondContact O-OG1 2.88Å; D133-T136 PolarHBondContact O-N 2.99Å; R134-T136 VanDerWaalsContact C-N 3.28Å; R134-T136 PolarHBondContact O-N 2.94Å; T136-I139 PolarHBondContact O-N 3.47Å; T136-R140 WeakPolarHBondContact O-CG 3.33Å; T136-R140 PolarHBondContact O-N 3.39Å
137	H	87.9	Confident	89.4	Confident	19 Å²	19	27.1 Å²	27.1	9%	0.088	12%	0.12	C	C	.	.	H	α-helix	trans	-64.6	-41.5	176.1	-173.2	74	0	0	0	112.2	D133 R134 L135 I139 R140 K141 Y300	D133-H137 PolarHBondContact O-N 3.39Å; D133-H137 VanDerWaalsContact O-N 3.08Å; R134-H137 PolarHBondContact O-N 3.2Å; L135-H137 VanDerWaalsContact C-N 3.33Å; L135-H137 PolarHBondContact O-N 3.31Å; H137-I139 VanDerWaalsContact C-N 3.31Å; H137-I139 PolarHBondContact O-N 2.86Å; H137-R140 PolarHBondContact O-N 3.12Å; H137-K141 PolarHBondContact O-N 2.96Å; H137-K141 VanDerWaalsContact O-N 3.11Å; H137-Y300 AromaticContact CE1-CE2 3.77Å; H137-Y300 AromaticContact CE1-CZ 3.4Å; H137-Y300 VanDerWaalsContact CE1-CZ 3.4Å; H137-Y300 PolarHBondContact CE1-OH 2.78Å; H137-Y300 AromaticContact NE2-CE2 3.48Å; H137-Y300 WeakPolarHBondContact NE2-CE2 3.38Å; H137-Y300 AromaticContact NE2-CZ 3.51Å; H137-Y300 PolarHBondContact NE2-OH 3.41Å; H137-Y300 VanDerWaalsContact NE2-OH 3.15Å
138	I	91.1	Very high	88.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.1	-44.4	175.5	-63.1	170.6	0	0	0	110.5	L112 R134 L135 R140 K141 G142 L176 E179 V183	L112-I138 HydrophobicContact CD2-CG2 4.27Å; R134-I138 HydrophobicContact CG-CD1 4.34Å; R134-I138 VanDerWaalsContact O-CG1 3.29Å; R134-I138 WeakPolarHBondContact O-CG1 3.25Å; R134-I138 PolarHBondContact O-N 2.91Å; R134-I138 VanDerWaalsContact O-N 3.08Å; L135-I138 HydrophobicContact CD2-CD1 4.28Å; L135-I138 WeakPolarHBondContact O-CB 3.23Å; L135-I138 PolarHBondContact O-N 3.47Å; I138-R140 PolarHBondContact O-N 3.28Å; I138-K141 PolarHBondContact O-N 3.48Å; I138-G142 PolarHBondContact O-N 3.4Å; I138-L176 HydrophobicContact CG2-CD2 3.81Å; I138-E179 HydrophobicContact CB-CB 4.38Å; I138-E179 HydrophobicContact CD1-CB 3.79Å; I138-E179 WeakPolarHBondContact CD1-O 3.34Å; I138-E179 HydrophobicContact CG1-CB 3.76Å; I138-E179 HydrophobicContact CG1-CG 4.3Å; I138-E179 HydrophobicContact CG2-CB 3.76Å; I138-E179 HydrophobicContact CG2-CG 4.33Å; I138-V183 HydrophobicContact CD1-CG2 3.91Å
139	I	92.1	Very high	87.1	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-63.7	-41.9	178.1	-71	166.1	0	0	0	111.6	I80 L97 F99 L112 L135 T136 H137 K141 G142 R143	I80-I139 HydrophobicContact CD1-CB 4.05Å; I80-I139 HydrophobicContact CD1-CG2 3.56Å; I80-I139 HydrophobicContact CG1-CG2 3.95Å; I80-I139 HydrophobicContact CG2-CD1 3.96Å; L97-I139 HydrophobicContact CB-CD1 3.35Å; L97-I139 HydrophobicContact CD2-CD1 3.74Å; L97-I139 HydrophobicContact CG-CD1 4.19Å; F99-I139 HydrophobicContact CB-CG2 3.85Å; F99-I139 HydrophobicContact CD1-CB 4.42Å; F99-I139 HydrophobicContact CD1-CD1 3.67Å; F99-I139 HydrophobicContact CD1-CG1 3.85Å; F99-I139 HydrophobicContact CD1-CG2 3.67Å; F99-I139 HydrophobicContact CD2-CG2 3.59Å; F99-I139 HydrophobicContact CE1-CB 4.48Å; F99-I139 HydrophobicContact CE1-CD1 3.96Å; F99-I139 HydrophobicContact CE1-CG1 3.73Å; F99-I139 HydrophobicContact CE1-CG2 4Å; F99-I139 HydrophobicContact CE2-CG2 3.93Å; F99-I139 HydrophobicContact CG-CD1 4.42Å; F99-I139 HydrophobicContact CG-CG1 4.49Å; F99-I139 HydrophobicContact CG-CG2 3.42Å; F99-I139 VanDerWaalsContact CG-CG2 3.42Å; F99-I139 HydrophobicContact CZ-CG1 4.28Å; F99-I139 HydrophobicContact CZ-CG2 4.1Å; L112-I139 HydrophobicContact CB-CD1 4.36Å; L112-I139 HydrophobicContact CD2-CG1 4.27Å; L135-I139 VanDerWaalsContact O-CG1 3.27Å; L135-I139 WeakPolarHBondContact O-CG1 3.42Å; L135-I139 PolarHBondContact O-N 2.92Å; T136-I139 PolarHBondContact O-N 3.47Å; H137-I139 VanDerWaalsContact C-N 3.31Å; H137-I139 PolarHBondContact O-N 2.86Å; I139-K141 PolarHBondContact O-N 3.35Å; I139-G142 CarbonylContact O-C 3.53Å; I139-G142 PolarHBondContact O-N 3.17Å; I139-R143 HydrophobicContact CG2-CG 4.36Å; I139-R143 WeakPolarHBondContact O-CB 3.49Å; I139-R143 WeakPolarHBondContact O-CG 3.35Å; I139-R143 PolarHBondContact O-N 3.27Å
140	R	88.1	Confident	85.9	Confident	90 Å²	90	24.6 Å²	24.6	34%	0.34	11%	0.109	S	C	.	.	H	α-helix	trans	-60.4	-46.3	177.1	-74.4	177.6	177.6	162.2	4.6	112	I80 T136 H137 I138 R143 I144 L336	I80-R140 HydrophobicContact CD1-CG 4.19Å; T136-R140 WeakPolarHBondContact O-CG 3.33Å; T136-R140 PolarHBondContact O-N 3.39Å; H137-R140 PolarHBondContact O-N 3.12Å; I138-R140 PolarHBondContact O-N 3.28Å; R140-R143 PolarHBondContact O-N 3.02Å; R140-I144 PolarHBondContact O-N 3.04Å; R140-L336 HydrophobicContact CB-CD2 4.48Å
141	K	85.4	Confident	84.4	Confident	19 Å²	19	28.6 Å²	28.6	8%	0.083	13%	0.127	C	C	.	.	H	α-helix	trans	-62.4	-44.3	174.2	-70.2	179.3	65.1	-177.7	0	111.3	H137 I138 I139 R143 I144 W145 E179	H137-K141 PolarHBondContact O-N 2.96Å; H137-K141 VanDerWaalsContact O-N 3.11Å; I138-K141 PolarHBondContact O-N 3.48Å; I139-K141 PolarHBondContact O-N 3.35Å; K141-R143 PolarHBondContact O-N 3.36Å; K141-I144 PolarHBondContact O-N 2.71Å; K141-W145 PolarHBondContact O-N 3.49Å; K141-E179 IonicContact NZ-OE1 3.94Å; K141-E179 PolarHBondContact NZ-OE1 3.19Å
142	G	87.4	Confident	82.9	Confident	1 Å²	1	33 Å²	33	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-40.9	177.4	0	0	0	0	0	113.8	I138 I139 I144 W145 M146	I138-G142 PolarHBondContact O-N 3.4Å; I139-G142 CarbonylContact O-C 3.53Å; I139-G142 PolarHBondContact O-N 3.17Å; G142-I144 PolarHBondContact O-N 2.98Å; G142-W145 WeakPolarHBondContact O-CB 3.37Å; G142-W145 PolarHBondContact O-N 3.25Å; G142-M146 WeakPolarHBondContact O-CE 3.41Å; G142-M146 WeakPolarHBondContact O-CG 3.37Å; G142-M146 PolarHBondContact O-N 3.03Å
143	R	86.9	Confident	81.2	Confident	13 Å²	13	35.1 Å²	35.1	5%	0.049	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-44.6	175.1	-81.9	177.4	162.4	170.4	-3.6	112.5	G78 A79 F99 D100 I139 R140 K141 W145 M146 H147 F481	G78-R143 VanDerWaalsContact C-NH1 3.27Å; G78-R143 PolarHBondContact O-NH1 3.05Å; A79-R143 PolarHBondContact O-NH2 3.09Å; F99-R143 VanDerWaalsContact CB-NH2 3.34Å; F99-R143 HydrophobicContact CD2-CG 4.05Å; F99-R143 HydrophobicContact CE2-CG 4.19Å; D100-R143 VanDerWaalsContact N-NH2 3.18Å; D100-R143 PolarHBondContact O-NE 2.98Å; D100-R143 PolarHBondContact O-NH2 3.16Å; I139-R143 HydrophobicContact CG2-CG 4.36Å; I139-R143 WeakPolarHBondContact O-CB 3.49Å; I139-R143 WeakPolarHBondContact O-CG 3.35Å; I139-R143 PolarHBondContact O-N 3.27Å; R140-R143 PolarHBondContact O-N 3.02Å; K141-R143 PolarHBondContact O-N 3.36Å; R143-W145 VanDerWaalsContact C-N 3.34Å; R143-M146 HydrophobicContact CG-CE 4.25Å; R143-H147 WeakPolarHBondContact O-CB 3.16Å; R143-H147 PolarHBondContact O-N 2.77Å; R143-F481 VanDerWaalsContact CD-OXT 3.23Å; R143-F481 WeakPolarHBondContact CD-OXT 3.38Å; R143-F481 PolarHBondContact NH1-OXT 3.12Å
144	I	83	Confident	79.6	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-64.7	-43	176.4	-62	168.8	0	0	0	110.1	R140 K141 G142 H147 K148 L336 F339 W340 F481	R140-I144 PolarHBondContact O-N 3.04Å; K141-I144 PolarHBondContact O-N 2.71Å; G142-I144 PolarHBondContact O-N 2.98Å; I144-H147 PolarHBondContact O-N 3.48Å; I144-K148 PolarHBondContact O-N 2.9Å; I144-L336 HydrophobicContact CD1-CB 4.1Å; I144-L336 HydrophobicContact CD1-CD2 3.57Å; I144-L336 HydrophobicContact CD1-CG 4.39Å; I144-F339 HydrophobicContact CB-CD1 3.8Å; I144-F339 HydrophobicContact CB-CE1 4.1Å; I144-F339 HydrophobicContact CD1-CD1 4.12Å; I144-F339 HydrophobicContact CG2-CD1 3.49Å; I144-F339 VanDerWaalsContact CG2-CD1 3.49Å; I144-F339 HydrophobicContact CG2-CE1 4Å; I144-W340 HydrophobicContact CG2-CE3 3.99Å; I144-F481 HydrophobicContact CG1-CD1 4.25Å; I144-F481 HydrophobicContact CG1-CG 4.39Å
145	W	82.4	Confident	78	Confident	33 Å²	33	42.6 Å²	42.6	13%	0.125	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-52.8	177	-164.7	-78.1	0	0	0	112.2	K141 G142 R143 H147 K148 E149 M175 F339 D345 M348	K141-W145 PolarHBondContact O-N 3.49Å; G142-W145 WeakPolarHBondContact O-CB 3.37Å; G142-W145 PolarHBondContact O-N 3.25Å; R143-W145 VanDerWaalsContact C-N 3.34Å; W145-H147 VanDerWaalsContact C-N 3.25Å; W145-H147 PolarHBondContact O-N 3Å; W145-K148 PolarHBondContact O-N 3.01Å; W145-K148 VanDerWaalsContact O-N 3.11Å; W145-E149 PolarHBondContact NE1-OE1 3.26Å; W145-E149 PolarHBondContact O-N 3.18Å; W145-E149 VanDerWaalsContact O-N 3.11Å; W145-M175 HydrophobicContact CB-CE 4.29Å; W145-M175 HydrophobicContact CD2-CG 4.45Å; W145-M175 HydrophobicContact CE3-CG 4.23Å; W145-F339 HydrophobicContact CE3-CE1 4.24Å; W145-F339 AromaticContact CE3-CZ 3.71Å; W145-F339 HydrophobicContact CE3-CZ 3.71Å; W145-F339 HydrophobicContact CZ3-CZ 4.09Å; W145-D345 VanDerWaalsContact CH2-OD1 3.23Å; W145-D345 WeakPolarHBondContact CH2-OD1 3.1Å; W145-D345 WeakPolarHBondContact CZ2-OD1 3.46Å; W145-M348 HydrophobicContact CD2-CE 3.98Å; W145-M348 HydrophobicContact CE3-CE 3.17Å; W145-M348 HydrophobicContact CE3-SD 4.33Å; W145-M348 HydrophobicContact CH2-CB 4.33Å; W145-M348 HydrophobicContact CH2-CE 4.06Å; W145-M348 HydrophobicContact CH2-SD 4.2Å; W145-M348 HydrophobicContact CZ3-CB 3.76Å; W145-M348 HydrophobicContact CZ3-CE 3.24Å; W145-M348 HydrophobicContact CZ3-CG 4.38Å; W145-M348 HydrophobicContact CZ3-SD 3.86Å
146	M	82	Confident	76.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.1	-39.2	177.8	-71	-177.3	-77.3	0	0	112	F99 N102 W103 Y110 G142 R143 K148 R150 I172	F99-M146 HydrophobicContact CE2-CE 3.59Å; F99-M146 HydrophobicContact CZ-CE 4.21Å; N102-M146 CarbonylContact O-C 3.57Å; N102-M146 VanDerWaalsContact O-CB 3.3Å; N102-M146 WeakPolarHBondContact O-CB 3.3Å; W103-M146 HydrophobicContact CB-CB 4.31Å; W103-M146 HydrophobicContact CB-CG 4.18Å; W103-M146 HydrophobicContact CB-SD 4.1Å; W103-M146 HydrophobicContact CG-CG 4.27Å; Y110-M146 HydrophobicContact CE2-SD 4.29Å; G142-M146 WeakPolarHBondContact O-CE 3.41Å; G142-M146 WeakPolarHBondContact O-CG 3.37Å; G142-M146 PolarHBondContact O-N 3.03Å; R143-M146 HydrophobicContact CG-CE 4.25Å; M146-K148 PolarHBondContact O-N 3.22Å; M146-R150 PolarHBondContact O-N 3.47Å; M146-I172 HydrophobicContact CE-CD1 4.04Å; M146-I172 HydrophobicContact CG-CD1 3.41Å; M146-I172 VanDerWaalsContact CG-CD1 3.41Å; M146-I172 HydrophobicContact CG-CG1 4.21Å; M146-I172 HydrophobicContact SD-CD1 3.76Å
147	H	78.8	Confident	74.8	Confident	38 Å²	38	51.8 Å²	51.8	18%	0.176	23%	0.229	C	C	.	.	H	α-helix	trans	-66.2	-37.1	178.3	-167.7	96.2	0	0	0	112.7	R143 I144 W145 R150 Q151 W340	R143-H147 WeakPolarHBondContact O-CB 3.16Å; R143-H147 PolarHBondContact O-N 2.77Å; I144-H147 PolarHBondContact O-N 3.48Å; W145-H147 VanDerWaalsContact C-N 3.25Å; W145-H147 PolarHBondContact O-N 3Å; H147-R150 WeakPolarHBondContact O-CB 3.41Å; H147-R150 PolarHBondContact O-N 2.94Å; H147-Q151 PolarHBondContact NE2-NE2 3.44Å; H147-Q151 PolarHBondContact O-N 3.37Å; H147-W340 HydrophobicContact CB-CZ3 4.2Å; H147-W340 AromaticContact CD2-CH2 3.19Å; H147-W340 WeakPolarHBondContact CD2-CH2 3.38Å; H147-W340 AromaticContact CD2-CZ3 3.42Å; H147-W340 VanDerWaalsContact CD2-CZ3 3.42Å; H147-W340 WeakPolarHBondContact CD2-CZ3 3.4Å; H147-W340 AromaticContact CG-CH2 3.93Å; H147-W340 AromaticContact CG-CZ3 3.81Å; H147-W340 AromaticContact NE2-CH2 3.39Å; H147-W340 WeakPolarHBondContact NE2-CH2 3.41Å
148	K	74.6	Confident	73.5	Confident	17 Å²	17	55.8 Å²	55.8	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-71	-42.9	179.2	-77.9	-170.4	176	-169.8	0	113	I144 W145 M146 R150 Q151 E152 F339 W340 A342 M348	I144-K148 PolarHBondContact O-N 2.9Å; W145-K148 PolarHBondContact O-N 3.01Å; W145-K148 VanDerWaalsContact O-N 3.11Å; M146-K148 PolarHBondContact O-N 3.22Å; K148-R150 PolarHBondContact O-N 3.37Å; K148-R150 VanDerWaalsContact O-N 3.12Å; K148-Q151 PolarHBondContact O-N 3.04Å; K148-E152 PolarHBondContact O-N 3.34Å; K148-E152 VanDerWaalsContact O-N 3.09Å; K148-F339 WeakPolarHBondContact CE-O 3.31Å; K148-F339 PolarHBondContact NZ-O 2.86Å; K148-W340 WeakPolarHBondContact CE-O 3.16Å; K148-A342 PolarHBondContact NZ-O 2.91Å; K148-M348 HydrophobicContact CD-CE 3.71Å; K148-M348 HydrophobicContact CD-SD 3.88Å; K148-M348 PolarHBondContact NZ-SD 3Å
149	E	69.3	Low	71.9	Confident	15 Å²	15	62 Å²	62	7%	0.07	29%	0.288	C	S	.	.	H	α-helix	trans	-53.2	-37	174.4	-78	-176.6	-179.9	0	0	111.1	W103 W145 H153 Q170	W103-E149 VanDerWaalsContact CD1-OE2 3.23Å; W103-E149 PolarHBondContact NE1-OE2 2.75Å; W145-E149 PolarHBondContact NE1-OE1 3.26Å; W145-E149 PolarHBondContact O-N 3.18Å; W145-E149 VanDerWaalsContact O-N 3.11Å; E149-H153 WeakPolarHBondContact O-CB 3.26Å; E149-H153 PolarHBondContact O-N 3.17Å; E149-Q170 VanDerWaalsContact OE1-C 3.29Å; E149-Q170 WeakPolarHBondContact OE1-CB 3.3Å
150	R	65.6	Low	70.2	Confident	105 Å²	105	67.6 Å²	67.6	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-45.3	173	-177.7	-167.9	179.8	-146.4	-1	112.9	N102 M146 H147 K148 H153 F154	N102-R150 WeakPolarHBondContact ND2-CD 3.46Å; M146-R150 PolarHBondContact O-N 3.47Å; H147-R150 WeakPolarHBondContact O-CB 3.41Å; H147-R150 PolarHBondContact O-N 2.94Å; K148-R150 PolarHBondContact O-N 3.37Å; K148-R150 VanDerWaalsContact O-N 3.12Å; R150-H153 PolarHBondContact O-N 2.93Å; R150-F154 VanDerWaalsContact O-CB 3.3Å; R150-F154 WeakPolarHBondContact O-CB 3.3Å; R150-F154 PolarHBondContact O-N 3.47Å
151	Q	61.1	Low	68.4	Low	96 Å²	96	66.7 Å²	66.7	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-45.1	-177.3	-68.3	-171.6	4.1	0	0	111	H147 K148 F154 Q155	H147-Q151 PolarHBondContact NE2-NE2 3.44Å; H147-Q151 PolarHBondContact O-N 3.37Å; K148-Q151 PolarHBondContact O-N 3.04Å; Q151-F154 PolarHBondContact O-N 3.49Å; Q151-Q155 VanDerWaalsContact O-CB 3.29Å; Q151-Q155 WeakPolarHBondContact O-CB 3.43Å; Q151-Q155 PolarHBondContact O-N 3.26Å
152	E	62.5	Low	66.7	Low	95 Å²	95	70.8 Å²	70.8	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-64.4	-43.2	176.9	-66.7	-179.1	-177.2	0	0	111.7	K148 Q155 K156	K148-E152 PolarHBondContact O-N 3.34Å; K148-E152 VanDerWaalsContact O-N 3.09Å; E152-Q155 PolarHBondContact O-N 3.31Å; E152-K156 WeakPolarHBondContact O-CB 3.38Å; E152-K156 PolarHBondContact O-N 3.18Å
153	H	58.2	Low	64.7	Low	60 Å²	60	80.2 Å²	80.2	28%	0.278	40%	0.403	S	S	.	.	H	α-helix	trans	-63.9	-43.7	178	-162.1	70.3	0	0	0	112	E149 R150 K156 I157 M165	E149-H153 WeakPolarHBondContact O-CB 3.26Å; E149-H153 PolarHBondContact O-N 3.17Å; R150-H153 PolarHBondContact O-N 2.93Å; H153-K156 PolarHBondContact O-N 3.2Å; H153-I157 VanDerWaalsContact O-CG1 3.28Å; H153-I157 WeakPolarHBondContact O-CG1 3.41Å; H153-I157 PolarHBondContact O-N 2.93Å; H153-M165 WeakPolarHBondContact NE2-CE 3.45Å
154	F	57.6	Low	62.7	Low	139 Å²	139	90.8 Å²	90.8	61%	0.61	44%	0.443	S	S	*	.	H	α-helix	trans	-64.3	-41.6	176.2	-173	-97.2	0	0	0	111.8	R150 Q151 I157 V158	R150-F154 VanDerWaalsContact O-CB 3.3Å; R150-F154 WeakPolarHBondContact O-CB 3.3Å; R150-F154 PolarHBondContact O-N 3.47Å; Q151-F154 PolarHBondContact O-N 3.49Å; F154-I157 PolarHBondContact O-N 2.92Å; F154-V158 HydrophobicContact CD1-CG2 4.2Å; F154-V158 HydrophobicContact CE1-CG2 3.86Å; F154-V158 HydrophobicContact CZ-CG2 4.08Å; F154-V158 VanDerWaalsContact O-CG2 3.31Å; F154-V158 WeakPolarHBondContact O-CG2 3.45Å; F154-V158 PolarHBondContact O-N 3.41Å; F154-V158 VanDerWaalsContact O-N 3.08Å
155	Q	58.3	Low	60.7	Low	124 Å²	124	96.9 Å²	96.9	58%	0.579	47%	0.472	S	S	*	.	H	α-helix	trans	-66.3	-39	179	-164.8	153.4	5.1	0	0	111.6	Q151 E152 V158 L159	Q151-Q155 VanDerWaalsContact O-CB 3.29Å; Q151-Q155 WeakPolarHBondContact O-CB 3.43Å; Q151-Q155 PolarHBondContact O-N 3.26Å; E152-Q155 PolarHBondContact O-N 3.31Å; Q155-V158 PolarHBondContact O-N 3.45Å; Q155-L159 HydrophobicContact CG-CD1 3.78Å; Q155-L159 WeakPolarHBondContact O-CB 3.38Å; Q155-L159 WeakPolarHBondContact O-CD1 3.36Å; Q155-L159 PolarHBondContact O-N 3.23Å
156	K	59.2	Low	58.7	Low	124 Å²	124	102.7 Å²	102.7	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-41.7	174.7	-163.3	175.3	-175.6	178.9	0	112.6	E152 H153 V158 L159 E160	E152-K156 WeakPolarHBondContact O-CB 3.38Å; E152-K156 PolarHBondContact O-N 3.18Å; H153-K156 PolarHBondContact O-N 3.2Å; K156-V158 PolarHBondContact O-N 3.49Å; K156-L159 PolarHBondContact O-N 2.59Å; K156-E160 WeakPolarHBondContact CE-OE2 3.32Å; K156-E160 HydrophobicContact CG-CG 4.39Å; K156-E160 WeakPolarHBondContact CG-OE2 3.16Å; K156-E160 WeakPolarHBondContact O-CB 3.22Å; K156-E160 PolarHBondContact O-N 3Å
157	I	59.9	Low	56.8	Low	94 Å²	94	109.6 Å²	109.6	48%	0.482	54%	0.538	S	S	.	.	H	α-helix	trans	-61.5	-43.5	175.8	-69.9	166.1	0	0	0	111.4	H153 F154 G161	H153-I157 VanDerWaalsContact O-CG1 3.28Å; H153-I157 WeakPolarHBondContact O-CG1 3.41Å; H153-I157 PolarHBondContact O-N 2.93Å; F154-I157 PolarHBondContact O-N 2.92Å; I157-G161 PolarHBondContact O-N 3.07Å
158	V	59.8	Low	54.9	Low	103 Å²	103	115.3 Å²	115.3	62%	0.624	57%	0.565	S	S	*	*	H	α-helix	trans	-70.4	-32.6	-178.9	174.2	0	0	0	0	112.3	F154 Q155 K156	F154-V158 HydrophobicContact CD1-CG2 4.2Å; F154-V158 HydrophobicContact CE1-CG2 3.86Å; F154-V158 HydrophobicContact CZ-CG2 4.08Å; F154-V158 VanDerWaalsContact O-CG2 3.31Å; F154-V158 WeakPolarHBondContact O-CG2 3.45Å; F154-V158 PolarHBondContact O-N 3.41Å; F154-V158 VanDerWaalsContact O-N 3.08Å; Q155-V158 PolarHBondContact O-N 3.45Å; K156-V158 PolarHBondContact O-N 3.49Å
159	L	57.1	Low	53.5	Low	132 Å²	132	116.4 Å²	116.4	69%	0.691	58%	0.581	S	S	*	*	H	α-helix	trans	-87.4	-35.6	-178.5	-91.8	138.5	0	0	0	114.5	Q155 K156	Q155-L159 HydrophobicContact CG-CD1 3.78Å; Q155-L159 WeakPolarHBondContact O-CB 3.38Å; Q155-L159 WeakPolarHBondContact O-CD1 3.36Å; Q155-L159 PolarHBondContact O-N 3.23Å; K156-L159 PolarHBondContact O-N 2.59Å
160	E	56.8	Low	52.7	Low	119 Å²	119	119.8 Å²	119.8	56%	0.556	60%	0.597	S	S	*	*	H	α-helix	trans	-103.7	-12.4	-169.1	-66.3	-177.1	168.2	0	0	114.7	K156 T162	K156-E160 WeakPolarHBondContact CE-OE2 3.32Å; K156-E160 HydrophobicContact CG-CG 4.39Å; K156-E160 WeakPolarHBondContact CG-OE2 3.16Å; K156-E160 WeakPolarHBondContact O-CB 3.22Å; K156-E160 PolarHBondContact O-N 3Å; E160-T162 PolarHBondContact O-N 3.38Å; E160-T162 PolarHBondContact O-OG1 2.85Å
161	G	51.3	Low	53	Low	70 Å²	70	117.3 Å²	117.3	72%	0.722	60%	0.596	S	S	*	*			trans	58.6	13.5	169.3	0	0	0	0	0	116.7	I157	I157-G161 PolarHBondContact O-N 3.07Å
162	T	48.3	Very low	54.1	Low	106 Å²	106	112.8 Å²	112.8	65%	0.65	57%	0.574	S	S	*	*			trans	-104	114	-174.5	-12.2	0	0	0	0	112	E160 R164	E160-T162 PolarHBondContact O-N 3.38Å; E160-T162 PolarHBondContact O-OG1 2.85Å; T162-R164 PolarHBondContact O-N 3.16Å
163	E	47	Very low	55.3	Low	199 Å²	199	109.1 Å²	109.1	93%	0.93	56%	0.558	S	S	*	*			trans	-74.2	29.9	175.5	-65.7	-173.8	147.5	0	0	114.4
164	R	44.1	Very low	56.7	Low	235 Å²	235	110.5 Å²	110.5	89%	0.887	57%	0.572	S	S	*	*			trans	-120.2	78.3	176.4	-70.3	-170.4	-178.5	-177	1.6	110.5	T162 E166	T162-R164 PolarHBondContact O-N 3.16Å; R164-E166 PolarHBondContact O-N 3.3Å
165	M	40.9	Very low	58.1	Low	130 Å²	130	105.4 Å²	105.4	64%	0.64	55%	0.551	S	S	*	*			trans	-72.3	97.1	168.1	-76.8	169.8	67.2	0	0	109.1	H153	H153-M165 WeakPolarHBondContact NE2-CE 3.45Å
166	E	40.2	Very low	59.8	Low	155 Å²	155	99.8 Å²	99.8	72%	0.724	52%	0.524	S	S	*	.			trans	-72.2	133.7	144.4	-75.4	-174.6	178.6	0	0	107	R164 Q168	R164-E166 PolarHBondContact O-N 3.3Å; E166-Q168 HydrophobicContact CB-CG 4.31Å; E166-Q168 PolarHBondContact O-N 3.41Å; E166-Q168 PolarHBondContact OE2-NE2 3.13Å
167	D	42.7	Very low	61.3	Low	146 Å²	146	95.1 Å²	95.1	78%	0.781	51%	0.506	S	S	*	.	S	Bend	trans	-67	46.5	-174.6	-139.8	10	0	0	0	112.1	G169	D167-G169 VanDerWaalsContact C-N 3.27Å; D167-G169 PolarHBondContact O-N 3.36Å
168	Q	39.1	Very low	62.7	Low	157 Å²	157	93 Å²	93	73%	0.734	51%	0.508	S	S	*	.			trans	-94.7	33.3	177.3	-59.1	-173.2	14.6	0	0	111	E166 Q170	E166-Q168 HydrophobicContact CB-CG 4.31Å; E166-Q168 PolarHBondContact O-N 3.41Å; E166-Q168 PolarHBondContact OE2-NE2 3.13Å; Q168-Q170 PolarHBondContact O-N 3.05Å
169	G	44.2	Very low	64.2	Low	41 Å²	41	89.5 Å²	89.5	42%	0.423	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-58.8	134.4	160	0	0	0	0	0	107.9	D167 S171	D167-G169 VanDerWaalsContact C-N 3.27Å; D167-G169 PolarHBondContact O-N 3.36Å; G169-S171 PolarHBondContact O-N 3.21Å
170	Q	53.7	Low	66	Low	86 Å²	86	83.5 Å²	83.5	40%	0.402	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-51.5	134.1	170.2	-74.8	178.1	-19.1	0	0	108	E149 Q168 D345	E149-Q170 VanDerWaalsContact OE1-C 3.29Å; E149-Q170 WeakPolarHBondContact OE1-CB 3.3Å; Q168-Q170 PolarHBondContact O-N 3.05Å; Q170-D345 PolarHBondContact NE2-OD2 3.45Å
171	S	70.6	Confident	67.7	Low	52 Å²	52	80 Å²	80	36%	0.364	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-87.9	129.5	-177	-175.7	0	0	0	0	107.4	G169 I173 P174	G169-S171 PolarHBondContact O-N 3.21Å; S171-I173 PolarHBondContact O-N 3.32Å; S171-I173 VanDerWaalsContact O-N 3.08Å; S171-I173 WeakPolarHBondContact OG-CB 3.15Å; S171-I173 VanDerWaalsContact OG-CG1 3.26Å; S171-I173 WeakPolarHBondContact OG-CG1 3.49Å; S171-I173 PolarHBondContact OG-N 3.45Å; S171-P174 WeakPolarHBondContact O-CD 3.24Å
172	I	83.9	Confident	69.6	Low	1 Å²	1	78.2 Å²	78.2	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-59	-18.5	169.7	-160.7	-166.1	0	0	0	112	F30 W103 M146 M175 L176	F30-I172 HydrophobicContact CE1-CG2 3.98Å; F30-I172 HydrophobicContact CZ-CG2 4.48Å; W103-I172 HydrophobicContact CH2-CG2 4.46Å; W103-I172 HydrophobicContact CZ2-CG2 4.29Å; M146-I172 HydrophobicContact CE-CD1 4.04Å; M146-I172 HydrophobicContact CG-CD1 3.41Å; M146-I172 VanDerWaalsContact CG-CD1 3.41Å; M146-I172 HydrophobicContact CG-CG1 4.21Å; M146-I172 HydrophobicContact SD-CD1 3.76Å; I172-M175 HydrophobicContact CD1-CE 4.24Å; I172-M175 HydrophobicContact CG1-CE 3.86Å; I172-M175 PolarHBondContact O-N 2.87Å; I172-L176 HydrophobicContact CD1-CD1 4.08Å; I172-L176 HydrophobicContact CD1-CD2 4.49Å; I172-L176 HydrophobicContact CD1-CG 4.19Å; I172-L176 HydrophobicContact CG1-CD1 4.35Å; I172-L176 HydrophobicContact CG1-CG 4.18Å; I172-L176 HydrophobicContact CG2-CD1 4.19Å; I172-L176 WeakPolarHBondContact O-CG 3.24Å; I172-L176 PolarHBondContact O-N 3.48Å
173	I	88.6	Confident	71.7	Confident	19 Å²	19	73.3 Å²	73.3	10%	0.097	38%	0.384	C	S	.	.	H	α-helix	trans	-60.1	-48.5	-174.5	-59.7	-55.2	0	0	0	112.8	F30 H43 W45 S171 M175 L176 T177	F30-I173 HydrophobicContact CD1-CD1 3.83Å; F30-I173 HydrophobicContact CE1-CD1 4.5Å; H43-I173 HydrophobicContact CB-CD1 3.59Å; H43-I173 HydrophobicContact CB-CG1 4.25Å; H43-I173 HydrophobicContact CB-CG2 4.27Å; W45-I173 HydrophobicContact CH2-CD1 4.44Å; W45-I173 HydrophobicContact CZ2-CG2 4.17Å; S171-I173 PolarHBondContact O-N 3.32Å; S171-I173 VanDerWaalsContact O-N 3.08Å; S171-I173 WeakPolarHBondContact OG-CB 3.15Å; S171-I173 VanDerWaalsContact OG-CG1 3.26Å; S171-I173 WeakPolarHBondContact OG-CG1 3.49Å; S171-I173 PolarHBondContact OG-N 3.45Å; I173-M175 VanDerWaalsContact C-N 3.34Å; I173-M175 PolarHBondContact O-N 2.75Å; I173-L176 PolarHBondContact O-N 3.13Å; I173-T177 VanDerWaalsContact O-CB 3.31Å; I173-T177 WeakPolarHBondContact O-CB 3.48Å; I173-T177 PolarHBondContact O-N 2.88Å; I173-T177 PolarHBondContact O-OG1 3.41Å
174	P	87.8	Confident	74	Confident	89 Å²	89	64 Å²	64	58%	0.578	34%	0.34	S	S	*	.	H	α-helix	trans	-49	-48	170.6	-28.9	22.2	0	0	0	114.8	S171 T177 G178	S171-P174 WeakPolarHBondContact O-CD 3.24Å; P174-T177 WeakPolarHBondContact O-CB 3.16Å; P174-T177 PolarHBondContact O-N 3.03Å; P174-G178 PolarHBondContact O-N 2.97Å; P174-G178 VanDerWaalsContact O-N 3.1Å
175	M	87.9	Confident	76.3	Confident	32 Å²	32	57.2 Å²	57.2	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-48	178.9	-175.3	-75.4	-65	0	0	110.8	W145 I172 I173 T177 G178 E179	W145-M175 HydrophobicContact CB-CE 4.29Å; W145-M175 HydrophobicContact CD2-CG 4.45Å; W145-M175 HydrophobicContact CE3-CG 4.23Å; I172-M175 HydrophobicContact CD1-CE 4.24Å; I172-M175 HydrophobicContact CG1-CE 3.86Å; I172-M175 PolarHBondContact O-N 2.87Å; I173-M175 VanDerWaalsContact C-N 3.34Å; I173-M175 PolarHBondContact O-N 2.75Å; M175-T177 VanDerWaalsContact C-N 3.26Å; M175-T177 PolarHBondContact O-N 3.39Å; M175-G178 PolarHBondContact O-N 3.39Å; M175-E179 PolarHBondContact O-N 3.26Å; M175-E179 HydrophobicContact SD-CG 4.14Å
176	L	91.9	Very high	78.8	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-35.3	175.3	-68.5	179.6	0	0	0	112.1	F30 W45 I138 I172 I173 E179 V180	F30-L176 HydrophobicContact CB-CD1 4.45Å; F30-L176 HydrophobicContact CD1-CD1 4.09Å; F30-L176 HydrophobicContact CD2-CD1 3.98Å; F30-L176 HydrophobicContact CE1-CD1 4.3Å; F30-L176 HydrophobicContact CE2-CD1 4.2Å; F30-L176 HydrophobicContact CG-CD1 3.92Å; F30-L176 HydrophobicContact CZ-CD1 4.35Å; W45-L176 HydrophobicContact CH2-CB 3.74Å; W45-L176 HydrophobicContact CH2-CD1 3.99Å; W45-L176 HydrophobicContact CZ2-CB 3.72Å; I138-L176 HydrophobicContact CG2-CD2 3.81Å; I172-L176 HydrophobicContact CD1-CD1 4.08Å; I172-L176 HydrophobicContact CD1-CD2 4.49Å; I172-L176 HydrophobicContact CD1-CG 4.19Å; I172-L176 HydrophobicContact CG1-CD1 4.35Å; I172-L176 HydrophobicContact CG1-CG 4.18Å; I172-L176 HydrophobicContact CG2-CD1 4.19Å; I172-L176 WeakPolarHBondContact O-CG 3.24Å; I172-L176 PolarHBondContact O-N 3.48Å; I173-L176 PolarHBondContact O-N 3.13Å; L176-E179 PolarHBondContact O-N 2.75Å; L176-E179 VanDerWaalsContact O-N 3.15Å; L176-V180 WeakPolarHBondContact O-CB 3.49Å; L176-V180 VanDerWaalsContact O-CG2 3.24Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 3.25Å
177	T	91.6	Very high	81.3	Confident	26 Å²	26	43.9 Å²	43.9	16%	0.16	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-44.1	178.6	-59	0	0	0	0	110.7	W45 I173 P174 M175 E179 I181	W45-T177 PolarHBondContact NE1-OG1 2.92Å; I173-T177 VanDerWaalsContact O-CB 3.31Å; I173-T177 WeakPolarHBondContact O-CB 3.48Å; I173-T177 PolarHBondContact O-N 2.88Å; I173-T177 PolarHBondContact O-OG1 3.41Å; P174-T177 WeakPolarHBondContact O-CB 3.16Å; P174-T177 PolarHBondContact O-N 3.03Å; M175-T177 VanDerWaalsContact C-N 3.26Å; M175-T177 PolarHBondContact O-N 3.39Å; T177-E179 PolarHBondContact O-N 2.99Å; T177-I181 HydrophobicContact CG2-CD1 3.67Å; T177-I181 HydrophobicContact CG2-CG1 4.36Å; T177-I181 WeakPolarHBondContact O-CD1 3.28Å; T177-I181 VanDerWaalsContact O-CG1 3.28Å; T177-I181 WeakPolarHBondContact O-CG1 3.41Å; T177-I181 PolarHBondContact O-N 2.73Å
178	G	90.3	Very high	83.7	Confident	50 Å²	50	37.1 Å²	37.1	52%	0.515	22%	0.219	S	C	.	.	H	α-helix	trans	-62.6	-22	175.5	0	0	0	0	0	114.2	P174 M175 P182	P174-G178 PolarHBondContact O-N 2.97Å; P174-G178 VanDerWaalsContact O-N 3.1Å; M175-G178 PolarHBondContact O-N 3.39Å; G178-P182 WeakPolarHBondContact O-CD 3.41Å; G178-P182 WeakPolarHBondContact O-CG 3.49Å
179	E	91.1	Very high	86.3	Confident	30 Å²	30	30 Å²	30	14%	0.14	19%	0.187	C	C	.	.	H	α-helix	trans	-101.1	-32.4	-178	-69.6	-68.6	177.4	0	0	113.8	I138 K141 M175 L176 T177 P182	I138-E179 HydrophobicContact CB-CB 4.38Å; I138-E179 HydrophobicContact CD1-CB 3.79Å; I138-E179 WeakPolarHBondContact CD1-O 3.34Å; I138-E179 HydrophobicContact CG1-CB 3.76Å; I138-E179 HydrophobicContact CG1-CG 4.3Å; I138-E179 HydrophobicContact CG2-CB 3.76Å; I138-E179 HydrophobicContact CG2-CG 4.33Å; K141-E179 IonicContact NZ-OE1 3.94Å; K141-E179 PolarHBondContact NZ-OE1 3.19Å; M175-E179 PolarHBondContact O-N 3.26Å; M175-E179 HydrophobicContact SD-CG 4.14Å; L176-E179 PolarHBondContact O-N 2.75Å; L176-E179 VanDerWaalsContact O-N 3.15Å; T177-E179 PolarHBondContact O-N 2.99Å; E179-P182 WeakPolarHBondContact O-CD 3.32Å
180	V	93.4	Very high	88.7	Confident	5 Å²	5	28 Å²	28	3%	0.03	17%	0.167	C	C	.	.	H	α-helix	trans	-73.8	-40.6	177.9	169.5	0	0	0	0	111.1	A28 W45 L112 L176 V183 M184	A28-V180 HydrophobicContact CB-CG1 3.89Å; W45-V180 HydrophobicContact CB-CG1 4.21Å; W45-V180 HydrophobicContact CD2-CB 4.4Å; W45-V180 HydrophobicContact CD2-CG1 4.1Å; W45-V180 HydrophobicContact CD2-CG2 4.46Å; W45-V180 HydrophobicContact CE3-CG1 4.2Å; W45-V180 HydrophobicContact CE3-CG2 4.25Å; W45-V180 HydrophobicContact CG-CG1 4.12Å; W45-V180 HydrophobicContact CH2-CG2 4.45Å; W45-V180 HydrophobicContact CZ3-CG2 4.23Å; L112-V180 HydrophobicContact CD1-CG2 4.37Å; L176-V180 WeakPolarHBondContact O-CB 3.49Å; L176-V180 VanDerWaalsContact O-CG2 3.24Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 3.25Å; V180-V183 WeakPolarHBondContact O-CB 3.43Å; V180-V183 PolarHBondContact O-N 3.06Å; V180-M184 HydrophobicContact CG1-CG 4.2Å; V180-M184 HydrophobicContact CG1-SD 4.05Å; V180-M184 WeakPolarHBondContact O-CG 3.49Å; V180-M184 PolarHBondContact O-N 3.25Å; V180-M184 VanDerWaalsContact O-N 3.09Å
181	I	92.6	Very high	90.5	Very high	45 Å²	45	27.5 Å²	27.5	23%	0.231	16%	0.163	C	C	.	.	H	α-helix	trans	-54.8	-49.6	179.9	-70.7	168.6	0	0	0	111.7	I17 T177 V183 M184 E185	I17-I181 HydrophobicContact CD1-CG1 3.77Å; I17-I181 HydrophobicContact CG1-CG1 4.18Å; I17-I181 HydrophobicContact CG2-CG1 4.31Å; T177-I181 HydrophobicContact CG2-CD1 3.67Å; T177-I181 HydrophobicContact CG2-CG1 4.36Å; T177-I181 WeakPolarHBondContact O-CD1 3.28Å; T177-I181 VanDerWaalsContact O-CG1 3.28Å; T177-I181 WeakPolarHBondContact O-CG1 3.41Å; T177-I181 PolarHBondContact O-N 2.73Å; I181-V183 VanDerWaalsContact C-N 3.26Å; I181-V183 PolarHBondContact O-N 3.03Å; I181-M184 WeakPolarHBondContact O-CA 3.25Å; I181-M184 WeakPolarHBondContact O-CB 3.41Å; I181-M184 PolarHBondContact O-N 2.91Å; I181-E185 HydrophobicContact CG2-CG 4.24Å; I181-E185 WeakPolarHBondContact O-CG 3.48Å; I181-E185 PolarHBondContact O-N 3.35Å
182	P	91.8	Very high	91.5	Very high	34 Å²	34	28.1 Å²	28.1	22%	0.221	17%	0.167	C	C	.	.	H	α-helix	trans	-54.9	-36.5	174.8	-28.9	34.3	0	0	0	114.5	G178 E179 E185 L186	G178-P182 WeakPolarHBondContact O-CD 3.41Å; G178-P182 WeakPolarHBondContact O-CG 3.49Å; E179-P182 WeakPolarHBondContact O-CD 3.32Å; P182-E185 PolarHBondContact O-N 2.89Å; P182-L186 WeakPolarHBondContact O-CB 3.41Å; P182-L186 PolarHBondContact O-N 3.48Å
183	V	93.4	Very high	92	Very high	3 Å²	3	30 Å²	30	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-38.8	176.6	-178.8	0	0	0	0	111.1	I114 R134 I138 V180 I181 L186 L187	I114-V183 HydrophobicContact CD1-CG1 3.79Å; R134-V183 HydrophobicContact CB-CG2 4.47Å; R134-V183 HydrophobicContact CG-CG2 3.63Å; I138-V183 HydrophobicContact CD1-CG2 3.91Å; V180-V183 WeakPolarHBondContact O-CB 3.43Å; V180-V183 PolarHBondContact O-N 3.06Å; I181-V183 VanDerWaalsContact C-N 3.26Å; I181-V183 PolarHBondContact O-N 3.03Å; V183-L186 PolarHBondContact O-N 3.49Å; V183-L187 PolarHBondContact O-N 3.42Å; V183-L187 VanDerWaalsContact O-N 3.12Å
184	M	94	Very high	92.3	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-67.5	-41.4	175.8	-58.1	-174.9	66.1	0	0	111.6	I17 L19 L25 W45 P47 V180 I181 L187 S188	I17-M184 HydrophobicContact CD1-CE 4.1Å; I17-M184 HydrophobicContact CD1-SD 3.36Å; I17-M184 WeakPolarHBondContact CD1-SD 3.37Å; L19-M184 HydrophobicContact CD1-CB 4.14Å; L19-M184 HydrophobicContact CD1-CE 4.3Å; L19-M184 HydrophobicContact CD2-CB 4.17Å; L25-M184 HydrophobicContact CD1-CB 3.92Å; L25-M184 HydrophobicContact CD1-CE 4.05Å; L25-M184 HydrophobicContact CD1-CG 3.56Å; W45-M184 HydrophobicContact CB-SD 4.3Å; P47-M184 HydrophobicContact CB-CE 4.3Å; P47-M184 HydrophobicContact CG-CE 4.44Å; V180-M184 HydrophobicContact CG1-CG 4.2Å; V180-M184 HydrophobicContact CG1-SD 4.05Å; V180-M184 WeakPolarHBondContact O-CG 3.49Å; V180-M184 PolarHBondContact O-N 3.25Å; V180-M184 VanDerWaalsContact O-N 3.09Å; I181-M184 WeakPolarHBondContact O-CA 3.25Å; I181-M184 WeakPolarHBondContact O-CB 3.41Å; I181-M184 PolarHBondContact O-N 2.91Å; M184-L187 PolarHBondContact O-N 3.38Å; M184-S188 PolarHBondContact O-N 2.88Å
185	E	92.1	Very high	92.6	Very high	94 Å²	94	26.9 Å²	26.9	44%	0.439	16%	0.158	S	C	.	.	H	α-helix	trans	-62.9	-42.6	174.4	-70.4	179.9	159.9	0	0	112	L19 I181 P182 L187 S188 S189	L19-E185 HydrophobicContact CD2-CG 3.79Å; I181-E185 HydrophobicContact CG2-CG 4.24Å; I181-E185 WeakPolarHBondContact O-CG 3.48Å; I181-E185 PolarHBondContact O-N 3.35Å; P182-E185 PolarHBondContact O-N 2.89Å; E185-L187 PolarHBondContact O-N 2.85Å; E185-S188 PolarHBondContact O-N 2.9Å; E185-S189 WeakPolarHBondContact O-CB 3.5Å; E185-S189 PolarHBondContact O-N 2.84Å
186	L	93.1	Very high	92.9	Very high	5 Å²	5	29 Å²	29	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-55	-53.7	173.7	167.3	63.2	0	0	0	110.5	V130 P182 V183 S188 S189 M190 E275 L278	V130-L186 HydrophobicContact CG1-CD2 3.98Å; P182-L186 WeakPolarHBondContact O-CB 3.41Å; P182-L186 PolarHBondContact O-N 3.48Å; V183-L186 PolarHBondContact O-N 3.49Å; L186-S188 PolarHBondContact O-N 3.09Å; L186-S189 PolarHBondContact O-N 2.95Å; L186-S189 VanDerWaalsContact O-N 3.13Å; L186-S189 PolarHBondContact O-OG 2.8Å; L186-M190 HydrophobicContact CD1-CG 3.94Å; L186-M190 WeakPolarHBondContact O-CG 3.32Å; L186-M190 PolarHBondContact O-N 2.78Å; L186-E275 HydrophobicContact CD1-CB 4.17Å; L186-E275 HydrophobicContact CD1-CG 3.82Å; L186-L278 HydrophobicContact CD1-CD1 4.22Å; L186-L278 HydrophobicContact CD1-CD2 4.33Å
187	L	94.2	Very high	92.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-39	-178.4	-71.6	176.7	0	0	0	112.5	P24 L25 F123 L127 V183 M184 E185 S189 M190 K191	P24-L187 HydrophobicContact CG-CB 3.88Å; L25-L187 HydrophobicContact CD1-CD1 4.02Å; L25-L187 HydrophobicContact CD2-CD1 3.59Å; L25-L187 HydrophobicContact CG-CD1 4.04Å; F123-L187 HydrophobicContact CE1-CD2 4.31Å; F123-L187 HydrophobicContact CZ-CD2 4.4Å; F123-L187 WeakPolarHBondContact CZ-O 3.41Å; L127-L187 HydrophobicContact CB-CD2 4.49Å; L127-L187 HydrophobicContact CD1-CD2 3.77Å; V183-L187 PolarHBondContact O-N 3.42Å; V183-L187 VanDerWaalsContact O-N 3.12Å; M184-L187 PolarHBondContact O-N 3.38Å; E185-L187 PolarHBondContact O-N 2.85Å; L187-S189 VanDerWaalsContact C-N 3.35Å; L187-S189 PolarHBondContact O-N 2.9Å; L187-M190 PolarHBondContact O-N 2.87Å; L187-K191 PolarHBondContact O-N 3.4Å
188	S	93.1	Very high	93	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-43.6	172	-173.6	0	0	0	0	112.1	N20 E22 M184 E185 L186 M190 K191 S192	N20-S188 PolarHBondContact O-OG 3.2Å; E22-S188 PolarHBondContact O-OG 3.13Å; M184-S188 PolarHBondContact O-N 2.88Å; E185-S188 PolarHBondContact O-N 2.9Å; L186-S188 PolarHBondContact O-N 3.09Å; S188-M190 PolarHBondContact O-N 3.27Å; S188-K191 PolarHBondContact O-N 3.36Å; S188-S192 PolarHBondContact O-N 3.33Å; S188-S192 PolarHBondContact O-OG 2.71Å
189	S	92.7	Very high	93.2	Very high	8 Å²	8	38.6 Å²	38.6	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-65.9	-37.9	178.7	78.6	0	0	0	0	112.3	E185 L186 L187 S192 H193 R264	E185-S189 WeakPolarHBondContact O-CB 3.5Å; E185-S189 PolarHBondContact O-N 2.84Å; L186-S189 PolarHBondContact O-N 2.95Å; L186-S189 VanDerWaalsContact O-N 3.13Å; L186-S189 PolarHBondContact O-OG 2.8Å; L187-S189 VanDerWaalsContact C-N 3.35Å; L187-S189 PolarHBondContact O-N 2.9Å; S189-S192 PolarHBondContact O-N 3.09Å; S189-S192 PolarHBondContact O-OG 3.36Å; S189-H193 PolarHBondContact O-N 2.81Å; S189-R264 WeakPolarHBondContact OG-CD 3.41Å; S189-R264 PolarHBondContact OG-NH1 2.67Å
190	M	94.4	Very high	93.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-35.4	177.3	-67.6	-52.9	-70.4	0	0	111.7	F123 L127 L186 L187 S188 S192 S194 K261 R264 L278	F123-M190 HydrophobicContact CE2-CB 3.97Å; F123-M190 HydrophobicContact CZ-CB 4.01Å; L127-M190 HydrophobicContact CD1-CB 3.76Å; L127-M190 HydrophobicContact CD1-CG 4.03Å; L127-M190 HydrophobicContact CD2-CE 3.78Å; L127-M190 HydrophobicContact CD2-CG 4.18Å; L186-M190 HydrophobicContact CD1-CG 3.94Å; L186-M190 WeakPolarHBondContact O-CG 3.32Å; L186-M190 PolarHBondContact O-N 2.78Å; L187-M190 PolarHBondContact O-N 2.87Å; S188-M190 PolarHBondContact O-N 3.27Å; M190-S192 PolarHBondContact O-N 3.21Å; M190-S194 WeakPolarHBondContact O-CB 3.44Å; M190-S194 PolarHBondContact O-N 2.76Å; M190-S194 VanDerWaalsContact O-N 3.11Å; M190-S194 PolarHBondContact O-OG 3.02Å; M190-K261 WeakPolarHBondContact CE-O 3.45Å; M190-R264 HydrophobicContact SD-CB 3.86Å; M190-R264 HydrophobicContact SD-CG 4.13Å; M190-L278 HydrophobicContact CE-CD2 3.84Å; M190-L278 HydrophobicContact SD-CD1 3.8Å; M190-L278 HydrophobicContact SD-CD2 3.79Å; M190-L278 HydrophobicContact SD-CG 4.49Å
191	K	92.8	Very high	93.3	Very high	74 Å²	74	42.9 Å²	42.9	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-61.5	-35.8	176	-176.6	61.2	169.2	-172.9	0	112.1	P24 E120 F123 L187 S188	P24-K191 HydrophobicContact CG-CB 4.29Å; E120-K191 IonicContact OE1-NZ 3.48Å; E120-K191 PolarHBondContact OE1-NZ 3.34Å; E120-K191 IonicContact OE2-NZ 2.76Å; E120-K191 PolarHBondContact OE2-NZ 3.46Å; F123-K191 HydrophobicContact CD2-CD 4.3Å; F123-K191 HydrophobicContact CE2-CB 4.11Å; F123-K191 HydrophobicContact CE2-CD 4.34Å; F123-K191 HydrophobicContact CZ-CB 4Å; L187-K191 PolarHBondContact O-N 3.4Å; S188-K191 PolarHBondContact O-N 3.36Å
192	S	90.8	Very high	93.2	Very high	66 Å²	66	43.1 Å²	43.1	46%	0.462	24%	0.235	S	C	.	.	H	α-helix	trans	-96.2	-30.4	-173.9	50	0	0	0	0	114.6	S188 S189 M190	S188-S192 PolarHBondContact O-N 3.33Å; S188-S192 PolarHBondContact O-OG 2.71Å; S189-S192 PolarHBondContact O-N 3.09Å; S189-S192 PolarHBondContact O-OG 3.36Å; M190-S192 PolarHBondContact O-N 3.21Å
193	H	93.8	Very high	93.3	Very high	39 Å²	39	45.3 Å²	45.3	18%	0.181	25%	0.245	C	C	.	.	H	α-helix	trans	-132.2	14.6	-169.8	-59.9	74.6	0	0	0	113.9	S189 R264 L265 R267 F272	S189-H193 PolarHBondContact O-N 2.81Å; H193-R264 HydrophobicContact CB-CG 4.06Å; H193-R264 WeakPolarHBondContact O-CA 3.19Å; H193-L265 PolarHBondContact O-N 3.5Å; H193-R267 WeakPolarHBondContact NE2-CD 3.46Å; H193-F272 HydrophobicContact CB-CE2 4.17Å; H193-F272 HydrophobicContact CB-CZ 4.41Å; H193-F272 AromaticContact CG-CE2 3.95Å; H193-F272 AromaticContact CG-CZ 3.92Å; H193-F272 AromaticContact ND1-CZ 3.74Å
194	S	94.8	Very high	93.3	Very high	39 Å²	39	45.2 Å²	45.2	27%	0.273	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-62	149.9	171.3	51.3	0	0	0	0	111.3	M190 S263	M190-S194 WeakPolarHBondContact O-CB 3.44Å; M190-S194 PolarHBondContact O-N 2.76Å; M190-S194 VanDerWaalsContact O-N 3.11Å; M190-S194 PolarHBondContact O-OG 3.02Å; S194-S263 WeakPolarHBondContact CA-O 3.25Å
195	V	95.8	Very high	93.3	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.03	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-73.7	136	173.3	-176.5	0	0	0	0	109	I199 V248 C252 R260 S263 L265	V195-I199 HydrophobicContact CG1-CD1 3.75Å; V195-I199 HydrophobicContact CG1-CG1 4Å; V195-V248 HydrophobicContact CG2-CG1 4.18Å; V195-C252 HydrophobicContact CG1-CB 4.25Å; V195-R260 WeakPolarHBondContact CB-O 3.4Å; V195-R260 HydrophobicContact CG1-CB 4.41Å; V195-S263 PolarHBondContact N-O 3Å; V195-L265 HydrophobicContact CG2-CD2 3.97Å; V195-L265 HydrophobicContact CG2-CG 3.97Å
196	S	93.4	Very high	93.3	Very high	76 Å²	76	40.8 Å²	40.8	53%	0.531	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-60.3	152.5	175.4	175.8	0	0	0	0	112	E198	S196-E198 VanDerWaalsContact C-N 3.3Å; S196-E198 VanDerWaalsContact CB-O 3.23Å; S196-E198 WeakPolarHBondContact CB-O 3.46Å; S196-E198 PolarHBondContact OG-N 3.04Å; S196-E198 PolarHBondContact OG-O 3.2Å
197	E	92.4	Very high	93.2	Very high	85 Å²	85	42.9 Å²	42.9	40%	0.397	24%	0.235	S	C	.	.	S	Bend	trans	-61.7	-43.1	172.6	-68.3	-175.5	174	0	0	111	P257 R260 K261	E197-P257 HydrophobicContact CB-CB 4.2Å; E197-P257 HydrophobicContact CG-CB 4.35Å; E197-R260 WeakPolarHBondContact O-CD 3.23Å; E197-R260 PolarHBondContact O-NH1 3.47Å; E197-K261 HydrophobicContact CG-CD 3.91Å; E197-K261 HydrophobicContact CG-CG 3.95Å; E197-K261 WeakPolarHBondContact OE1-CD 3.37Å; E197-K261 WeakPolarHBondContact OE1-CE 3.26Å; E197-K261 IonicContact OE1-NZ 3.66Å; E197-K261 PolarHBondContact OE1-NZ 3.32Å
198	E	93.4	Very high	93	Very high	170 Å²	170	45.5 Å²	45.5	79%	0.794	25%	0.249	S	C	*	.	S	Bend	trans	-94.1	122.7	173.9	-64.9	-175.4	176.6	0	0	109.1	S196	S196-E198 VanDerWaalsContact C-N 3.3Å; S196-E198 VanDerWaalsContact CB-O 3.23Å; S196-E198 WeakPolarHBondContact CB-O 3.46Å; S196-E198 PolarHBondContact OG-N 3.04Å; S196-E198 PolarHBondContact OG-O 3.2Å
199	I	94.7	Very high	92.5	Very high	27 Å²	27	51 Å²	51	14%	0.138	28%	0.278	C	S	.	.			trans	-110.9	119.7	175.8	-62.2	175.5	0	0	0	106.4	V195 I201 T204 R249 C252 L253 R260	V195-I199 HydrophobicContact CG1-CD1 3.75Å; V195-I199 HydrophobicContact CG1-CG1 4Å; I199-I201 PolarHBondContact O-N 2.92Å; I199-T204 HydrophobicContact CG2-CG2 4.03Å; I199-R249 HydrophobicContact CG2-CB 4.27Å; I199-C252 HydrophobicContact CD1-CB 3.37Å; I199-L253 HydrophobicContact CB-CD2 3.99Å; I199-L253 HydrophobicContact CG2-CD2 3.76Å; I199-L253 HydrophobicContact CG2-CG 4.34Å; I199-R260 HydrophobicContact CD1-CG 4.13Å
200	D	92.9	Very high	92	Very high	98 Å²	98	56.6 Å²	56.6	52%	0.524	31%	0.307	S	S	.	.			trans	-69.4	126.1	169	-162.5	-21.1	0	0	0	108.8	S202 D203	D200-S202 PolarHBondContact O-N 2.89Å; D200-S202 PolarHBondContact OD1-N 3.08Å; D200-S202 PolarHBondContact OD1-OG 3.2Å; D200-S202 PolarHBondContact OD2-OG 3.22Å; D200-D203 PolarHBondContact O-N 2.99Å
201	I	92.3	Very high	91.3	Very high	28 Å²	28	58 Å²	58	14%	0.144	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-63.6	-24.2	178.5	-161.9	167.3	0	0	0	111	I199 D203 T204 L206 N207 L253 R394	I199-I201 PolarHBondContact O-N 2.92Å; I201-D203 PolarHBondContact O-N 3.46Å; I201-T204 WeakPolarHBondContact O-CB 3.48Å; I201-T204 PolarHBondContact O-N 3.41Å; I201-T204 VanDerWaalsContact O-N 3.12Å; I201-T204 PolarHBondContact O-OG1 2.87Å; I201-L206 HydrophobicContact CD1-CB 4.05Å; I201-L206 HydrophobicContact CD1-CD1 4.43Å; I201-L206 HydrophobicContact CG1-CB 3.99Å; I201-N207 WeakPolarHBondContact O-CB 3.42Å; I201-L253 HydrophobicContact CG1-CD1 4.25Å; I201-R394 HydrophobicContact CD1-CB 3.86Å
202	S	91.3	Very high	90.6	Very high	49 Å²	49	56.6 Å²	56.6	34%	0.343	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-55.9	-30.2	175.9	65.3	0	0	0	0	113.4	D200 T204	D200-S202 PolarHBondContact O-N 2.89Å; D200-S202 PolarHBondContact OD1-N 3.08Å; D200-S202 PolarHBondContact OD1-OG 3.2Å; D200-S202 PolarHBondContact OD2-OG 3.22Å; S202-T204 PolarHBondContact O-N 3.41Å
203	D	93	Very high	89.8	Confident	81 Å²	81	58.4 Å²	58.4	43%	0.433	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-89.7	11.3	-175.3	-62.1	-13.4	0	0	0	112.6	D200 I201	D200-D203 PolarHBondContact O-N 2.99Å; I201-D203 PolarHBondContact O-N 3.46Å
204	T	95.1	Very high	88.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.35	C	S	.	.	S	Bend	trans	-122.4	166.9	-173.4	76.6	0	0	0	0	111.7	I199 I201 S202 L206 N207 K246 R249 T250 L253	I199-T204 HydrophobicContact CG2-CG2 4.03Å; I201-T204 WeakPolarHBondContact O-CB 3.48Å; I201-T204 PolarHBondContact O-N 3.41Å; I201-T204 VanDerWaalsContact O-N 3.12Å; I201-T204 PolarHBondContact O-OG1 2.87Å; S202-T204 PolarHBondContact O-N 3.41Å; T204-L206 PolarHBondContact O-N 3.25Å; T204-L206 PolarHBondContact OG1-N 3.02Å; T204-N207 PolarHBondContact O-N 3.45Å; T204-K246 WeakPolarHBondContact O-CE 3.49Å; T204-R249 HydrophobicContact CG2-CB 3.89Å; T204-T250 WeakPolarHBondContact CB-OG1 3.27Å; T204-L253 HydrophobicContact CG2-CD1 3.79Å; T204-L253 HydrophobicContact CG2-CG 4.16Å
205	V	94.4	Very high	87	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.024	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-64.1	-24.8	175.1	-179.3	0	0	0	0	111.5	N207 D208 L220 K246 I247 T250	V205-N207 PolarHBondContact O-N 3.26Å; V205-N207 VanDerWaalsContact O-N 3.11Å; V205-D208 WeakPolarHBondContact O-CB 3.09Å; V205-D208 PolarHBondContact O-N 3.02Å; V205-L220 HydrophobicContact CB-CD1 4.47Å; V205-L220 HydrophobicContact CG1-CD1 4.23Å; V205-L220 HydrophobicContact CG1-CD2 3.85Å; V205-K246 HydrophobicContact CG2-CD 4.17Å; V205-K246 HydrophobicContact CG2-CG 4.13Å; V205-I247 HydrophobicContact CG2-CD1 3.7Å; V205-T250 HydrophobicContact CB-CG2 4.13Å; V205-T250 HydrophobicContact CG2-CG2 4.47Å; V205-T250 PolarHBondContact N-OG1 3.02Å
206	L	91.6	Very high	86.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-70.3	-6.1	-180	-59.4	-172.3	0	0	0	113.9	I201 T204 T250 L253 L381 I384 F385 R394 L398	I201-L206 HydrophobicContact CD1-CB 4.05Å; I201-L206 HydrophobicContact CD1-CD1 4.43Å; I201-L206 HydrophobicContact CG1-CB 3.99Å; T204-L206 PolarHBondContact O-N 3.25Å; T204-L206 PolarHBondContact OG1-N 3.02Å; L206-T250 HydrophobicContact CG-CG2 4.46Å; L206-L253 HydrophobicContact CD1-CD1 3.62Å; L206-L253 HydrophobicContact CG-CD1 4.19Å; L206-L381 HydrophobicContact CD2-CD2 4.4Å; L206-I384 HydrophobicContact CD1-CD1 4.07Å; L206-I384 HydrophobicContact CD2-CD1 4.46Å; L206-F385 HydrophobicContact CD2-CE2 4.49Å; L206-F385 HydrophobicContact CD2-CZ 4.25Å; L206-R394 WeakPolarHBondContact O-CD 3.24Å; L206-R394 PolarHBondContact O-NH1 3.42Å; L206-L398 HydrophobicContact CD1-CD2 4.45Å
207	N	90.9	Very high	86.1	Confident	48 Å²	48	65.1 Å²	65.1	26%	0.257	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-97.1	-7	172	-167.8	64	0	0	0	113.3	I201 T204 V205 P389	I201-N207 WeakPolarHBondContact O-CB 3.42Å; T204-N207 PolarHBondContact O-N 3.45Å; V205-N207 PolarHBondContact O-N 3.26Å; V205-N207 VanDerWaalsContact O-N 3.11Å; N207-P389 WeakPolarHBondContact OD1-CB 2.79Å
208	D	89.3	Confident	86	Confident	55 Å²	55	62.4 Å²	62.4	29%	0.294	36%	0.358	S	S	.	.	S	Bend	trans	-65.9	141.4	175.6	-62.6	-22.3	0	0	0	109.7	V205 D210 K246 R394	V205-D208 WeakPolarHBondContact O-CB 3.09Å; V205-D208 PolarHBondContact O-N 3.02Å; D208-D210 VanDerWaalsContact C-N 3.27Å; D208-D210 PolarHBondContact O-N 3.12Å; D208-K246 IonicContact OD1-NZ 3.75Å; D208-K246 PolarHBondContact OD1-NZ 3.44Å; D208-K246 IonicContact OD2-NZ 3.55Å; D208-K246 PolarHBondContact OD2-NZ 3Å; D208-R394 PolarHBondContact O-NH1 2.73Å
209	D	82.6	Confident	86.1	Confident	118 Å²	118	54.7 Å²	54.7	63%	0.631	32%	0.322	S	S	*	.	S	Bend	trans	-58.1	-41.9	-173.1	-77.4	-48.3	0	0	0	111.9	P389 R394	D209-P389 WeakPolarHBondContact OD1-CG 3.49Å; D209-R394 PolarHBondContact O-NH2 3.19Å
210	D	81.9	Confident	86.2	Confident	126 Å²	126	53.5 Å²	53.5	67%	0.674	32%	0.316	S	S	*	.	S	Bend	trans	-124.4	156.9	178.8	-67	-42.7	0	0	0	111.5	D208 G212	D208-D210 VanDerWaalsContact C-N 3.27Å; D208-D210 PolarHBondContact O-N 3.12Å; D210-G212 PolarHBondContact O-N 3.13Å; D210-G212 VanDerWaalsContact O-N 3.13Å
211	I	79.8	Confident	86.3	Confident	29 Å²	29	50.3 Å²	50.3	15%	0.149	30%	0.299	C	S	.	.			trans	-68.1	-6.3	176.9	-163.3	159.4	0	0	0	113.6	H216 E217 L220 L381 F385	I211-H216 PolarHBondContact O-CD2 3.26Å; I211-E217 HydrophobicContact CD1-CB 4.46Å; I211-E217 HydrophobicContact CD1-CG 3.82Å; I211-E217 HydrophobicContact CG1-CB 4.29Å; I211-E217 HydrophobicContact CG1-CG 4.18Å; I211-E217 HydrophobicContact CG2-CB 4.27Å; I211-E217 HydrophobicContact CG2-CG 4.25Å; I211-L220 HydrophobicContact CD1-CD2 4.39Å; I211-L220 HydrophobicContact CG1-CD2 4.08Å; I211-L381 HydrophobicContact CD1-CB 3.95Å; I211-F385 HydrophobicContact CB-CD1 4.37Å; I211-F385 HydrophobicContact CB-CD2 3.73Å; I211-F385 HydrophobicContact CB-CE1 4.41Å; I211-F385 HydrophobicContact CB-CE2 3.78Å; I211-F385 HydrophobicContact CB-CG 4.05Å; I211-F385 HydrophobicContact CB-CZ 4.13Å; I211-F385 HydrophobicContact CD1-CD2 3.82Å; I211-F385 HydrophobicContact CD1-CE2 3.62Å; I211-F385 HydrophobicContact CG1-CD2 3.98Å; I211-F385 HydrophobicContact CG1-CE2 3.62Å; I211-F385 HydrophobicContact CG1-CZ 4.09Å
212	G	78	Confident	86.5	Confident	45 Å²	45	51.8 Å²	51.8	46%	0.464	31%	0.307	S	S	.	.			trans	92.1	-167.9	-177.4	0	0	0	0	0	113.9	D210	D210-G212 PolarHBondContact O-N 3.13Å; D210-G212 VanDerWaalsContact O-N 3.13Å
213	D	74.4	Confident	86.8	Confident	105 Å²	105	49.5 Å²	49.5	56%	0.561	29%	0.291	S	S	*	.	S	Bend	trans	-69.6	171.8	175	68.7	15.8	0	0	0	111.8	C215 H216 E217	D213-C215 PolarHBondContact O-N 3.03Å; D213-C215 VanDerWaalsContact O-N 3.09Å; D213-C215 WeakPolarHBondContact OD1-CB 3.49Å; D213-C215 PolarHBondContact OD1-N 2.78Å; D213-C215 VanDerWaalsContact OD1-N 3.16Å; D213-H216 PolarHBondContact O-N 2.85Å; D213-H216 WeakPolarHBondContact OD1-CB 3.15Å; D213-H216 PolarHBondContact OD1-N 3.13Å; D213-E217 PolarHBondContact O-N 3.16Å
214	S	61.9	Low	87	Confident	97 Å²	97	45.7 Å²	45.7	68%	0.678	27%	0.271	S	S	*	.	H	α-helix	trans	-58.8	-26.8	-177.6	57.8	0	0	0	0	113.6	G218	S214-G218 PolarHBondContact O-N 2.94Å; S214-G218 VanDerWaalsContact O-N 3.17Å
215	C	67.9	Low	87.1	Confident	86 Å²	86	45.8 Å²	45.8	58%	0.581	27%	0.271	S	S	*	.	H	α-helix	trans	-74.5	-42.5	177	-66.5	0	0	0	0	110.8	D213 F219	D213-C215 PolarHBondContact O-N 3.03Å; D213-C215 VanDerWaalsContact O-N 3.09Å; D213-C215 WeakPolarHBondContact OD1-CB 3.49Å; D213-C215 PolarHBondContact OD1-N 2.78Å; D213-C215 VanDerWaalsContact OD1-N 3.16Å; C215-F219 WeakPolarHBondContact O-CB 3.31Å; C215-F219 PolarHBondContact O-N 2.82Å
216	H	83	Confident	87.3	Confident	53 Å²	53	45.6 Å²	45.6	25%	0.245	27%	0.27	C	S	.	.	H	α-helix	trans	-68.7	-38.8	176.7	-159.8	57.1	0	0	0	112	I211 D213 F219 L220	I211-H216 PolarHBondContact O-CD2 3.26Å; D213-H216 PolarHBondContact O-N 2.85Å; D213-H216 WeakPolarHBondContact OD1-CB 3.15Å; D213-H216 PolarHBondContact OD1-N 3.13Å; H216-F219 PolarHBondContact O-N 2.81Å; H216-L220 WeakPolarHBondContact O-CB 3.41Å; H216-L220 PolarHBondContact O-N 3.37Å
217	E	87.3	Confident	87.6	Confident	63 Å²	63	45.6 Å²	45.6	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-58.3	-51.8	173.1	-175.1	-166.9	159	0	0	111	I211 D213 F219 L220 L221 K378	I211-E217 HydrophobicContact CD1-CB 4.46Å; I211-E217 HydrophobicContact CD1-CG 3.82Å; I211-E217 HydrophobicContact CG1-CB 4.29Å; I211-E217 HydrophobicContact CG1-CG 4.18Å; I211-E217 HydrophobicContact CG2-CB 4.27Å; I211-E217 HydrophobicContact CG2-CG 4.25Å; D213-E217 PolarHBondContact O-N 3.16Å; E217-F219 VanDerWaalsContact C-N 3.31Å; E217-F219 PolarHBondContact O-N 3.27Å; E217-L220 PolarHBondContact O-N 2.76Å; E217-L221 WeakPolarHBondContact O-CB 3.21Å; E217-L221 PolarHBondContact O-N 2.9Å; E217-K378 IonicContact OE1-NZ 2.96Å
218	G	91.4	Very high	87.9	Confident	28 Å²	28	43.5 Å²	43.5	29%	0.289	26%	0.259	S	S	.	.	H	α-helix	trans	-61.2	-40	178.5	0	0	0	0	0	112.5	S214 N222	S214-G218 PolarHBondContact O-N 2.94Å; S214-G218 VanDerWaalsContact O-N 3.17Å; G218-N222 VanDerWaalsContact O-CB 3.25Å; G218-N222 WeakPolarHBondContact O-CB 3.48Å; G218-N222 PolarHBondContact O-N 3.11Å; G218-N222 PolarHBondContact O-ND2 3.28Å; G218-N222 VanDerWaalsContact O-ND2 3.12Å
219	F	94.9	Very high	88.2	Confident	8 Å²	8	41.5 Å²	41.5	4%	0.035	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-50.4	175.8	170.2	-105.9	0	0	0	112.3	C215 H216 E217 L221 N222 A223 I247 I308 V310 N313 V315	C215-F219 WeakPolarHBondContact O-CB 3.31Å; C215-F219 PolarHBondContact O-N 2.82Å; H216-F219 PolarHBondContact O-N 2.81Å; E217-F219 VanDerWaalsContact C-N 3.31Å; E217-F219 PolarHBondContact O-N 3.27Å; F219-L221 PolarHBondContact O-N 3.5Å; F219-N222 PolarHBondContact O-N 3.07Å; F219-A223 WeakPolarHBondContact O-CB 3.34Å; F219-A223 PolarHBondContact O-N 2.71Å; F219-I247 HydrophobicContact CE1-CD1 4.24Å; F219-I308 HydrophobicContact CE2-CG2 3.76Å; F219-I308 HydrophobicContact CZ-CG2 3.64Å; F219-V310 HydrophobicContact CZ-CG1 4.3Å; F219-N313 HydrophobicContact CB-CB 4.17Å; F219-N313 VanDerWaalsContact CD2-C 3.44Å; F219-N313 HydrophobicContact CD2-CB 3.8Å; F219-N313 WeakPolarHBondContact CD2-O 3.33Å; F219-N313 HydrophobicContact CE2-CB 4.38Å; F219-N313 HydrophobicContact CG-CB 3.97Å; F219-V315 HydrophobicContact CD2-CG2 3.89Å; F219-V315 HydrophobicContact CE2-CG2 3.87Å
220	L	95.4	Very high	88.8	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-42.5	-178.2	-176.4	63.4	0	0	0	111.5	V205 I211 H216 E217 A223 I224 T250 L381 F385	V205-L220 HydrophobicContact CB-CD1 4.47Å; V205-L220 HydrophobicContact CG1-CD1 4.23Å; V205-L220 HydrophobicContact CG1-CD2 3.85Å; I211-L220 HydrophobicContact CD1-CD2 4.39Å; I211-L220 HydrophobicContact CG1-CD2 4.08Å; H216-L220 WeakPolarHBondContact O-CB 3.41Å; H216-L220 PolarHBondContact O-N 3.37Å; E217-L220 PolarHBondContact O-N 2.76Å; L220-A223 PolarHBondContact O-N 2.71Å; L220-I224 HydrophobicContact CD1-CD1 3.81Å; L220-I224 HydrophobicContact CD1-CG1 4.31Å; L220-I224 HydrophobicContact CG-CD1 3.95Å; L220-I224 WeakPolarHBondContact O-CG1 3.04Å; L220-I224 PolarHBondContact O-N 3.29Å; L220-T250 HydrophobicContact CD1-CG2 4.37Å; L220-L381 HydrophobicContact CD2-CD2 4.14Å; L220-L381 HydrophobicContact CG-CD1 4.37Å; L220-L381 HydrophobicContact CG-CD2 4.47Å; L220-F385 HydrophobicContact CD2-CE2 4.23Å; L220-F385 HydrophobicContact CD2-CZ 4.11Å
221	L	95.9	Very high	89.6	Confident	30 Å²	30	30 Å²	30	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-57	-53	173.5	175.4	60.7	0	0	0	110.6	E217 F219 A223 I224 S225 V377 K378 L381	E217-L221 WeakPolarHBondContact O-CB 3.21Å; E217-L221 PolarHBondContact O-N 2.9Å; F219-L221 PolarHBondContact O-N 3.5Å; L221-A223 VanDerWaalsContact C-N 3.32Å; L221-A223 PolarHBondContact O-N 3.32Å; L221-I224 PolarHBondContact O-N 3.29Å; L221-S225 WeakPolarHBondContact O-CB 3.39Å; L221-S225 PolarHBondContact O-N 3.32Å; L221-S225 PolarHBondContact O-OG 3.06Å; L221-V377 HydrophobicContact CD1-CB 4.05Å; L221-V377 HydrophobicContact CD1-CG1 3.87Å; L221-K378 HydrophobicContact CD1-CB 3.95Å; L221-K378 HydrophobicContact CD2-CB 4.3Å; L221-K378 HydrophobicContact CD2-CD 4.46Å; L221-L381 HydrophobicContact CB-CD1 3.96Å; L221-L381 HydrophobicContact CD1-CD1 4.01Å
222	N	96.7	Very high	90.4	Very high	59 Å²	59	28.8 Å²	28.8	32%	0.316	18%	0.181	S	C	.	.	H	α-helix	trans	-62.1	-39.1	-179.2	-76.8	-21.1	0	0	0	112.5	G218 F219 S226 V315 I370	G218-N222 VanDerWaalsContact O-CB 3.25Å; G218-N222 WeakPolarHBondContact O-CB 3.48Å; G218-N222 PolarHBondContact O-N 3.11Å; G218-N222 PolarHBondContact O-ND2 3.28Å; G218-N222 VanDerWaalsContact O-ND2 3.12Å; F219-N222 PolarHBondContact O-N 3.07Å; N222-S226 WeakPolarHBondContact O-CB 3.19Å; N222-S226 PolarHBondContact O-N 3.33Å; N222-V315 HydrophobicContact CB-CB 4.21Å; N222-V315 HydrophobicContact CB-CG2 4.05Å; N222-I370 HydrophobicContact CB-CD1 3.47Å; N222-I370 VanDerWaalsContact CB-CD1 3.47Å
223	A	97.3	Very high	91.3	Very high	2 Å²	2	26.9 Å²	26.9	2%	0.017	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-51.9	179.4	0	0	0	0	0	111.8	F219 L220 L221 H227 I308 V315	F219-A223 WeakPolarHBondContact O-CB 3.34Å; F219-A223 PolarHBondContact O-N 2.71Å; L220-A223 PolarHBondContact O-N 2.71Å; L221-A223 VanDerWaalsContact C-N 3.32Å; L221-A223 PolarHBondContact O-N 3.32Å; A223-H227 WeakPolarHBondContact O-CB 3.32Å; A223-H227 PolarHBondContact O-N 3.19Å; A223-I308 HydrophobicContact CB-CD1 4.03Å; A223-V315 HydrophobicContact CB-CG2 4.19Å
224	I	97.9	Very high	92.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.8	-42.7	-179.2	-65.3	167.5	0	0	0	110.7	L220 L221 H227 L228 L251 F254 V377 L381	L220-I224 HydrophobicContact CD1-CD1 3.81Å; L220-I224 HydrophobicContact CD1-CG1 4.31Å; L220-I224 HydrophobicContact CG-CD1 3.95Å; L220-I224 WeakPolarHBondContact O-CG1 3.04Å; L220-I224 PolarHBondContact O-N 3.29Å; L221-I224 PolarHBondContact O-N 3.29Å; I224-H227 PolarHBondContact O-N 2.44Å; I224-L228 HydrophobicContact CG2-CD1 4.03Å; I224-L228 WeakPolarHBondContact O-CG 3.3Å; I224-L228 PolarHBondContact O-N 3.35Å; I224-L251 HydrophobicContact CG1-CD2 4.19Å; I224-F254 HydrophobicContact CD1-CE2 3.91Å; I224-F254 HydrophobicContact CD1-CZ 3.91Å; I224-F254 HydrophobicContact CG1-CE2 3.96Å; I224-F254 HydrophobicContact CG1-CZ 4.28Å; I224-F254 HydrophobicContact CG2-CD1 4.31Å; I224-F254 HydrophobicContact CG2-CD2 4.27Å; I224-F254 HydrophobicContact CG2-CE1 3.88Å; I224-F254 HydrophobicContact CG2-CE2 3.84Å; I224-F254 HydrophobicContact CG2-CZ 3.63Å; I224-V377 HydrophobicContact CB-CG1 3.91Å; I224-V377 HydrophobicContact CG2-CG1 3.55Å; I224-V377 HydrophobicContact CG2-CG2 4.35Å; I224-L381 HydrophobicContact CD1-CD1 4.29Å; I224-L381 HydrophobicContact CD1-CD2 3.91Å
225	S	97.4	Very high	94.1	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-48.4	-178.4	-53.3	0	0	0	0	111.3	L221 H227 L228 Q229 D374 V377	L221-S225 WeakPolarHBondContact O-CB 3.39Å; L221-S225 PolarHBondContact O-N 3.32Å; L221-S225 PolarHBondContact O-OG 3.06Å; S225-H227 PolarHBondContact O-N 3.32Å; S225-L228 PolarHBondContact O-N 2.9Å; S225-Q229 WeakPolarHBondContact O-CB 3.48Å; S225-Q229 WeakPolarHBondContact O-CG 3.42Å; S225-Q229 PolarHBondContact O-N 3.15Å; S225-D374 WeakPolarHBondContact CB-OD2 3.32Å; S225-D374 PolarHBondContact OG-OD2 3.35Å; S225-V377 WeakPolarHBondContact OG-CB 3.4Å
226	S	97.4	Very high	95.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.1	-42.5	177	-169.9	0	0	0	0	111.5	N222 L228 Q229 T230 T306 Q317	N222-S226 WeakPolarHBondContact O-CB 3.19Å; N222-S226 PolarHBondContact O-N 3.33Å; S226-L228 VanDerWaalsContact C-N 3.35Å; S226-L228 PolarHBondContact O-N 2.89Å; S226-Q229 PolarHBondContact O-N 2.77Å; S226-T230 WeakPolarHBondContact O-CG2 3.41Å; S226-T230 PolarHBondContact O-N 3.22Å; S226-T230 PolarHBondContact O-OG1 3.16Å; S226-T306 VanDerWaalsContact C-OG1 3.32Å; S226-T306 PolarHBondContact O-OG1 2.97Å; S226-T306 WeakPolarHBondContact OG-CG2 3.24Å; S226-T306 PolarHBondContact OG-OG1 2.8Å; S226-Q317 VanDerWaalsContact OG-CG 3.23Å; S226-Q317 WeakPolarHBondContact OG-CG 3.28Å
227	H	97.9	Very high	96.1	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-56	-46	175.3	172.4	78.9	0	0	0	112.4	A223 I224 S225 T230 G232 S234 L251 V280	A223-H227 WeakPolarHBondContact O-CB 3.32Å; A223-H227 PolarHBondContact O-N 3.19Å; I224-H227 PolarHBondContact O-N 2.44Å; S225-H227 PolarHBondContact O-N 3.32Å; H227-T230 PolarHBondContact O-N 3.33Å; H227-T230 PolarHBondContact O-OG1 3.49Å; H227-G232 VanDerWaalsContact CE1-CA 3.41Å; H227-G232 WeakPolarHBondContact CE1-CA 3.4Å; H227-G232 PolarHBondContact CE1-O 3.37Å; H227-G232 WeakPolarHBondContact O-CA 3.39Å; H227-G232 PolarHBondContact O-N 3.25Å; H227-S234 PolarHBondContact ND1-OG 3.29Å; H227-L251 HydrophobicContact CB-CD2 3.93Å; H227-L251 PolarHBondContact NE2-O 2.57Å; H227-V280 VanDerWaalsContact CE1-CG2 3.48Å; H227-V280 WeakPolarHBondContact CE1-CG2 3.2Å
228	L	97.7	Very high	96.4	Very high	5 Å²	5	7.7 Å²	7.7	3%	0.026	5%	0.049	C	C	.	.	H	α-helix	trans	-68.4	-36.9	177.9	-73.3	174	0	0	0	112.4	I224 S225 S226 T230 F254 V377 F401 L405 I447 A450	I224-L228 HydrophobicContact CG2-CD1 4.03Å; I224-L228 WeakPolarHBondContact O-CG 3.3Å; I224-L228 PolarHBondContact O-N 3.35Å; S225-L228 PolarHBondContact O-N 2.9Å; S226-L228 VanDerWaalsContact C-N 3.35Å; S226-L228 PolarHBondContact O-N 2.89Å; L228-T230 VanDerWaalsContact C-N 3.32Å; L228-F254 HydrophobicContact CD1-CD1 4.36Å; L228-F254 HydrophobicContact CD2-CB 4.04Å; L228-F254 HydrophobicContact CD2-CD1 4.49Å; L228-V377 HydrophobicContact CD1-CG2 3.73Å; L228-F401 HydrophobicContact CD1-CE1 4.49Å; L228-L405 HydrophobicContact CD1-CD1 4.25Å; L228-I447 HydrophobicContact CB-CB 4.46Å; L228-I447 HydrophobicContact CB-CD1 4.33Å; L228-I447 HydrophobicContact CB-CG1 3.9Å; L228-I447 HydrophobicContact CB-CG2 3.99Å; L228-I447 HydrophobicContact CD1-CG2 4.37Å; L228-A450 VanDerWaalsContact O-CB 3.32Å; L228-A450 WeakPolarHBondContact O-CB 3.42Å
229	Q	95.8	Very high	96.5	Very high	12 Å²	12	10.1 Å²	10.1	6%	0.056	6%	0.061	C	C	.	.	H	α-helix	trans	-70.9	-24.3	176.4	-69.3	173.2	5.7	0	0	113.2	S225 S226 Q317 H372 G443 N446 I447	S225-Q229 WeakPolarHBondContact O-CB 3.48Å; S225-Q229 WeakPolarHBondContact O-CG 3.42Å; S225-Q229 PolarHBondContact O-N 3.15Å; S226-Q229 PolarHBondContact O-N 2.77Å; Q229-Q317 VanDerWaalsContact CB-NE2 3.27Å; Q229-Q317 VanDerWaalsContact OE1-NE2 3.16Å; Q229-H372 PolarHBondContact NE2-O 3.47Å; Q229-G443 PolarHBondContact NE2-O 3.1Å; Q229-N446 HydrophobicContact CB-CB 4.37Å; Q229-N446 HydrophobicContact CG-CB 3.91Å; Q229-I447 HydrophobicContact CG-CD1 4.46Å; Q229-I447 HydrophobicContact CG-CG1 3.57Å
230	T	95.8	Very high	96.4	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.006	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	36	177.5	55.2	0	0	0	0	112.9	S226 H227 L228 G232 C233 P304 T306 Q317	S226-T230 WeakPolarHBondContact O-CG2 3.41Å; S226-T230 PolarHBondContact O-N 3.22Å; S226-T230 PolarHBondContact O-OG1 3.16Å; H227-T230 PolarHBondContact O-N 3.33Å; H227-T230 PolarHBondContact O-OG1 3.49Å; L228-T230 VanDerWaalsContact C-N 3.32Å; T230-G232 PolarHBondContact O-N 3.1Å; T230-G232 VanDerWaalsContact O-N 3.07Å; T230-C233 PolarHBondContact O-N 3.17Å; T230-C233 PolarHBondContact OG1-O 3.36Å; T230-C233 VanDerWaalsContact OG1-O 3.13Å; T230-P304 HydrophobicContact CG2-CB 4.42Å; T230-P304 HydrophobicContact CG2-CG 4.45Å; T230-T306 VanDerWaalsContact CG2-OG1 3.24Å; T230-T306 WeakPolarHBondContact CG2-OG1 3.4Å; T230-T306 PolarHBondContact OG1-OG1 2.97Å; T230-Q317 HydrophobicContact CG2-CG 3.39Å
231	C	96.8	Very high	96.4	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.014	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	24.1	177.5	-55.9	0	0	0	0	114.3	C233 Y303 K454	C231-C233 VanDerWaalsContact C-N 3.33Å; C231-Y303 HydrophobicContact CB-CD1 3.87Å; C231-Y303 HydrophobicContact CB-CD2 4.31Å; C231-Y303 HydrophobicContact CB-CE1 4.48Å; C231-Y303 HydrophobicContact CB-CG 3.77Å; C231-K454 HydrophobicContact CB-CD 4.11Å; C231-K454 HydrophobicContact CB-CG 3.98Å; C231-K454 VanDerWaalsContact O-CD 3.3Å; C231-K454 WeakPolarHBondContact O-CD 3.15Å; C231-K454 WeakPolarHBondContact O-CE 3.49Å
232	G	96.8	Very high	96.4	Very high	3 Å²	3	17.4 Å²	17.4	3%	0.031	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	15.1	-178.3	0	0	0	0	0	114.4	H227 T230	H227-G232 VanDerWaalsContact CE1-CA 3.41Å; H227-G232 WeakPolarHBondContact CE1-CA 3.4Å; H227-G232 PolarHBondContact CE1-O 3.37Å; H227-G232 WeakPolarHBondContact O-CA 3.39Å; H227-G232 PolarHBondContact O-N 3.25Å; T230-G232 PolarHBondContact O-N 3.1Å; T230-G232 VanDerWaalsContact O-N 3.07Å
233	C	97.8	Very high	96.2	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.034	11%	0.11	C	C	.	.			trans	-96.9	121.7	178	-77	0	0	0	0	111.1	T230 C231 F279 P304 T306	T230-C233 PolarHBondContact O-N 3.17Å; T230-C233 PolarHBondContact OG1-O 3.36Å; T230-C233 VanDerWaalsContact OG1-O 3.13Å; C231-C233 VanDerWaalsContact C-N 3.33Å; C233-F279 CarbonylContact C-O 3.57Å; C233-F279 WeakPolarHBondContact CA-O 3.19Å; C233-P304 VanDerWaalsContact CB-O 3.24Å; C233-P304 WeakPolarHBondContact CB-O 3.48Å; C233-T306 PolarHBondContact O-N 3.04Å
234	S	98.1	Very high	96.2	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.007	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	147.2	-176.3	-56.9	0	0	0	0	113.4	H227 F279 V280 Q281 T306	H227-S234 PolarHBondContact ND1-OG 3.29Å; S234-F279 PolarHBondContact N-O 3.42Å; S234-V280 CarbonylContact O-C 3.51Å; S234-V280 VanDerWaalsContact O-CA 3.3Å; S234-V280 WeakPolarHBondContact O-CA 3.14Å; S234-Q281 PolarHBondContact O-N 3.45Å; S234-T306 CarbonylContact C-O 3.52Å; S234-T306 VanDerWaalsContact CA-O 3.3Å; S234-T306 WeakPolarHBondContact CA-O 3.47Å
235	V	97.3	Very high	96.2	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.6	170.4	176.1	0	0	0	0	107.8	V237 Y274 Q281 L283 T305 T306 I308	V235-V237 HydrophobicContact CG1-CG1 3.93Å; V235-Y274 HydrophobicContact CG2-CD2 3.45Å; V235-Y274 VanDerWaalsContact CG2-CD2 3.45Å; V235-Y274 HydrophobicContact CG2-CE2 3.3Å; V235-Q281 WeakPolarHBondContact CA-O 3.4Å; V235-L283 HydrophobicContact CG1-CD1 3.73Å; V235-L283 HydrophobicContact CG1-CG 4.22Å; V235-T305 HydrophobicContact CB-CG2 4.3Å; V235-T305 HydrophobicContact CG2-CG2 3.72Å; V235-T306 PolarHBondContact N-O 2.9Å; V235-I308 PolarHBondContact O-N 2.82Å
236	V	97.5	Very high	96.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118	178.2	-174.3	0	0	0	0	107.8	V244 I247 V248 L251 V280 Q281 G282 L283 I308 V310	V236-V244 HydrophobicContact CB-CG1 4.22Å; V236-V244 HydrophobicContact CG1-CB 4.44Å; V236-V244 HydrophobicContact CG1-CG1 4.01Å; V236-I247 HydrophobicContact CG1-CB 3.94Å; V236-I247 HydrophobicContact CG1-CG2 3.83Å; V236-I247 HydrophobicContact CG2-CG2 3.93Å; V236-V248 HydrophobicContact CB-CG2 3.9Å; V236-V248 HydrophobicContact CG2-CG2 3.87Å; V236-L251 HydrophobicContact CG2-CD1 3.85Å; V236-V280 HydrophobicContact CG2-CG1 4.39Å; V236-Q281 PolarHBondContact N-O 2.86Å; V236-G282 WeakPolarHBondContact O-CA 3.49Å; V236-L283 PolarHBondContact O-N 2.65Å; V236-I308 CarbonylContact C-O 3.19Å; V236-I308 WeakPolarHBondContact CA-O 3.37Å; V236-I308 HydrophobicContact CG2-CB 4.46Å; V236-I308 HydrophobicContact CG2-CD1 4.46Å; V236-V310 HydrophobicContact CG1-CG1 3.54Å
237	V	95.1	Very high	96.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	145.2	179.4	-60.6	0	0	0	0	111.3	V235 L283 F291 H307 I308 D309 V310	V235-V237 HydrophobicContact CG1-CG1 3.93Å; V237-L283 WeakPolarHBondContact CA-O 3.33Å; V237-L283 HydrophobicContact CG1-CB 4.23Å; V237-F291 HydrophobicContact CB-CD1 4.39Å; V237-F291 HydrophobicContact CB-CG 4.5Å; V237-F291 HydrophobicContact CG1-CD1 4.32Å; V237-F291 HydrophobicContact CG1-CD2 3.74Å; V237-F291 HydrophobicContact CG1-CE1 4.37Å; V237-F291 HydrophobicContact CG1-CE2 3.75Å; V237-F291 HydrophobicContact CG1-CG 4.06Å; V237-F291 HydrophobicContact CG1-CZ 4.13Å; V237-F291 HydrophobicContact CG2-CD1 4.29Å; V237-F291 HydrophobicContact CG2-CE1 4Å; V237-F291 HydrophobicContact CG2-CZ 4.26Å; V237-H307 WeakPolarHBondContact CG2-NE2 3.32Å; V237-I308 WeakPolarHBondContact CG2-O 3.4Å; V237-I308 PolarHBondContact N-O 3.16Å; V237-D309 HydrophobicContact CG2-CB 3.75Å; V237-D309 WeakPolarHBondContact O-CA 3.36Å; V237-V310 WeakPolarHBondContact O-CG2 3.5Å; V237-V310 PolarHBondContact O-N 2.59Å
238	G	94.3	Very high	96.2	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.1	175.5	175.1	0	0	0	0	0	112.8	L283 L284 K285 D311	G238-L283 PolarHBondContact N-O 2.97Å; G238-L284 WeakPolarHBondContact O-CA 3.35Å; G238-K285 PolarHBondContact O-N 3.01Å; G238-D311 WeakPolarHBondContact CA-OD2 3.27Å
239	S	92.9	Very high	96.2	Very high	78 Å²	78	28.2 Å²	28.2	55%	0.545	14%	0.142	S	C	.	.	S	Bend	trans	-90.5	-11.8	-178.5	-54.8	0	0	0	0	113.2	D311	S239-D311 WeakPolarHBondContact CB-OD2 3.48Å; S239-D311 PolarHBondContact N-OD1 2.88Å; S239-D311 VanDerWaalsContact N-OD1 3.16Å; S239-D311 PolarHBondContact N-OD2 3.11Å; S239-D311 PolarHBondContact OG-OD2 2.92Å
240	S	93.4	Very high	96.3	Very high	36 Å²	36	27.7 Å²	27.7	25%	0.252	14%	0.14	S	C	.	.			trans	-124.7	127.2	-179.4	166	0	0	0	0	111.1	E242 K243 V244	S240-E242 VanDerWaalsContact C-N 3.25Å; S240-E242 PolarHBondContact O-N 2.87Å; S240-E242 PolarHBondContact OG-N 3.43Å; S240-K243 PolarHBondContact O-N 2.7Å; S240-V244 WeakPolarHBondContact O-CG2 3.38Å; S240-V244 PolarHBondContact O-N 2.94Å; S240-V244 VanDerWaalsContact O-N 3.07Å
241	A	94.6	Very high	96.4	Very high	6 Å²	6	27.7 Å²	27.7	5%	0.05	14%	0.14	C	C	.	.	H	α-helix	trans	-66.3	-29.3	178.7	0	0	0	0	0	113	N245 C266 N268 L284	A241-N245 WeakPolarHBondContact O-CB 3.47Å; A241-N245 PolarHBondContact O-N 3.06Å; A241-N245 PolarHBondContact O-ND2 2.98Å; A241-C266 WeakPolarHBondContact CA-SG 3.4Å; A241-C266 VanDerWaalsContact CB-SG 3.5Å; A241-C266 PolarHBondContact O-SG 3.43Å; A241-N268 WeakPolarHBondContact CB-OD1 3.47Å; A241-L284 HydrophobicContact CB-CD1 4.38Å; A241-L284 HydrophobicContact CB-CD2 4.19Å
242	E	94.8	Very high	96.5	Very high	153 Å²	153	27.6 Å²	27.6	72%	0.715	14%	0.139	S	C	*	.	H	α-helix	trans	-64.1	-49.4	178.1	-66.9	167.1	-177.5	0	0	110.5	S240 N245 K246	S240-E242 VanDerWaalsContact C-N 3.25Å; S240-E242 PolarHBondContact O-N 2.87Å; S240-E242 PolarHBondContact OG-N 3.43Å; E242-N245 PolarHBondContact O-N 2.83Å; E242-K246 WeakPolarHBondContact O-CB 3.18Å; E242-K246 PolarHBondContact O-N 2.89Å
243	K	94.4	Very high	96.6	Very high	126 Å²	126	27.9 Å²	27.9	55%	0.548	14%	0.14	S	C	.	.	H	α-helix	trans	-63.2	-47.7	177.6	-68.9	-173.4	177.5	-176.9	0	111.7	S240 K246 I247 V310	S240-K243 PolarHBondContact O-N 2.7Å; K243-K246 PolarHBondContact O-N 2.86Å; K243-I247 PolarHBondContact O-N 2.93Å; K243-V310 HydrophobicContact CB-CG2 4.1Å
244	V	96.5	Very high	96.6	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-50	178.6	170.8	0	0	0	0	110.3	V236 S240 K246 I247 V248 C266 G282 L284 V310	V236-V244 HydrophobicContact CB-CG1 4.22Å; V236-V244 HydrophobicContact CG1-CB 4.44Å; V236-V244 HydrophobicContact CG1-CG1 4.01Å; S240-V244 WeakPolarHBondContact O-CG2 3.38Å; S240-V244 PolarHBondContact O-N 2.94Å; S240-V244 VanDerWaalsContact O-N 3.07Å; V244-K246 VanDerWaalsContact C-N 3.33Å; V244-K246 PolarHBondContact O-N 3.04Å; V244-I247 PolarHBondContact O-N 3.19Å; V244-V248 HydrophobicContact CG1-CG2 4.2Å; V244-V248 WeakPolarHBondContact O-CG2 3.49Å; V244-V248 PolarHBondContact O-N 3.32Å; V244-C266 HydrophobicContact CG1-CB 4.06Å; V244-C266 WeakPolarHBondContact CG1-SG 3.49Å; V244-G282 VanDerWaalsContact CG1-CA 3.48Å; V244-L284 HydrophobicContact CG2-CD2 4.34Å; V244-V310 HydrophobicContact CG2-CG2 3.97Å
245	N	96.8	Very high	96.6	Very high	19 Å²	19	28.3 Å²	28.3	10%	0.102	14%	0.141	C	C	.	.	H	α-helix	trans	-65.1	-33.6	-179.7	-74.7	-29.6	0	0	0	112.8	A241 E242 V248 R249 L265 C266	A241-N245 WeakPolarHBondContact O-CB 3.47Å; A241-N245 PolarHBondContact O-N 3.06Å; A241-N245 PolarHBondContact O-ND2 2.98Å; E242-N245 PolarHBondContact O-N 2.83Å; N245-V248 PolarHBondContact O-N 2.99Å; N245-R249 WeakPolarHBondContact O-CB 3.48Å; N245-R249 WeakPolarHBondContact O-CG 3.5Å; N245-R249 PolarHBondContact O-N 3.27Å; N245-L265 HydrophobicContact CB-CD2 4.23Å; N245-L265 WeakPolarHBondContact OD1-CA 3.35Å; N245-L265 WeakPolarHBondContact OD1-CB 3.35Å; N245-L265 WeakPolarHBondContact OD1-CD2 3.36Å; N245-C266 PolarHBondContact ND2-O 2.98Å; N245-C266 PolarHBondContact ND2-SG 2.67Å; N245-C266 PolarHBondContact OD1-N 3.15Å; N245-C266 PolarHBondContact OD1-SG 2.76Å
246	K	96.8	Very high	96.5	Very high	66 Å²	66	30.6 Å²	30.6	29%	0.287	16%	0.155	S	C	.	.	H	α-helix	trans	-60.8	-45.4	173.6	-165	179.3	-169.6	-172.4	0	111	T204 V205 D208 E242 K243 V244 T250	T204-K246 WeakPolarHBondContact O-CE 3.49Å; V205-K246 HydrophobicContact CG2-CD 4.17Å; V205-K246 HydrophobicContact CG2-CG 4.13Å; D208-K246 IonicContact OD1-NZ 3.75Å; D208-K246 PolarHBondContact OD1-NZ 3.44Å; D208-K246 IonicContact OD2-NZ 3.55Å; D208-K246 PolarHBondContact OD2-NZ 3Å; E242-K246 WeakPolarHBondContact O-CB 3.18Å; E242-K246 PolarHBondContact O-N 2.89Å; K243-K246 PolarHBondContact O-N 2.86Å; V244-K246 VanDerWaalsContact C-N 3.33Å; V244-K246 PolarHBondContact O-N 3.04Å; K246-T250 WeakPolarHBondContact O-CB 3.36Å; K246-T250 PolarHBondContact O-N 3.46Å; K246-T250 PolarHBondContact O-OG1 3.2Å
247	I	98	Very high	96.4	Very high	12 Å²	12	33.7 Å²	33.7	6%	0.062	18%	0.176	C	C	.	.	H	α-helix	trans	-69.4	-42	177	-61.7	-58	0	0	0	111.6	V205 F219 V236 K243 V244 R249 T250 L251 I308 V310	V205-I247 HydrophobicContact CG2-CD1 3.7Å; F219-I247 HydrophobicContact CE1-CD1 4.24Å; V236-I247 HydrophobicContact CG1-CB 3.94Å; V236-I247 HydrophobicContact CG1-CG2 3.83Å; V236-I247 HydrophobicContact CG2-CG2 3.93Å; K243-I247 PolarHBondContact O-N 2.93Å; V244-I247 PolarHBondContact O-N 3.19Å; I247-R249 PolarHBondContact O-N 2.78Å; I247-T250 WeakPolarHBondContact O-CB 2.98Å; I247-T250 PolarHBondContact O-N 2.75Å; I247-T250 VanDerWaalsContact O-N 3.13Å; I247-L251 HydrophobicContact CG2-CD1 4.07Å; I247-L251 HydrophobicContact CG2-CG 4.29Å; I247-L251 WeakPolarHBondContact O-CG 3.49Å; I247-L251 PolarHBondContact O-N 2.95Å; I247-I308 HydrophobicContact CG2-CG2 4.5Å; I247-V310 HydrophobicContact CB-CG1 4.25Å; I247-V310 HydrophobicContact CG1-CG1 3.77Å; I247-V310 HydrophobicContact CG2-CG1 4.49Å
248	V	98.3	Very high	96.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.7	-48.7	175.6	169.6	0	0	0	0	111	V195 V236 V244 N245 T250 L251 C252 L265 V280	V195-V248 HydrophobicContact CG2-CG1 4.18Å; V236-V248 HydrophobicContact CB-CG2 3.9Å; V236-V248 HydrophobicContact CG2-CG2 3.87Å; V244-V248 HydrophobicContact CG1-CG2 4.2Å; V244-V248 WeakPolarHBondContact O-CG2 3.49Å; V244-V248 PolarHBondContact O-N 3.32Å; N245-V248 PolarHBondContact O-N 2.99Å; V248-T250 VanDerWaalsContact C-N 3.32Å; V248-T250 PolarHBondContact O-N 2.8Å; V248-L251 PolarHBondContact O-N 3.17Å; V248-C252 WeakPolarHBondContact O-CB 3.47Å; V248-C252 PolarHBondContact O-N 2.9Å; V248-C252 PolarHBondContact O-SG 3.03Å; V248-L265 HydrophobicContact CB-CD2 4.25Å; V248-L265 HydrophobicContact CG1-CD2 3.75Å; V248-V280 HydrophobicContact CB-CG1 4.18Å; V248-V280 HydrophobicContact CG1-CB 4.49Å; V248-V280 HydrophobicContact CG1-CG1 3.8Å; V248-V280 HydrophobicContact CG2-CG1 4.07Å
249	R	98.1	Very high	96.4	Very high	71 Å²	71	38.7 Å²	38.7	27%	0.268	21%	0.207	S	C	.	.	H	α-helix	trans	-61.9	-40.9	176.2	-69.3	-176.4	-170.2	103.9	-0.6	111.9	I199 T204 N245 I247 L251 C252 L253 L265	I199-R249 HydrophobicContact CG2-CB 4.27Å; T204-R249 HydrophobicContact CG2-CB 3.89Å; N245-R249 WeakPolarHBondContact O-CB 3.48Å; N245-R249 WeakPolarHBondContact O-CG 3.5Å; N245-R249 PolarHBondContact O-N 3.27Å; I247-R249 PolarHBondContact O-N 2.78Å; R249-L251 PolarHBondContact O-N 2.76Å; R249-C252 PolarHBondContact O-N 2.67Å; R249-L253 PolarHBondContact O-N 2.71Å; R249-L265 HydrophobicContact CG-CD2 4.15Å
250	T	98.3	Very high	96.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-46.1	177.4	-55.9	0	0	0	0	111.8	T204 V205 L206 L220 K246 I247 V248 L253 F254	T204-T250 WeakPolarHBondContact CB-OG1 3.27Å; V205-T250 HydrophobicContact CB-CG2 4.13Å; V205-T250 HydrophobicContact CG2-CG2 4.47Å; V205-T250 PolarHBondContact N-OG1 3.02Å; L206-T250 HydrophobicContact CG-CG2 4.46Å; L220-T250 HydrophobicContact CD1-CG2 4.37Å; K246-T250 WeakPolarHBondContact O-CB 3.36Å; K246-T250 PolarHBondContact O-N 3.46Å; K246-T250 PolarHBondContact O-OG1 3.2Å; I247-T250 WeakPolarHBondContact O-CB 2.98Å; I247-T250 PolarHBondContact O-N 2.75Å; I247-T250 VanDerWaalsContact O-N 3.13Å; V248-T250 VanDerWaalsContact C-N 3.32Å; V248-T250 PolarHBondContact O-N 2.8Å; T250-L253 WeakPolarHBondContact O-CB 3.19Å; T250-L253 PolarHBondContact O-N 2.83Å; T250-F254 WeakPolarHBondContact O-CD2 3.2Å
251	L	98.6	Very high	96.7	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-68.7	-39.3	177.7	-63.8	174.9	0	0	0	111.8	I224 H227 V236 I247 V248 R249 L253 F254 V280 I308	I224-L251 HydrophobicContact CG1-CD2 4.19Å; H227-L251 HydrophobicContact CB-CD2 3.93Å; H227-L251 PolarHBondContact NE2-O 2.57Å; V236-L251 HydrophobicContact CG2-CD1 3.85Å; I247-L251 HydrophobicContact CG2-CD1 4.07Å; I247-L251 HydrophobicContact CG2-CG 4.29Å; I247-L251 WeakPolarHBondContact O-CG 3.49Å; I247-L251 PolarHBondContact O-N 2.95Å; V248-L251 PolarHBondContact O-N 3.17Å; R249-L251 PolarHBondContact O-N 2.76Å; L251-L253 PolarHBondContact O-N 3.18Å; L251-L253 VanDerWaalsContact O-N 3.13Å; L251-F254 PolarHBondContact O-N 3.02Å; L251-V280 HydrophobicContact CB-CG1 4.45Å; L251-V280 HydrophobicContact CB-CG2 4.32Å; L251-V280 HydrophobicContact CD1-CG1 4.39Å; L251-I308 HydrophobicContact CD1-CD1 3.49Å; L251-I308 VanDerWaalsContact CD1-CD1 3.49Å
252	C	98.4	Very high	96.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-18.3	178	-75.3	0	0	0	0	114.1	V195 I199 V248 R249 F254 L255 R260	V195-C252 HydrophobicContact CG1-CB 4.25Å; I199-C252 HydrophobicContact CD1-CB 3.37Å; V248-C252 WeakPolarHBondContact O-CB 3.47Å; V248-C252 PolarHBondContact O-N 2.9Å; V248-C252 PolarHBondContact O-SG 3.03Å; R249-C252 PolarHBondContact O-N 2.67Å; C252-F254 PolarHBondContact O-N 2.69Å; C252-L255 PolarHBondContact O-N 3.44Å; C252-L255 VanDerWaalsContact O-N 3.12Å; C252-R260 HydrophobicContact CB-CG 4.28Å; C252-R260 PolarHBondContact O-NE 3.41Å
253	L	98.1	Very high	96.9	Very high	8 Å²	8	30.4 Å²	30.4	4%	0.042	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.7	170.5	-73.5	177.5	0	0	0	112.5	I199 I201 T204 L206 R249 T250 L251 L255 R260 L398 L402	I199-L253 HydrophobicContact CB-CD2 3.99Å; I199-L253 HydrophobicContact CG2-CD2 3.76Å; I199-L253 HydrophobicContact CG2-CG 4.34Å; I201-L253 HydrophobicContact CG1-CD1 4.25Å; T204-L253 HydrophobicContact CG2-CD1 3.79Å; T204-L253 HydrophobicContact CG2-CG 4.16Å; L206-L253 HydrophobicContact CD1-CD1 3.62Å; L206-L253 HydrophobicContact CG-CD1 4.19Å; R249-L253 PolarHBondContact O-N 2.71Å; T250-L253 WeakPolarHBondContact O-CB 3.19Å; T250-L253 PolarHBondContact O-N 2.83Å; L251-L253 PolarHBondContact O-N 3.18Å; L251-L253 VanDerWaalsContact O-N 3.13Å; L253-L255 VanDerWaalsContact C-N 3.31Å; L253-R260 PolarHBondContact O-NH2 3.35Å; L253-L398 HydrophobicContact CB-CD2 3.84Å; L253-L398 HydrophobicContact CD1-CD2 4.13Å; L253-L398 HydrophobicContact CD2-CD2 4.19Å; L253-L398 HydrophobicContact CG-CD2 4.3Å; L253-L402 WeakPolarHBondContact O-CD1 3.47Å
254	F	98.1	Very high	97	Very high	7 Å²	7	24.5 Å²	24.5	3%	0.031	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	1.8	179.9	-59	-90.9	0	0	0	113.9	I224 L228 T250 L251 C252 F380 L398 F401 L402	I224-F254 HydrophobicContact CD1-CE2 3.91Å; I224-F254 HydrophobicContact CD1-CZ 3.91Å; I224-F254 HydrophobicContact CG1-CE2 3.96Å; I224-F254 HydrophobicContact CG1-CZ 4.28Å; I224-F254 HydrophobicContact CG2-CD1 4.31Å; I224-F254 HydrophobicContact CG2-CD2 4.27Å; I224-F254 HydrophobicContact CG2-CE1 3.88Å; I224-F254 HydrophobicContact CG2-CE2 3.84Å; I224-F254 HydrophobicContact CG2-CZ 3.63Å; L228-F254 HydrophobicContact CD1-CD1 4.36Å; L228-F254 HydrophobicContact CD2-CB 4.04Å; L228-F254 HydrophobicContact CD2-CD1 4.49Å; T250-F254 WeakPolarHBondContact O-CD2 3.2Å; L251-F254 PolarHBondContact O-N 3.02Å; C252-F254 PolarHBondContact O-N 2.69Å; F254-F380 HydrophobicContact CE1-CE1 4.1Å; F254-F380 AromaticContact CZ-CE1 3.94Å; F254-F380 HydrophobicContact CZ-CE1 3.94Å; F254-L398 HydrophobicContact CD1-CD1 4.12Å; F254-L398 HydrophobicContact CE1-CD1 3.69Å; F254-L398 HydrophobicContact CZ-CD1 4.02Å; F254-F401 HydrophobicContact CD1-CE1 4.22Å; F254-F401 HydrophobicContact CE1-CD1 4.11Å; F254-F401 AromaticContact CE1-CE1 3.87Å; F254-F401 HydrophobicContact CE1-CE1 3.87Å; F254-L402 HydrophobicContact CB-CD2 4.24Å; F254-L402 HydrophobicContact CD1-CD2 3.82Å; F254-L402 HydrophobicContact CG-CD2 4.45Å
255	L	97.8	Very high	97	Very high	8 Å²	8	25.9 Å²	25.9	4%	0.042	13%	0.134	C	C	.	.	S	Bend	trans	-101.5	157.6	177.2	-61.2	-179	0	0	0	111.9	C252 L253 E259 R260 F279 V280	C252-L255 PolarHBondContact O-N 3.44Å; C252-L255 VanDerWaalsContact O-N 3.12Å; L253-L255 VanDerWaalsContact C-N 3.31Å; L255-E259 HydrophobicContact CB-CB 3.97Å; L255-E259 HydrophobicContact CD1-CB 4.37Å; L255-R260 HydrophobicContact CB-CG 4.08Å; L255-R260 PolarHBondContact O-NE 3.37Å; L255-R260 PolarHBondContact O-NH2 3.27Å; L255-F279 HydrophobicContact CD1-CB 3.83Å; L255-F279 HydrophobicContact CD1-CG 4.46Å; L255-F279 HydrophobicContact CD2-CD1 4.34Å; L255-V280 HydrophobicContact CD1-CG2 3.84Å
256	T	96	Very high	96.8	Very high	50 Å²	50	25.3 Å²	25.3	31%	0.307	13%	0.132	S	C	.	.			trans	-71.5	158	170.1	66.1	0	0	0	0	111.3	S258 E259 R260	T256-S258 VanDerWaalsContact C-N 3.26Å; T256-S258 PolarHBondContact O-N 3.46Å; T256-E259 PolarHBondContact N-OE2 3.04Å; T256-E259 PolarHBondContact O-N 2.94Å; T256-E259 WeakPolarHBondContact OG1-CG 3.16Å; T256-E259 PolarHBondContact OG1-N 3.44Å; T256-E259 PolarHBondContact OG1-OE2 3.24Å; T256-E259 VanDerWaalsContact OG1-OE2 3.04Å; T256-R260 WeakPolarHBondContact O-CG 3.5Å; T256-R260 PolarHBondContact O-N 3.08Å
257	P	95.2	Very high	96.2	Very high	65 Å²	65	25.4 Å²	25.4	42%	0.422	13%	0.13	S	C	.	.	H	α-helix	trans	-54.1	-38.8	179	-28.7	36.5	0	0	0	114.4	E197 R260 K261	E197-P257 HydrophobicContact CB-CB 4.2Å; E197-P257 HydrophobicContact CG-CB 4.35Å; P257-R260 PolarHBondContact O-N 2.9Å; P257-K261 PolarHBondContact O-N 3.32Å
258	S	93.5	Very high	95.2	Very high	74 Å²	74	30.5 Å²	30.5	52%	0.517	16%	0.158	S	C	.	.	H	α-helix	trans	-67.5	-36.5	177.3	-53.6	0	0	0	0	112.6	T256 K261 C262	T256-S258 VanDerWaalsContact C-N 3.26Å; T256-S258 PolarHBondContact O-N 3.46Å; S258-K261 PolarHBondContact O-N 2.9Å; S258-C262 PolarHBondContact O-SG 3.42Å
259	E	96	Very high	93.8	Very high	30 Å²	30	39 Å²	39	14%	0.14	20%	0.197	C	C	.	.	H	α-helix	trans	-72.9	-33.2	176.8	-67.3	169.2	156.2	0	0	111.8	L255 T256 K261 C262 S263 F279 K454	L255-E259 HydrophobicContact CB-CB 3.97Å; L255-E259 HydrophobicContact CD1-CB 4.37Å; T256-E259 PolarHBondContact N-OE2 3.04Å; T256-E259 PolarHBondContact O-N 2.94Å; T256-E259 WeakPolarHBondContact OG1-CG 3.16Å; T256-E259 PolarHBondContact OG1-N 3.44Å; T256-E259 PolarHBondContact OG1-OE2 3.24Å; T256-E259 VanDerWaalsContact OG1-OE2 3.04Å; E259-K261 VanDerWaalsContact C-N 3.32Å; E259-K261 PolarHBondContact O-N 3.46Å; E259-C262 CarbonylContact O-C 2.91Å; E259-C262 WeakPolarHBondContact O-CA 3.49Å; E259-C262 WeakPolarHBondContact O-CB 3.39Å; E259-C262 PolarHBondContact O-N 2.95Å; E259-S263 PolarHBondContact O-N 3.21Å; E259-S263 PolarHBondContact O-OG 3.44Å; E259-F279 HydrophobicContact CB-CD1 4.47Å; E259-F279 HydrophobicContact CB-CD2 4.01Å; E259-F279 HydrophobicContact CB-CE2 4.02Å; E259-F279 HydrophobicContact CB-CG 4.22Å; E259-F279 HydrophobicContact CB-CZ 4.27Å; E259-F279 HydrophobicContact CG-CD2 4.25Å; E259-F279 HydrophobicContact CG-CE1 4.06Å; E259-F279 HydrophobicContact CG-CE2 3.76Å; E259-F279 HydrophobicContact CG-CZ 3.65Å; E259-K454 WeakPolarHBondContact OE1-CE 3.45Å; E259-K454 IonicContact OE1-NZ 3.03Å; E259-K454 PolarHBondContact OE1-NZ 3.4Å; E259-K454 IonicContact OE2-NZ 3.95Å; E259-K454 PolarHBondContact OE2-NZ 2.96Å
260	R	96.9	Very high	92.2	Very high	36 Å²	36	36.9 Å²	36.9	14%	0.136	19%	0.193	C	C	.	.	H	α-helix	trans	-59.5	-42.5	172.2	-66.7	172.4	-172.6	168.3	3.5	111.5	V195 E197 I199 C252 L253 L255 T256 P257 C262 S263	V195-R260 WeakPolarHBondContact CB-O 3.4Å; V195-R260 HydrophobicContact CG1-CB 4.41Å; E197-R260 WeakPolarHBondContact O-CD 3.23Å; E197-R260 PolarHBondContact O-NH1 3.47Å; I199-R260 HydrophobicContact CD1-CG 4.13Å; C252-R260 HydrophobicContact CB-CG 4.28Å; C252-R260 PolarHBondContact O-NE 3.41Å; L253-R260 PolarHBondContact O-NH2 3.35Å; L255-R260 HydrophobicContact CB-CG 4.08Å; L255-R260 PolarHBondContact O-NE 3.37Å; L255-R260 PolarHBondContact O-NH2 3.27Å; T256-R260 WeakPolarHBondContact O-CG 3.5Å; T256-R260 PolarHBondContact O-N 3.08Å; P257-R260 PolarHBondContact O-N 2.9Å; R260-C262 PolarHBondContact O-N 3.5Å; R260-C262 VanDerWaalsContact O-N 3.11Å; R260-S263 VanDerWaalsContact O-CB 3.31Å; R260-S263 WeakPolarHBondContact O-CB 3.39Å; R260-S263 PolarHBondContact O-N 3.11Å
261	K	95.3	Very high	91	Very high	57 Å²	57	41.4 Å²	41.4	25%	0.248	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-15.5	173.2	-81.6	-171.5	160.4	168.2	0	114	P126 M190 E197 P257 S258 E259	P126-K261 HydrophobicContact CB-CB 3.93Å; P126-K261 HydrophobicContact CG-CB 3.93Å; P126-K261 HydrophobicContact CG-CD 3.92Å; M190-K261 WeakPolarHBondContact CE-O 3.45Å; E197-K261 HydrophobicContact CG-CD 3.91Å; E197-K261 HydrophobicContact CG-CG 3.95Å; E197-K261 WeakPolarHBondContact OE1-CD 3.37Å; E197-K261 WeakPolarHBondContact OE1-CE 3.26Å; E197-K261 IonicContact OE1-NZ 3.66Å; E197-K261 PolarHBondContact OE1-NZ 3.32Å; P257-K261 PolarHBondContact O-N 3.32Å; S258-K261 PolarHBondContact O-N 2.9Å; E259-K261 VanDerWaalsContact C-N 3.32Å; E259-K261 PolarHBondContact O-N 3.46Å
262	C	95.9	Very high	90.4	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.041	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	18.4	172.7	-59.6	0	0	0	0	112.4	P126 S258 E259 R260 L278 F279	P126-C262 WeakPolarHBondContact CB-SG 3.49Å; P126-C262 PolarHBondContact O-SG 2.89Å; S258-C262 PolarHBondContact O-SG 3.42Å; E259-C262 CarbonylContact O-C 2.91Å; E259-C262 WeakPolarHBondContact O-CA 3.49Å; E259-C262 WeakPolarHBondContact O-CB 3.39Å; E259-C262 PolarHBondContact O-N 2.95Å; R260-C262 PolarHBondContact O-N 3.5Å; R260-C262 VanDerWaalsContact O-N 3.11Å; C262-L278 CarbonylContact O-C 3.58Å; C262-L278 WeakPolarHBondContact O-CA 3.26Å; C262-L278 VanDerWaalsContact O-CB 3.25Å; C262-L278 WeakPolarHBondContact O-CB 3.5Å; C262-L278 WeakPolarHBondContact O-CD2 3.4Å; C262-F279 HydrophobicContact CB-CD2 3.62Å; C262-F279 HydrophobicContact CB-CE2 4.07Å; C262-F279 PolarHBondContact O-N 3.4Å
263	S	97.7	Very high	89.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.			trans	-119	151.6	175.1	-65.1	0	0	0	0	110.2	S194 V195 E259 R260 F279 V280	S194-S263 WeakPolarHBondContact CA-O 3.25Å; V195-S263 PolarHBondContact N-O 3Å; E259-S263 PolarHBondContact O-N 3.21Å; E259-S263 PolarHBondContact O-OG 3.44Å; R260-S263 VanDerWaalsContact O-CB 3.31Å; R260-S263 WeakPolarHBondContact O-CB 3.39Å; R260-S263 PolarHBondContact O-N 3.11Å; S263-F279 WeakPolarHBondContact OG-CB 3.39Å; S263-V280 CarbonylContact C-O 3.43Å; S263-V280 WeakPolarHBondContact CA-O 3.3Å; S263-V280 WeakPolarHBondContact CB-O 3.41Å; S263-V280 PolarHBondContact OG-N 3.25Å
264	R	96.8	Very high	89.5	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.011	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-129.9	130.7	-172.8	-169.1	174.1	59.8	-170.3	-6.5	111.9	S189 M190 H193 F272 K273 L278 V280 Q281 G282	S189-R264 WeakPolarHBondContact OG-CD 3.41Å; S189-R264 PolarHBondContact OG-NH1 2.67Å; M190-R264 HydrophobicContact SD-CB 3.86Å; M190-R264 HydrophobicContact SD-CG 4.13Å; H193-R264 HydrophobicContact CB-CG 4.06Å; H193-R264 WeakPolarHBondContact O-CA 3.19Å; R264-F272 HydrophobicContact CG-CD2 4.49Å; R264-F272 HydrophobicContact CG-CE2 4.42Å; R264-K273 PolarHBondContact NH2-O 2.97Å; R264-L278 HydrophobicContact CB-CD1 4.03Å; R264-V280 PolarHBondContact N-O 2.93Å; R264-Q281 WeakPolarHBondContact O-CA 3.48Å; R264-G282 PolarHBondContact O-N 3.13Å
265	L	96.1	Very high	89.2	Confident	29 Å²	29	50.7 Å²	50.7	15%	0.152	27%	0.265	C	S	.	.			trans	-75.4	154.7	171.2	-63.5	175	0	0	0	110.7	H193 V195 N245 V248 R249	H193-L265 PolarHBondContact O-N 3.5Å; V195-L265 HydrophobicContact CG2-CD2 3.97Å; V195-L265 HydrophobicContact CG2-CG 3.97Å; N245-L265 HydrophobicContact CB-CD2 4.23Å; N245-L265 WeakPolarHBondContact OD1-CA 3.35Å; N245-L265 WeakPolarHBondContact OD1-CB 3.35Å; N245-L265 WeakPolarHBondContact OD1-CD2 3.36Å; V248-L265 HydrophobicContact CB-CD2 4.25Å; V248-L265 HydrophobicContact CG1-CD2 3.75Å; R249-L265 HydrophobicContact CG-CD2 4.15Å
266	C	91.9	Very high	88.9	Confident	6 Å²	6	51.1 Å²	51.1	4%	0.041	27%	0.269	C	S	.	.			trans	-83.2	155.9	172.7	64.3	0	0	0	0	111.8	A241 V244 N245 G282 L284	A241-C266 WeakPolarHBondContact CA-SG 3.4Å; A241-C266 VanDerWaalsContact CB-SG 3.5Å; A241-C266 PolarHBondContact O-SG 3.43Å; V244-C266 HydrophobicContact CG1-CB 4.06Å; V244-C266 WeakPolarHBondContact CG1-SG 3.49Å; N245-C266 PolarHBondContact ND2-O 2.98Å; N245-C266 PolarHBondContact ND2-SG 2.67Å; N245-C266 PolarHBondContact OD1-N 3.15Å; N245-C266 PolarHBondContact OD1-SG 2.76Å; C266-G282 WeakPolarHBondContact CB-O 3.44Å; C266-L284 HydrophobicContact CB-CD2 4.45Å; C266-L284 HydrophobicContact CB-CG 4.29Å
267	R	84.8	Confident	88.6	Confident	68 Å²	68	49.2 Å²	49.2	26%	0.257	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-117.6	140.2	178.2	-169	174	91.7	-179.2	4.4	110.6	H193 E269 S270 F272 L284	H193-R267 WeakPolarHBondContact NE2-CD 3.46Å; R267-E269 VanDerWaalsContact C-N 3.34Å; R267-E269 PolarHBondContact O-N 3.2Å; R267-S270 PolarHBondContact NE-OG 3.45Å; R267-S270 PolarHBondContact NH2-OG 3.23Å; R267-S270 VanDerWaalsContact NH2-OG 3.12Å; R267-F272 HydrophobicContact CB-CE2 4.1Å; R267-F272 HydrophobicContact CB-CZ 4.36Å; R267-L284 WeakPolarHBondContact O-CD1 3.42Å
268	N	77.5	Confident	88.6	Confident	120 Å²	120	46.4 Å²	46.4	64%	0.642	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-36.7	178.9	-80.1	-21.1	0	0	0	113.8	A241	A241-N268 WeakPolarHBondContact CB-OD1 3.47Å
269	E	68.4	Low	88.8	Confident	178 Å²	178	44.3 Å²	44.3	83%	0.832	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-5.1	-167.7	-61	-173.8	172.5	0	0	114.6	R267	R267-E269 VanDerWaalsContact C-N 3.34Å; R267-E269 PolarHBondContact O-N 3.2Å
270	S	65.5	Low	88.9	Confident	26 Å²	26	42.9 Å²	42.9	18%	0.182	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-142.3	135.2	174.3	61.5	0	0	0	0	112.2	R267 F272	R267-S270 PolarHBondContact NE-OG 3.45Å; R267-S270 PolarHBondContact NH2-OG 3.23Å; R267-S270 VanDerWaalsContact NH2-OG 3.12Å; S270-F272 PolarHBondContact O-N 2.73Å
271	S	71.7	Confident	88.8	Confident	97 Å²	97	41.2 Å²	41.2	68%	0.678	21%	0.21	S	C	*	.			trans	-76.2	104.6	164.5	57.7	0	0	0	0	109.3
272	F	85.9	Confident	88.9	Confident	37 Å²	37	38.5 Å²	38.5	16%	0.162	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-63.2	152.6	161.6	-65.6	-47.6	0	0	0	109.9	H193 R264 R267 S270 L283	H193-F272 HydrophobicContact CB-CE2 4.17Å; H193-F272 HydrophobicContact CB-CZ 4.41Å; H193-F272 AromaticContact CG-CE2 3.95Å; H193-F272 AromaticContact CG-CZ 3.92Å; H193-F272 AromaticContact ND1-CZ 3.74Å; R264-F272 HydrophobicContact CG-CD2 4.49Å; R264-F272 HydrophobicContact CG-CE2 4.42Å; R267-F272 HydrophobicContact CB-CE2 4.1Å; R267-F272 HydrophobicContact CB-CZ 4.36Å; S270-F272 PolarHBondContact O-N 2.73Å; F272-L283 HydrophobicContact CB-CD2 4.07Å; F272-L283 WeakPolarHBondContact O-CD2 3.48Å
273	K	87.6	Confident	88.8	Confident	151 Å²	151	38.7 Å²	38.7	66%	0.657	20%	0.198	S	C	*	.	P	Polyproline II helix	trans	-88	158.2	169.4	-62.8	-179	-176.6	173.6	0	109.6	R264	R264-K273 PolarHBondContact NH2-O 2.97Å
274	Y	91.2	Very high	88.6	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.016	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-60.3	138.3	169.8	175.1	-95.9	0	0	0	110.3	V235 L293 Q297 V298 T305	V235-Y274 HydrophobicContact CG2-CD2 3.45Å; V235-Y274 VanDerWaalsContact CG2-CD2 3.45Å; V235-Y274 HydrophobicContact CG2-CE2 3.3Å; Y274-L293 HydrophobicContact CD1-CD1 4.45Å; Y274-L293 HydrophobicContact CD2-CD1 3.65Å; Y274-L293 HydrophobicContact CE2-CD1 4.32Å; Y274-L293 HydrophobicContact CG-CD1 3.71Å; Y274-Q297 HydrophobicContact CD1-CB 3.76Å; Y274-Q297 HydrophobicContact CE1-CB 4.01Å; Y274-Q297 PolarHBondContact O-OE1 2.81Å; Y274-V298 HydrophobicContact CD1-CG2 4.19Å; Y274-V298 HydrophobicContact CE1-CB 4.39Å; Y274-V298 HydrophobicContact CE1-CG2 3.82Å; Y274-T305 PolarHBondContact OH-OG1 2.94Å
275	E	92.1	Very high	88.3	Confident	20 Å²	20	41.4 Å²	41.4	9%	0.093	21%	0.212	C	C	.	.			trans	-120.3	125.3	178.5	-65.6	-68.4	175.8	0	0	111.1	L186 G277 L278 Q281	L186-E275 HydrophobicContact CD1-CB 4.17Å; L186-E275 HydrophobicContact CD1-CG 3.82Å; E275-G277 PolarHBondContact O-N 3.32Å; E275-L278 HydrophobicContact CB-CD1 3.87Å; E275-L278 HydrophobicContact CB-CG 4.01Å; E275-L278 HydrophobicContact CG-CD1 4.38Å; E275-Q281 PolarHBondContact O-NE2 3.25Å
276	S	90.3	Very high	87.9	Confident	16 Å²	16	43.6 Å²	43.6	11%	0.112	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	114.9	175.7	57.2	0	0	0	0	109.7	R134 Q297	R134-S276 PolarHBondContact NH1-OG 2.98Å; S276-Q297 WeakPolarHBondContact CB-O 3.43Å
277	G	89.5	Confident	87.6	Confident	11 Å²	11	48.7 Å²	48.7	11%	0.113	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	114.2	-9.4	173.3	0	0	0	0	0	116	V130 E275	V130-G277 VanDerWaalsContact CG2-O 3.26Å; V130-G277 WeakPolarHBondContact CG2-O 3.48Å; E275-G277 PolarHBondContact O-N 3.32Å
278	L	95.8	Very high	87.6	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	29%	0.289	C	S	.	.			trans	-76	148.5	166.9	-55.9	-177.7	0	0	0	110.3	L127 L186 M190 C262 R264 E275 Q281	L127-L278 HydrophobicContact CD2-CD2 4.4Å; L186-L278 HydrophobicContact CD1-CD1 4.22Å; L186-L278 HydrophobicContact CD1-CD2 4.33Å; M190-L278 HydrophobicContact CE-CD2 3.84Å; M190-L278 HydrophobicContact SD-CD1 3.8Å; M190-L278 HydrophobicContact SD-CD2 3.79Å; M190-L278 HydrophobicContact SD-CG 4.49Å; C262-L278 CarbonylContact O-C 3.58Å; C262-L278 WeakPolarHBondContact O-CA 3.26Å; C262-L278 VanDerWaalsContact O-CB 3.25Å; C262-L278 WeakPolarHBondContact O-CB 3.5Å; C262-L278 WeakPolarHBondContact O-CD2 3.4Å; R264-L278 HydrophobicContact CB-CD1 4.03Å; E275-L278 HydrophobicContact CB-CD1 3.87Å; E275-L278 HydrophobicContact CB-CG 4.01Å; E275-L278 HydrophobicContact CG-CD1 4.38Å; L278-Q281 HydrophobicContact CB-CG 3.59Å; L278-Q281 HydrophobicContact CD1-CG 3.75Å; L278-Q281 HydrophobicContact CG-CG 4.27Å
279	F	97.4	Very high	87.9	Confident	30 Å²	30	47.4 Å²	47.4	13%	0.132	28%	0.278	C	S	.	.	S	Bend	trans	-75.1	-66.9	179	-77.4	-90.9	0	0	0	110.5	C233 S234 L255 E259 C262 S263	C233-F279 CarbonylContact C-O 3.57Å; C233-F279 WeakPolarHBondContact CA-O 3.19Å; S234-F279 PolarHBondContact N-O 3.42Å; L255-F279 HydrophobicContact CD1-CB 3.83Å; L255-F279 HydrophobicContact CD1-CG 4.46Å; L255-F279 HydrophobicContact CD2-CD1 4.34Å; E259-F279 HydrophobicContact CB-CD1 4.47Å; E259-F279 HydrophobicContact CB-CD2 4.01Å; E259-F279 HydrophobicContact CB-CE2 4.02Å; E259-F279 HydrophobicContact CB-CG 4.22Å; E259-F279 HydrophobicContact CB-CZ 4.27Å; E259-F279 HydrophobicContact CG-CD2 4.25Å; E259-F279 HydrophobicContact CG-CE1 4.06Å; E259-F279 HydrophobicContact CG-CE2 3.76Å; E259-F279 HydrophobicContact CG-CZ 3.65Å; C262-F279 HydrophobicContact CB-CD2 3.62Å; C262-F279 HydrophobicContact CB-CE2 4.07Å; C262-F279 PolarHBondContact O-N 3.4Å; S263-F279 WeakPolarHBondContact OG-CB 3.39Å
280	V	98.2	Very high	88.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.4	178.9	-173.3	0	0	0	0	110.2	H227 S234 V236 V248 L251 L255 S263 R264	H227-V280 VanDerWaalsContact CE1-CG2 3.48Å; H227-V280 WeakPolarHBondContact CE1-CG2 3.2Å; S234-V280 CarbonylContact O-C 3.51Å; S234-V280 VanDerWaalsContact O-CA 3.3Å; S234-V280 WeakPolarHBondContact O-CA 3.14Å; V236-V280 HydrophobicContact CG2-CG1 4.39Å; V248-V280 HydrophobicContact CB-CG1 4.18Å; V248-V280 HydrophobicContact CG1-CB 4.49Å; V248-V280 HydrophobicContact CG1-CG1 3.8Å; V248-V280 HydrophobicContact CG2-CG1 4.07Å; L251-V280 HydrophobicContact CB-CG1 4.45Å; L251-V280 HydrophobicContact CB-CG2 4.32Å; L251-V280 HydrophobicContact CD1-CG1 4.39Å; L255-V280 HydrophobicContact CD1-CG2 3.84Å; S263-V280 CarbonylContact C-O 3.43Å; S263-V280 WeakPolarHBondContact CA-O 3.3Å; S263-V280 WeakPolarHBondContact CB-O 3.41Å; S263-V280 PolarHBondContact OG-N 3.25Å; R264-V280 PolarHBondContact N-O 2.93Å
281	Q	96.3	Very high	89.3	Confident	2 Å²	2	43 Å²	43	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.6	-179.9	-60.3	178	62.1	0	0	110.9	S234 V235 V236 R264 E275 L278	S234-Q281 PolarHBondContact O-N 3.45Å; V235-Q281 WeakPolarHBondContact CA-O 3.4Å; V236-Q281 PolarHBondContact N-O 2.86Å; R264-Q281 WeakPolarHBondContact O-CA 3.48Å; E275-Q281 PolarHBondContact O-NE2 3.25Å; L278-Q281 HydrophobicContact CB-CG 3.59Å; L278-Q281 HydrophobicContact CD1-CG 3.75Å; L278-Q281 HydrophobicContact CG-CG 4.27Å
282	G	96.1	Very high	89.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127	166.4	0	0	0	0	0	110.9	V236 V244 R264 C266	V236-G282 WeakPolarHBondContact O-CA 3.49Å; V244-G282 VanDerWaalsContact CG1-CA 3.48Å; R264-G282 PolarHBondContact O-N 3.13Å; C266-G282 WeakPolarHBondContact CB-O 3.44Å
283	L	93.9	Very high	89.6	Confident	9 Å²	9	44.1 Å²	44.1	5%	0.047	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.1	174.3	-58.1	178.2	0	0	0	109.8	V235 V236 V237 G238 F272	V235-L283 HydrophobicContact CG1-CD1 3.73Å; V235-L283 HydrophobicContact CG1-CG 4.22Å; V236-L283 PolarHBondContact O-N 2.65Å; V237-L283 WeakPolarHBondContact CA-O 3.33Å; V237-L283 HydrophobicContact CG1-CB 4.23Å; G238-L283 PolarHBondContact N-O 2.97Å; F272-L283 HydrophobicContact CB-CD2 4.07Å; F272-L283 WeakPolarHBondContact O-CD2 3.48Å
284	L	93.3	Very high	89.5	Confident	32 Å²	32	39 Å²	39	17%	0.168	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	144.5	175.2	-66.5	-177.3	0	0	0	110.9	G238 A241 V244 C266 R267	G238-L284 WeakPolarHBondContact O-CA 3.35Å; A241-L284 HydrophobicContact CB-CD1 4.38Å; A241-L284 HydrophobicContact CB-CD2 4.19Å; V244-L284 HydrophobicContact CG2-CD2 4.34Å; C266-L284 HydrophobicContact CB-CD2 4.45Å; C266-L284 HydrophobicContact CB-CG 4.29Å; R267-L284 WeakPolarHBondContact O-CD1 3.42Å
285	K	91	Very high	89.1	Confident	29 Å²	29	41.5 Å²	41.5	13%	0.126	26%	0.257	C	S	.	.			trans	-68.3	150.2	165.5	-68.1	172.6	-179.1	171.5	0	109.9	G238 G289 S290 F291 D309 D311	G238-K285 PolarHBondContact O-N 3.01Å; K285-G289 WeakPolarHBondContact CD-O 3.46Å; K285-S290 CarbonylContact C-O 3.49Å; K285-S290 VanDerWaalsContact CA-O 3.32Å; K285-S290 WeakPolarHBondContact CA-O 3.47Å; K285-F291 HydrophobicContact CG-CB 4.34Å; K285-F291 HydrophobicContact CG-CD1 4.43Å; K285-D309 WeakPolarHBondContact CE-OD2 3.35Å; K285-D309 IonicContact NZ-OD1 2.67Å; K285-D309 PolarHBondContact NZ-OD1 3.32Å; K285-D309 IonicContact NZ-OD2 2.71Å; K285-D309 PolarHBondContact NZ-OD2 2.78Å; K285-D311 WeakPolarHBondContact CD-OD2 3.32Å; K285-D311 WeakPolarHBondContact CE-OD2 3.41Å; K285-D311 IonicContact NZ-OD2 3.66Å; K285-D311 PolarHBondContact NZ-OD2 2.7Å
286	D	86.9	Confident	88.7	Confident	74 Å²	74	42.8 Å²	42.8	40%	0.396	26%	0.261	S	S	.	.			trans	-70.8	176.4	173	67.8	25	0	0	0	111.6	T288 G289 S290	D286-T288 VanDerWaalsContact CG-OG1 3.28Å; D286-T288 PolarHBondContact O-N 3.12Å; D286-T288 VanDerWaalsContact O-N 3.08Å; D286-T288 VanDerWaalsContact OD1-CA 3.27Å; D286-T288 WeakPolarHBondContact OD1-CA 2.97Å; D286-T288 WeakPolarHBondContact OD1-CB 3.36Å; D286-T288 PolarHBondContact OD1-N 3.39Å; D286-T288 PolarHBondContact OD1-OG1 3.17Å; D286-T288 PolarHBondContact OD2-OG1 2.95Å; D286-G289 PolarHBondContact O-N 3.43Å; D286-G289 PolarHBondContact OD1-N 3.02Å; D286-G289 VanDerWaalsContact OD1-N 3.11Å; D286-S290 PolarHBondContact N-O 2.86Å; D286-S290 PolarHBondContact OD1-N 2.92Å; D286-S290 PolarHBondContact OD2-OG 3.19Å
287	A	85.4	Confident	88.4	Confident	114 Å²	114	43.9 Å²	43.9	94%	0.942	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.3	179.2	0	0	0	0	0	114	G289	A287-G289 VanDerWaalsContact C-N 3.33Å
288	T	86.3	Confident	88.4	Confident	119 Å²	119	43.5 Å²	43.5	73%	0.73	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-2.2	175.2	73.1	0	0	0	0	112.7	D286 S290	D286-T288 VanDerWaalsContact CG-OG1 3.28Å; D286-T288 PolarHBondContact O-N 3.12Å; D286-T288 VanDerWaalsContact O-N 3.08Å; D286-T288 VanDerWaalsContact OD1-CA 3.27Å; D286-T288 WeakPolarHBondContact OD1-CA 2.97Å; D286-T288 WeakPolarHBondContact OD1-CB 3.36Å; D286-T288 PolarHBondContact OD1-N 3.39Å; D286-T288 PolarHBondContact OD1-OG1 3.17Å; D286-T288 PolarHBondContact OD2-OG1 2.95Å; T288-S290 VanDerWaalsContact C-N 3.28Å; T288-S290 WeakPolarHBondContact OG1-CB 3.44Å
289	G	82.4	Confident	88.1	Confident	41 Å²	41	43.8 Å²	43.8	42%	0.423	26%	0.261	S	S	.	.	S	Bend	trans	77.7	15	-174.3	0	0	0	0	0	113.1	K285 D286 A287	K285-G289 WeakPolarHBondContact CD-O 3.46Å; D286-G289 PolarHBondContact O-N 3.43Å; D286-G289 PolarHBondContact OD1-N 3.02Å; D286-G289 VanDerWaalsContact OD1-N 3.11Å; A287-G289 VanDerWaalsContact C-N 3.33Å
290	S	81.9	Confident	87.7	Confident	50 Å²	50	43.8 Å²	43.8	35%	0.35	26%	0.26	S	S	.	.			trans	-103.4	159.5	-179.7	104.3	0	0	0	0	111	K285 D286 T288	K285-S290 CarbonylContact C-O 3.49Å; K285-S290 VanDerWaalsContact CA-O 3.32Å; K285-S290 WeakPolarHBondContact CA-O 3.47Å; D286-S290 PolarHBondContact N-O 2.86Å; D286-S290 PolarHBondContact OD1-N 2.92Å; D286-S290 PolarHBondContact OD2-OG 3.19Å; T288-S290 VanDerWaalsContact C-N 3.28Å; T288-S290 WeakPolarHBondContact OG1-CB 3.44Å
291	F	82.6	Confident	87.4	Confident	61 Å²	61	43.9 Å²	43.9	27%	0.268	26%	0.261	S	S	.	.			trans	-145.1	149.7	167.4	77.9	-76.2	0	0	0	108.6	V237 K285 L293 H307	V237-F291 HydrophobicContact CB-CD1 4.39Å; V237-F291 HydrophobicContact CB-CG 4.5Å; V237-F291 HydrophobicContact CG1-CD1 4.32Å; V237-F291 HydrophobicContact CG1-CD2 3.74Å; V237-F291 HydrophobicContact CG1-CE1 4.37Å; V237-F291 HydrophobicContact CG1-CE2 3.75Å; V237-F291 HydrophobicContact CG1-CG 4.06Å; V237-F291 HydrophobicContact CG1-CZ 4.13Å; V237-F291 HydrophobicContact CG2-CD1 4.29Å; V237-F291 HydrophobicContact CG2-CE1 4Å; V237-F291 HydrophobicContact CG2-CZ 4.26Å; K285-F291 HydrophobicContact CG-CB 4.34Å; K285-F291 HydrophobicContact CG-CD1 4.43Å; F291-L293 HydrophobicContact CD2-CB 4.43Å; F291-L293 HydrophobicContact CE2-CB 3.82Å; F291-H307 AromaticContact CE1-NE2 3.57Å; F291-H307 AromaticContact CE2-NE2 3.78Å; F291-H307 AromaticContact CZ-CD2 3.64Å; F291-H307 AromaticContact CZ-CE1 3.95Å; F291-H307 AromaticContact CZ-NE2 2.98Å; F291-H307 WeakPolarHBondContact CZ-NE2 3.47Å
292	V	79.8	Confident	87.2	Confident	121 Å²	121	45.2 Å²	45.2	73%	0.733	27%	0.27	S	S	*	.			trans	-105	120.6	179.4	-179.6	0	0	0	0	108.7	P294	V292-P294 WeakPolarHBondContact O-CD 3.49Å
293	L	83.9	Confident	87.1	Confident	38 Å²	38	46 Å²	46	20%	0.199	27%	0.273	C	S	.	.			trans	-105.2	106.4	171.2	-165.6	62	0	0	0	109.3	Y274 F291 F295 V298 F367	Y274-L293 HydrophobicContact CD1-CD1 4.45Å; Y274-L293 HydrophobicContact CD2-CD1 3.65Å; Y274-L293 HydrophobicContact CE2-CD1 4.32Å; Y274-L293 HydrophobicContact CG-CD1 3.71Å; F291-L293 HydrophobicContact CD2-CB 4.43Å; F291-L293 HydrophobicContact CE2-CB 3.82Å; L293-F295 PolarHBondContact O-N 3.38Å; L293-V298 HydrophobicContact CD1-CG2 3.93Å; L293-V298 HydrophobicContact CD2-CG2 3.95Å; L293-V298 HydrophobicContact CG-CG2 3.62Å; L293-F367 HydrophobicContact CD2-CD2 4.32Å; L293-F367 HydrophobicContact CD2-CE2 3.33Å; L293-F367 HydrophobicContact CD2-CZ 3.52Å
294	P	84.7	Confident	87.1	Confident	42 Å²	42	45.6 Å²	45.6	27%	0.273	27%	0.271	S	S	.	.			trans	-68.5	110.1	-175.4	-20.3	34	0	0	0	110.9	V292 R296 Q297 V298	V292-P294 WeakPolarHBondContact O-CD 3.49Å; P294-R296 PolarHBondContact O-N 3.18Å; P294-Q297 HydrophobicContact CB-CB 4.2Å; P294-Q297 HydrophobicContact CB-CG 4.03Å; P294-Q297 PolarHBondContact O-N 2.92Å; P294-V298 PolarHBondContact O-N 2.71Å; P294-V298 VanDerWaalsContact O-N 3.1Å
295	F	83.9	Confident	87.2	Confident	57 Å²	57	44.3 Å²	44.3	25%	0.25	26%	0.264	C	S	.	.	H	α-helix	trans	-48.2	-47.4	-179.8	170.5	-114.5	0	0	0	112.4	L293 Q297 V298 M299 Y331 P362 V366	L293-F295 PolarHBondContact O-N 3.38Å; F295-Q297 PolarHBondContact O-N 3.34Å; F295-V298 PolarHBondContact O-N 3.3Å; F295-M299 HydrophobicContact CD2-CG 3.95Å; F295-M299 HydrophobicContact CE1-CG 4.22Å; F295-M299 HydrophobicContact CE2-CG 3.41Å; F295-M299 VanDerWaalsContact CE2-CG 3.41Å; F295-M299 HydrophobicContact CE2-SD 3.77Å; F295-M299 HydrophobicContact CZ-CG 3.6Å; F295-M299 HydrophobicContact CZ-SD 4.2Å; F295-M299 WeakPolarHBondContact O-CG 3.35Å; F295-M299 PolarHBondContact O-N 2.62Å; F295-Y331 HydrophobicContact CD1-CE2 4.26Å; F295-Y331 HydrophobicContact CE1-CD2 4Å; F295-Y331 AromaticContact CE1-CE2 3.6Å; F295-Y331 HydrophobicContact CE1-CE2 3.6Å; F295-Y331 HydrophobicContact CZ-CD2 4.45Å; F295-Y331 HydrophobicContact CZ-CE2 4.46Å; F295-P362 HydrophobicContact CE1-CB 3.81Å; F295-P362 HydrophobicContact CE1-CG 4.37Å; F295-P362 HydrophobicContact CZ-CB 3.72Å; F295-V366 HydrophobicContact CD2-CG2 3.45Å; F295-V366 VanDerWaalsContact CD2-CG2 3.45Å; F295-V366 HydrophobicContact CE2-CG2 3.2Å; F295-V366 HydrophobicContact CZ-CG2 4.39Å
296	R	83.4	Confident	87.5	Confident	47 Å²	47	42.9 Å²	42.9	18%	0.177	26%	0.258	C	S	.	.	H	α-helix	trans	-53.7	-48.8	178.4	178.5	173.4	175	173.1	3.2	112.7	P294 M299 Y300 Y331 E335	P294-R296 PolarHBondContact O-N 3.18Å; R296-M299 PolarHBondContact O-N 2.61Å; R296-Y300 HydrophobicContact CG-CD2 4.31Å; R296-Y300 HydrophobicContact CG-CE1 4.26Å; R296-Y300 HydrophobicContact CG-CE2 3.59Å; R296-Y300 PolarHBondContact NE-OH 3.34Å; R296-Y300 PolarHBondContact NH2-OH 3.13Å; R296-Y300 WeakPolarHBondContact O-CD1 3.5Å; R296-Y300 WeakPolarHBondContact O-CD2 3.34Å; R296-Y300 VanDerWaalsContact O-CG 3.25Å; R296-Y300 PolarHBondContact O-N 2.89Å; R296-Y300 VanDerWaalsContact O-N 3.16Å; R296-Y331 HydrophobicContact CB-CE1 4.38Å; R296-Y331 WeakPolarHBondContact CB-OH 3.36Å; R296-Y331 HydrophobicContact CG-CE1 4.05Å; R296-E335 IonicContact CZ-OE1 3.85Å; R296-E335 IonicContact NE-OE1 3.11Å; R296-E335 PolarHBondContact NE-OE1 3.04Å; R296-E335 IonicContact NE-OE2 2.7Å; R296-E335 IonicContact NH1-OE1 2.88Å; R296-E335 IonicContact NH2-OE1 2.7Å; R296-E335 PolarHBondContact NH2-OE1 3.28Å
297	Q	84.3	Confident	87.9	Confident	40 Å²	40	40.2 Å²	40.2	19%	0.187	24%	0.243	C	C	.	.	H	α-helix	trans	-70.5	-37	-177.7	-64.1	178.4	-10.2	0	0	111.8	Y274 S276 P294 F295 M299 Y300 A301	Y274-Q297 HydrophobicContact CD1-CB 3.76Å; Y274-Q297 HydrophobicContact CE1-CB 4.01Å; Y274-Q297 PolarHBondContact O-OE1 2.81Å; S276-Q297 WeakPolarHBondContact CB-O 3.43Å; P294-Q297 HydrophobicContact CB-CB 4.2Å; P294-Q297 HydrophobicContact CB-CG 4.03Å; P294-Q297 PolarHBondContact O-N 2.92Å; F295-Q297 PolarHBondContact O-N 3.34Å; Q297-M299 VanDerWaalsContact C-N 3.32Å; Q297-M299 PolarHBondContact O-N 3.38Å; Q297-Y300 PolarHBondContact O-N 3.07Å; Q297-A301 PolarHBondContact O-N 3.17Å
298	V	89.7	Confident	88.5	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-43.4	174.4	174.2	0	0	0	0	110.7	Y274 L293 P294 F295 Y300 A301 M318 F367	Y274-V298 HydrophobicContact CD1-CG2 4.19Å; Y274-V298 HydrophobicContact CE1-CB 4.39Å; Y274-V298 HydrophobicContact CE1-CG2 3.82Å; L293-V298 HydrophobicContact CD1-CG2 3.93Å; L293-V298 HydrophobicContact CD2-CG2 3.95Å; L293-V298 HydrophobicContact CG-CG2 3.62Å; P294-V298 PolarHBondContact O-N 2.71Å; P294-V298 VanDerWaalsContact O-N 3.1Å; F295-V298 PolarHBondContact O-N 3.3Å; V298-Y300 PolarHBondContact O-N 2.92Å; V298-A301 WeakPolarHBondContact O-CB 3.15Å; V298-A301 PolarHBondContact O-N 3.29Å; V298-A301 VanDerWaalsContact O-N 3.16Å; V298-M318 HydrophobicContact CG1-CE 3.86Å; V298-M318 HydrophobicContact CG1-SD 3.32Å; V298-M318 WeakPolarHBondContact CG1-SD 3.29Å; V298-F367 HydrophobicContact CG1-CE2 4.27Å; V298-F367 HydrophobicContact CG1-CZ 4.08Å
299	M	89.1	Confident	88.9	Confident	11 Å²	11	29.8 Å²	29.8	5%	0.054	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-26.3	177	-68.6	-54.4	-61.3	0	0	113	F295 R296 Q297 A301 M318 N327 Q328 Y331 V366	F295-M299 HydrophobicContact CD2-CG 3.95Å; F295-M299 HydrophobicContact CE1-CG 4.22Å; F295-M299 HydrophobicContact CE2-CG 3.41Å; F295-M299 VanDerWaalsContact CE2-CG 3.41Å; F295-M299 HydrophobicContact CE2-SD 3.77Å; F295-M299 HydrophobicContact CZ-CG 3.6Å; F295-M299 HydrophobicContact CZ-SD 4.2Å; F295-M299 WeakPolarHBondContact O-CG 3.35Å; F295-M299 PolarHBondContact O-N 2.62Å; R296-M299 PolarHBondContact O-N 2.61Å; Q297-M299 VanDerWaalsContact C-N 3.32Å; Q297-M299 PolarHBondContact O-N 3.38Å; M299-A301 VanDerWaalsContact C-N 3.35Å; M299-M318 HydrophobicContact SD-CE 4.27Å; M299-N327 HydrophobicContact CE-CB 3.65Å; M299-Q328 WeakPolarHBondContact O-CB 3.3Å; M299-Q328 WeakPolarHBondContact O-CG 3.31Å; M299-Q328 PolarHBondContact O-NE2 3.39Å; M299-Y331 HydrophobicContact CB-CD1 4.04Å; M299-Y331 HydrophobicContact CB-CE1 4.46Å; M299-Y331 HydrophobicContact CB-CG 4.45Å; M299-V366 HydrophobicContact SD-CG1 4.23Å
300	Y	88.6	Confident	89.5	Confident	30 Å²	30	28.5 Å²	28.5	12%	0.118	15%	0.151	C	C	.	.	H	α-helix	trans	-80.1	-12.1	175	-63	-20	0	0	0	114.6	H137 R296 Q297 V298 Q328 Y331 M332 E335	H137-Y300 AromaticContact CE1-CE2 3.77Å; H137-Y300 AromaticContact CE1-CZ 3.4Å; H137-Y300 VanDerWaalsContact CE1-CZ 3.4Å; H137-Y300 PolarHBondContact CE1-OH 2.78Å; H137-Y300 AromaticContact NE2-CE2 3.48Å; H137-Y300 WeakPolarHBondContact NE2-CE2 3.38Å; H137-Y300 AromaticContact NE2-CZ 3.51Å; H137-Y300 PolarHBondContact NE2-OH 3.41Å; H137-Y300 VanDerWaalsContact NE2-OH 3.15Å; R296-Y300 HydrophobicContact CG-CD2 4.31Å; R296-Y300 HydrophobicContact CG-CE1 4.26Å; R296-Y300 HydrophobicContact CG-CE2 3.59Å; R296-Y300 PolarHBondContact NE-OH 3.34Å; R296-Y300 PolarHBondContact NH2-OH 3.13Å; R296-Y300 WeakPolarHBondContact O-CD1 3.5Å; R296-Y300 WeakPolarHBondContact O-CD2 3.34Å; R296-Y300 VanDerWaalsContact O-CG 3.25Å; R296-Y300 PolarHBondContact O-N 2.89Å; R296-Y300 VanDerWaalsContact O-N 3.16Å; Q297-Y300 PolarHBondContact O-N 3.07Å; V298-Y300 PolarHBondContact O-N 2.92Å; Y300-Q328 PolarHBondContact O-NE2 3.31Å; Y300-Q328 VanDerWaalsContact O-NE2 3.13Å; Y300-Y331 AromaticContact CE1-CD1 3.99Å; Y300-Y331 HydrophobicContact CE1-CD1 3.99Å; Y300-Y331 AromaticContact CE1-CE1 3.84Å; Y300-Y331 HydrophobicContact CE1-CE1 3.84Å; Y300-M332 HydrophobicContact CD1-CG 3.88Å; Y300-M332 HydrophobicContact CD1-SD 4.35Å; Y300-M332 HydrophobicContact CE1-CG 3.73Å; Y300-E335 PolarHBondContact OH-OE1 3.25Å; Y300-E335 PolarHBondContact OH-OE2 2.79Å
301	A	91.9	Very high	90	Very high	2 Å²	2	28.8 Å²	28.8	2%	0.017	15%	0.149	C	C	.	.	S	Bend	trans	-59.6	141	176.5	0	0	0	0	0	110.5	Q297 V298 M299 Y303 H324 Q328	Q297-A301 PolarHBondContact O-N 3.17Å; V298-A301 WeakPolarHBondContact O-CB 3.15Å; V298-A301 PolarHBondContact O-N 3.29Å; V298-A301 VanDerWaalsContact O-N 3.16Å; M299-A301 VanDerWaalsContact C-N 3.35Å; A301-Y303 WeakPolarHBondContact CB-O 3.38Å; A301-Y303 PolarHBondContact O-N 3.47Å; A301-H324 PolarHBondContact O-NE2 3.42Å; A301-Q328 PolarHBondContact O-NE2 2.89Å
302	P	91.4	Very high	90.5	Very high	30 Å²	30	30.1 Å²	30.1	20%	0.195	16%	0.162	C	C	.	.	S	Bend	trans	-66.5	-23.2	-178.9	25.8	-34	0	0	0	113
303	Y	94.4	Very high	91.2	Very high	17 Å²	17	28 Å²	28	7%	0.067	15%	0.146	C	C	.	.	S	Bend	trans	-128.9	155.2	-180	-60.7	-60.2	0	0	0	110.6	C231 A301	C231-Y303 HydrophobicContact CB-CD1 3.87Å; C231-Y303 HydrophobicContact CB-CD2 4.31Å; C231-Y303 HydrophobicContact CB-CE1 4.48Å; C231-Y303 HydrophobicContact CB-CG 3.77Å; A301-Y303 WeakPolarHBondContact CB-O 3.38Å; A301-Y303 PolarHBondContact O-N 3.47Å
304	P	94.6	Very high	91.7	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	15%	0.152	C	C	.	.			trans	-59.9	153	172	26.8	-35.4	0	0	0	110.5	T230 C233 M318 P319 C321 H324	T230-P304 HydrophobicContact CG2-CB 4.42Å; T230-P304 HydrophobicContact CG2-CG 4.45Å; C233-P304 VanDerWaalsContact CB-O 3.24Å; C233-P304 WeakPolarHBondContact CB-O 3.48Å; P304-M318 HydrophobicContact CB-CB 3.63Å; P304-P319 VanDerWaalsContact CB-O 3.27Å; P304-P319 WeakPolarHBondContact CB-O 3.48Å; P304-C321 HydrophobicContact CG-CB 4.34Å; P304-H324 HydrophobicContact CB-CB 4.17Å
305	T	95.6	Very high	92.2	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.025	14%	0.144	C	C	.	.			trans	-114.4	140.1	-177.2	-62.5	0	0	0	0	110.7	V235 Y274 M318 F367	V235-T305 HydrophobicContact CB-CG2 4.3Å; V235-T305 HydrophobicContact CG2-CG2 3.72Å; Y274-T305 PolarHBondContact OH-OG1 2.94Å; T305-M318 PolarHBondContact N-SD 3.17Å; T305-M318 WeakPolarHBondContact O-CB 3.42Å; T305-M318 VanDerWaalsContact O-CG 3.25Å; T305-M318 WeakPolarHBondContact O-CG 3.43Å; T305-M318 PolarHBondContact O-N 2.79Å; T305-F367 WeakPolarHBondContact O-CE1 3.31Å
306	T	96.8	Very high	92.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.5	163.3	-59.7	0	0	0	0	110.2	S226 T230 C233 S234 V235 I308 V315 K316	S226-T306 VanDerWaalsContact C-OG1 3.32Å; S226-T306 PolarHBondContact O-OG1 2.97Å; S226-T306 WeakPolarHBondContact OG-CG2 3.24Å; S226-T306 PolarHBondContact OG-OG1 2.8Å; T230-T306 VanDerWaalsContact CG2-OG1 3.24Å; T230-T306 WeakPolarHBondContact CG2-OG1 3.4Å; T230-T306 PolarHBondContact OG1-OG1 2.97Å; C233-T306 PolarHBondContact O-N 3.04Å; S234-T306 CarbonylContact C-O 3.52Å; S234-T306 VanDerWaalsContact CA-O 3.3Å; S234-T306 WeakPolarHBondContact CA-O 3.47Å; V235-T306 PolarHBondContact N-O 2.9Å; T306-I308 HydrophobicContact CG2-CD1 4.09Å; T306-I308 HydrophobicContact CG2-CG1 3.7Å; T306-V315 HydrophobicContact CG2-CG1 3.56Å; T306-K316 CarbonylContact C-O 3.55Å; T306-K316 WeakPolarHBondContact CA-O 3.36Å; T306-K316 WeakPolarHBondContact CG2-O 3.38Å
307	H	96.1	Very high	93.2	Very high	17 Å²	17	27.6 Å²	27.6	8%	0.079	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.6	172	171.3	-89.8	0	0	0	110.1	V237 F291 V315 K316 F367	V237-H307 WeakPolarHBondContact CG2-NE2 3.32Å; F291-H307 AromaticContact CE1-NE2 3.57Å; F291-H307 AromaticContact CE2-NE2 3.78Å; F291-H307 AromaticContact CZ-CD2 3.64Å; F291-H307 AromaticContact CZ-CE1 3.95Å; F291-H307 AromaticContact CZ-NE2 2.98Å; F291-H307 WeakPolarHBondContact CZ-NE2 3.47Å; H307-V315 WeakPolarHBondContact O-CA 3.36Å; H307-K316 HydrophobicContact CB-CB 4.43Å; H307-K316 PolarHBondContact N-O 2.69Å; H307-K316 PolarHBondContact O-N 3.29Å; H307-F367 HydrophobicContact CB-CD1 3.52Å; H307-F367 HydrophobicContact CB-CE1 3.49Å; H307-F367 VanDerWaalsContact CB-CE1 3.49Å; H307-F367 HydrophobicContact CB-CG 4.22Å; H307-F367 HydrophobicContact CB-CZ 4.19Å
308	I	96.8	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.1	-176.3	-58.1	171.4	0	0	0	108.5	F219 A223 V235 V236 V237 I247 L251 T306 V310 V315	F219-I308 HydrophobicContact CE2-CG2 3.76Å; F219-I308 HydrophobicContact CZ-CG2 3.64Å; A223-I308 HydrophobicContact CB-CD1 4.03Å; V235-I308 PolarHBondContact O-N 2.82Å; V236-I308 CarbonylContact C-O 3.19Å; V236-I308 WeakPolarHBondContact CA-O 3.37Å; V236-I308 HydrophobicContact CG2-CB 4.46Å; V236-I308 HydrophobicContact CG2-CD1 4.46Å; V237-I308 WeakPolarHBondContact CG2-O 3.4Å; V237-I308 PolarHBondContact N-O 3.16Å; I247-I308 HydrophobicContact CG2-CG2 4.5Å; L251-I308 HydrophobicContact CD1-CD1 3.49Å; L251-I308 VanDerWaalsContact CD1-CD1 3.49Å; T306-I308 HydrophobicContact CG2-CD1 4.09Å; T306-I308 HydrophobicContact CG2-CG1 3.7Å; I308-V310 HydrophobicContact CG2-CG1 4.44Å; I308-V315 HydrophobicContact CG1-CG1 4.2Å; I308-V315 HydrophobicContact CG1-CG2 4.48Å; I308-V315 HydrophobicContact CG2-CG2 4.47Å
309	D	95.4	Very high	93.5	Very high	15 Å²	15	26.7 Å²	26.7	8%	0.08	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.7	174.3	-169.6	-34.1	0	0	0	110.4	V237 K285 D311 V312 N313 T314	V237-D309 HydrophobicContact CG2-CB 3.75Å; V237-D309 WeakPolarHBondContact O-CA 3.36Å; K285-D309 WeakPolarHBondContact CE-OD2 3.35Å; K285-D309 IonicContact NZ-OD1 2.67Å; K285-D309 PolarHBondContact NZ-OD1 3.32Å; K285-D309 IonicContact NZ-OD2 2.71Å; K285-D309 PolarHBondContact NZ-OD2 2.78Å; D309-D311 PolarHBondContact OD1-N 2.81Å; D309-V312 HydrophobicContact CB-CG2 3.73Å; D309-V312 VanDerWaalsContact CG-CG2 3.43Å; D309-V312 PolarHBondContact OD1-N 3.01Å; D309-N313 VanDerWaalsContact O-CA 3.27Å; D309-N313 WeakPolarHBondContact O-CA 3.46Å; D309-N313 PolarHBondContact O-N 2.65Å; D309-T314 PolarHBondContact N-O 2.7Å; D309-T314 PolarHBondContact O-N 2.99Å; D309-T314 VanDerWaalsContact O-N 3.09Å
310	V	95.3	Very high	93.5	Very high	13 Å²	13	28.1 Å²	28.1	8%	0.079	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.3	-174.9	-51.7	0	0	0	0	113.6	F219 V236 V237 K243 V244 I247 I308	F219-V310 HydrophobicContact CZ-CG1 4.3Å; V236-V310 HydrophobicContact CG1-CG1 3.54Å; V237-V310 WeakPolarHBondContact O-CG2 3.5Å; V237-V310 PolarHBondContact O-N 2.59Å; K243-V310 HydrophobicContact CB-CG2 4.1Å; V244-V310 HydrophobicContact CG2-CG2 3.97Å; I247-V310 HydrophobicContact CB-CG1 4.25Å; I247-V310 HydrophobicContact CG1-CG1 3.77Å; I247-V310 HydrophobicContact CG2-CG1 4.49Å; I308-V310 HydrophobicContact CG2-CG1 4.44Å
311	D	92	Very high	93.5	Very high	57 Å²	57	26.8 Å²	26.8	31%	0.305	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-36.7	177.7	-60.5	-34	0	0	0	111	G238 S239 K285 D309	G238-D311 WeakPolarHBondContact CA-OD2 3.27Å; S239-D311 WeakPolarHBondContact CB-OD2 3.48Å; S239-D311 PolarHBondContact N-OD1 2.88Å; S239-D311 VanDerWaalsContact N-OD1 3.16Å; S239-D311 PolarHBondContact N-OD2 3.11Å; S239-D311 PolarHBondContact OG-OD2 2.92Å; K285-D311 WeakPolarHBondContact CD-OD2 3.32Å; K285-D311 WeakPolarHBondContact CE-OD2 3.41Å; K285-D311 IonicContact NZ-OD2 3.66Å; K285-D311 PolarHBondContact NZ-OD2 2.7Å; D309-D311 PolarHBondContact OD1-N 2.81Å
312	V	92.6	Very high	93.3	Very high	89 Å²	89	28 Å²	28	54%	0.539	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	1.6	179.6	-63.5	0	0	0	0	113.4	D309 T314	D309-V312 HydrophobicContact CB-CG2 3.73Å; D309-V312 VanDerWaalsContact CG-CG2 3.43Å; D309-V312 PolarHBondContact OD1-N 3.01Å; V312-T314 VanDerWaalsContact C-N 3.31Å; V312-T314 HydrophobicContact CB-CG2 4.18Å; V312-T314 HydrophobicContact CG2-CG2 3.61Å; V312-T314 WeakPolarHBondContact CG2-OG1 3.16Å; V312-T314 PolarHBondContact O-N 2.7Å
313	N	94.1	Very high	93.1	Very high	76 Å²	76	30.7 Å²	30.7	41%	0.406	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	43.8	-177.9	-62.8	-38.5	0	0	0	113.2	F219 D309	F219-N313 HydrophobicContact CB-CB 4.17Å; F219-N313 VanDerWaalsContact CD2-C 3.44Å; F219-N313 HydrophobicContact CD2-CB 3.8Å; F219-N313 WeakPolarHBondContact CD2-O 3.33Å; F219-N313 HydrophobicContact CE2-CB 4.38Å; F219-N313 HydrophobicContact CG-CB 3.97Å; D309-N313 VanDerWaalsContact O-CA 3.27Å; D309-N313 WeakPolarHBondContact O-CA 3.46Å; D309-N313 PolarHBondContact O-N 2.65Å
314	T	94.3	Very high	93	Very high	54 Å²	54	30 Å²	30	33%	0.331	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	144	178.7	66.7	0	0	0	0	111.3	D309 V312	D309-T314 PolarHBondContact N-O 2.7Å; D309-T314 PolarHBondContact O-N 2.99Å; D309-T314 VanDerWaalsContact O-N 3.09Å; V312-T314 VanDerWaalsContact C-N 3.31Å; V312-T314 HydrophobicContact CB-CG2 4.18Å; V312-T314 HydrophobicContact CG2-CG2 3.61Å; V312-T314 WeakPolarHBondContact CG2-OG1 3.16Å; V312-T314 PolarHBondContact O-N 2.7Å
315	V	96.3	Very high	92.7	Very high	16 Å²	16	31.8 Å²	31.8	10%	0.097	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	121.4	175.9	-174.9	0	0	0	0	108.1	F219 N222 A223 T306 H307 I308 I370	F219-V315 HydrophobicContact CD2-CG2 3.89Å; F219-V315 HydrophobicContact CE2-CG2 3.87Å; N222-V315 HydrophobicContact CB-CB 4.21Å; N222-V315 HydrophobicContact CB-CG2 4.05Å; A223-V315 HydrophobicContact CB-CG2 4.19Å; T306-V315 HydrophobicContact CG2-CG1 3.56Å; H307-V315 WeakPolarHBondContact O-CA 3.36Å; I308-V315 HydrophobicContact CG1-CG1 4.2Å; I308-V315 HydrophobicContact CG1-CG2 4.48Å; I308-V315 HydrophobicContact CG2-CG2 4.47Å; V315-I370 HydrophobicContact CB-CD1 3.98Å; V315-I370 HydrophobicContact CG1-CD1 3.77Å; V315-I370 HydrophobicContact CG1-CG1 4.41Å
316	K	94.8	Very high	92.3	Very high	85 Å²	85	35.2 Å²	35.2	37%	0.37	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	149.6	174.6	-60.1	-173.3	174.4	-174.7	0	110	T306 H307 F367 Q368	T306-K316 CarbonylContact C-O 3.55Å; T306-K316 WeakPolarHBondContact CA-O 3.36Å; T306-K316 WeakPolarHBondContact CG2-O 3.38Å; H307-K316 HydrophobicContact CB-CB 4.43Å; H307-K316 PolarHBondContact N-O 2.69Å; H307-K316 PolarHBondContact O-N 3.29Å; K316-F367 HydrophobicContact CB-CB 3.86Å; K316-F367 HydrophobicContact CB-CD1 4.36Å; K316-F367 HydrophobicContact CD-CB 4.15Å; K316-Q368 CarbonylContact C-O 3.53Å; K316-Q368 WeakPolarHBondContact CA-O 3.15Å
317	Q	93	Very high	91.9	Very high	21 Å²	21	37.7 Å²	37.7	10%	0.098	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.7	-171.5	-162	179.6	0.6	0	0	110.7	S226 Q229 T230 Q368	S226-Q317 VanDerWaalsContact OG-CG 3.23Å; S226-Q317 WeakPolarHBondContact OG-CG 3.28Å; Q229-Q317 VanDerWaalsContact CB-NE2 3.27Å; Q229-Q317 VanDerWaalsContact OE1-NE2 3.16Å; T230-Q317 HydrophobicContact CG2-CG 3.39Å; Q317-Q368 PolarHBondContact N-O 2.88Å; Q317-Q368 PolarHBondContact O-N 3.11Å
318	M	92.5	Very high	91.5	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.025	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-75.1	160.3	165.5	-77.7	-173.3	69.5	0	0	111.8	V298 M299 P304 T305 H324 V366 F367	V298-M318 HydrophobicContact CG1-CE 3.86Å; V298-M318 HydrophobicContact CG1-SD 3.32Å; V298-M318 WeakPolarHBondContact CG1-SD 3.29Å; M299-M318 HydrophobicContact SD-CE 4.27Å; P304-M318 HydrophobicContact CB-CB 3.63Å; T305-M318 PolarHBondContact N-SD 3.17Å; T305-M318 WeakPolarHBondContact O-CB 3.42Å; T305-M318 VanDerWaalsContact O-CG 3.25Å; T305-M318 WeakPolarHBondContact O-CG 3.43Å; T305-M318 PolarHBondContact O-N 2.79Å; M318-H324 WeakPolarHBondContact CE-ND1 3.49Å; M318-V366 HydrophobicContact CE-CG1 3.6Å; M318-V366 HydrophobicContact CG-CG1 3.99Å; M318-V366 HydrophobicContact SD-CG1 4.16Å; M318-F367 HydrophobicContact CG-CD1 4.02Å; M318-F367 HydrophobicContact CG-CE1 3.71Å; M318-F367 HydrophobicContact CG-CZ 4.06Å; M318-F367 HydrophobicContact SD-CE1 4.31Å; M318-F367 HydrophobicContact SD-CZ 4.16Å
319	P	88.9	Confident	90.9	Very high	17 Å²	17	44.8 Å²	44.8	11%	0.11	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-60.7	161.6	176.4	27.2	-36.9	0	0	0	112.1	P304 E323	P304-P319 VanDerWaalsContact CB-O 3.27Å; P304-P319 WeakPolarHBondContact CB-O 3.48Å; P319-E323 HydrophobicContact CB-CB 4.03Å; P319-E323 WeakPolarHBondContact CB-OE2 3.41Å; P319-E323 HydrophobicContact CG-CB 4.45Å
320	P	87.7	Confident	90.4	Very high	41 Å²	41	48.4 Å²	48.4	27%	0.266	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-56.2	157.6	-178.9	-24.7	34.1	0	0	0	113.5	H322 E323 H324	P320-H322 VanDerWaalsContact C-N 3.32Å; P320-H322 PolarHBondContact O-N 2.83Å; P320-H322 VanDerWaalsContact O-N 3.1Å; P320-E323 PolarHBondContact O-N 3.17Å; P320-H324 PolarHBondContact O-N 3.34Å
321	C	89.9	Confident	89.9	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.014	24%	0.236	C	C	.	.	H	α-helix	trans	-53.1	-40.3	-168.9	-174.1	0	0	0	0	114.9	P304 E323 H324 I325	P304-C321 HydrophobicContact CG-CB 4.34Å; C321-E323 PolarHBondContact O-N 2.8Å; C321-H324 PolarHBondContact O-N 2.95Å; C321-I325 WeakPolarHBondContact O-CB 3.43Å; C321-I325 VanDerWaalsContact O-CG1 3.27Å; C321-I325 WeakPolarHBondContact O-CG1 3.38Å; C321-I325 PolarHBondContact O-N 2.89Å; C321-I325 VanDerWaalsContact SG-CD1 3.54Å
322	H	86.5	Confident	89.4	Confident	29 Å²	29	47.9 Å²	47.9	13%	0.134	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-41.1	176.8	66.3	-66.3	0	0	0	113.8	P320 Y326 H460	P320-H322 VanDerWaalsContact C-N 3.32Å; P320-H322 PolarHBondContact O-N 2.83Å; P320-H322 VanDerWaalsContact O-N 3.1Å; H322-Y326 VanDerWaalsContact O-CB 3.3Å; H322-Y326 WeakPolarHBondContact O-CB 3.45Å; H322-Y326 PolarHBondContact O-N 3.22Å; H322-H460 HydrophobicContact CB-CB 4.03Å; H322-H460 AromaticContact ND1-ND1 3.76Å
323	E	88.6	Confident	88.7	Confident	86 Å²	86	45.9 Å²	45.9	40%	0.402	21%	0.213	S	C	.	.	H	α-helix	trans	-70.9	-41	177.1	-64.5	-171.4	-172.9	0	0	110.5	P319 P320 C321 Y326 N327	P319-E323 HydrophobicContact CB-CB 4.03Å; P319-E323 WeakPolarHBondContact CB-OE2 3.41Å; P319-E323 HydrophobicContact CG-CB 4.45Å; P320-E323 PolarHBondContact O-N 3.17Å; C321-E323 PolarHBondContact O-N 2.8Å; E323-Y326 PolarHBondContact O-N 3Å; E323-N327 VanDerWaalsContact O-CB 3.29Å; E323-N327 WeakPolarHBondContact O-CB 3.46Å; E323-N327 PolarHBondContact O-N 3.12Å; E323-N327 PolarHBondContact O-ND2 2.88Å
324	H	90.9	Very high	88.1	Confident	1 Å²	1	45 Å²	45	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-56.9	-51.3	173.5	177.6	65.8	0	0	0	111.6	A301 P304 M318 P320 C321 Y326 N327 Q328	A301-H324 PolarHBondContact O-NE2 3.42Å; P304-H324 HydrophobicContact CB-CB 4.17Å; M318-H324 WeakPolarHBondContact CE-ND1 3.49Å; P320-H324 PolarHBondContact O-N 3.34Å; C321-H324 PolarHBondContact O-N 2.95Å; H324-Y326 VanDerWaalsContact C-N 3.31Å; H324-Y326 PolarHBondContact O-N 3.39Å; H324-N327 PolarHBondContact O-N 3.43Å; H324-Q328 WeakPolarHBondContact O-CB 3.27Å; H324-Q328 PolarHBondContact O-N 3.49Å
325	I	88.8	Confident	87.5	Confident	39 Å²	39	43.1 Å²	43.1	20%	0.2	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-41.9	178	-69.4	167.8	0	0	0	111	C321 R329	C321-I325 WeakPolarHBondContact O-CB 3.43Å; C321-I325 VanDerWaalsContact O-CG1 3.27Å; C321-I325 WeakPolarHBondContact O-CG1 3.38Å; C321-I325 PolarHBondContact O-N 2.89Å; C321-I325 VanDerWaalsContact SG-CD1 3.54Å; I325-R329 WeakPolarHBondContact O-CB 3.27Å; I325-R329 PolarHBondContact O-N 3.29Å
326	Y	87.3	Confident	86.6	Confident	76 Å²	76	43.7 Å²	43.7	30%	0.298	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-49.4	176.9	178.7	-87.4	0	0	0	111.4	H322 E323 H324 R329 R330 F468	H322-Y326 VanDerWaalsContact O-CB 3.3Å; H322-Y326 WeakPolarHBondContact O-CB 3.45Å; H322-Y326 PolarHBondContact O-N 3.22Å; E323-Y326 PolarHBondContact O-N 3Å; H324-Y326 VanDerWaalsContact C-N 3.31Å; H324-Y326 PolarHBondContact O-N 3.39Å; Y326-R329 PolarHBondContact O-N 2.92Å; Y326-R330 PolarHBondContact O-N 3.46Å; Y326-F468 AromaticContact CD2-CD2 3.43Å; Y326-F468 HydrophobicContact CD2-CD2 3.43Å; Y326-F468 VanDerWaalsContact CD2-CD2 3.43Å; Y326-F468 AromaticContact CD2-CE2 3.08Å; Y326-F468 HydrophobicContact CD2-CE2 3.08Å; Y326-F468 HydrophobicContact CD2-CZ 4.03Å; Y326-F468 AromaticContact CE2-CD2 3.41Å; Y326-F468 HydrophobicContact CE2-CD2 3.41Å; Y326-F468 VanDerWaalsContact CE2-CD2 3.41Å; Y326-F468 AromaticContact CE2-CE2 3.16Å; Y326-F468 HydrophobicContact CE2-CE2 3.16Å; Y326-F468 HydrophobicContact CE2-CG 4.22Å; Y326-F468 AromaticContact CE2-CZ 3.77Å; Y326-F468 HydrophobicContact CE2-CZ 3.77Å; Y326-F468 AromaticContact CG-CE2 3.84Å; Y326-F468 HydrophobicContact CG-CE2 3.84Å; Y326-F468 AromaticContact CZ-CE2 3.99Å
327	N	87.7	Confident	85.8	Confident	53 Å²	53	41.4 Å²	41.4	28%	0.283	20%	0.196	S	C	.	.	H	α-helix	trans	-69.3	-40	-179.1	-70.5	-27.1	0	0	0	111.9	M299 E323 H324 R329 R330 Y331	M299-N327 HydrophobicContact CE-CB 3.65Å; E323-N327 VanDerWaalsContact O-CB 3.29Å; E323-N327 WeakPolarHBondContact O-CB 3.46Å; E323-N327 PolarHBondContact O-N 3.12Å; E323-N327 PolarHBondContact O-ND2 2.88Å; H324-N327 PolarHBondContact O-N 3.43Å; N327-R329 PolarHBondContact O-N 3.25Å; N327-R330 PolarHBondContact O-N 2.83Å; N327-Y331 VanDerWaalsContact O-CB 3.28Å; N327-Y331 WeakPolarHBondContact O-CB 3.48Å; N327-Y331 PolarHBondContact O-N 2.89Å
328	Q	88.3	Confident	85.1	Confident	29 Å²	29	42.5 Å²	42.5	14%	0.136	21%	0.209	C	C	.	.	H	α-helix	trans	-56.1	-49.7	172.3	166.4	178.4	83	0	0	110.5	M299 Y300 A301 H324 R330 Y331 M332	M299-Q328 WeakPolarHBondContact O-CB 3.3Å; M299-Q328 WeakPolarHBondContact O-CG 3.31Å; M299-Q328 PolarHBondContact O-NE2 3.39Å; Y300-Q328 PolarHBondContact O-NE2 3.31Å; Y300-Q328 VanDerWaalsContact O-NE2 3.13Å; A301-Q328 PolarHBondContact O-NE2 2.89Å; H324-Q328 WeakPolarHBondContact O-CB 3.27Å; H324-Q328 PolarHBondContact O-N 3.49Å; Q328-R330 VanDerWaalsContact C-N 3.35Å; Q328-R330 PolarHBondContact O-N 3.38Å; Q328-Y331 PolarHBondContact O-N 3.46Å; Q328-M332 HydrophobicContact CG-CE 3.53Å; Q328-M332 HydrophobicContact CG-SD 4.29Å; Q328-M332 WeakPolarHBondContact O-CB 3.47Å; Q328-M332 WeakPolarHBondContact O-CG 3.14Å; Q328-M332 PolarHBondContact O-N 3.26Å
329	R	84	Confident	84.1	Confident	136 Å²	136	43.3 Å²	43.3	51%	0.513	21%	0.212	S	C	.	.	H	α-helix	trans	-62.7	-42.8	178.8	-174.7	178.6	-67.9	173.2	-0.8	111.5	I325 Y326 N327 R333 F468	I325-R329 WeakPolarHBondContact O-CB 3.27Å; I325-R329 PolarHBondContact O-N 3.29Å; Y326-R329 PolarHBondContact O-N 2.92Å; N327-R329 PolarHBondContact O-N 3.25Å; R329-R333 WeakPolarHBondContact O-CB 3.3Å; R329-R333 PolarHBondContact O-N 3.39Å; R329-F468 HydrophobicContact CB-CE2 4.5Å; R329-F468 HydrophobicContact CB-CZ 4.43Å; R329-F468 HydrophobicContact CG-CZ 4.3Å
330	R	84.2	Confident	83.3	Confident	92 Å²	92	45.9 Å²	45.9	35%	0.347	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-45.3	176.3	-175.4	177.1	178	164.3	0.3	111.5	Y326 N327 Q328 R333 S334 S359 F360	Y326-R330 PolarHBondContact O-N 3.46Å; N327-R330 PolarHBondContact O-N 2.83Å; Q328-R330 VanDerWaalsContact C-N 3.35Å; Q328-R330 PolarHBondContact O-N 3.38Å; R330-R333 PolarHBondContact O-N 3.4Å; R330-S334 WeakPolarHBondContact O-CB 3.42Å; R330-S334 PolarHBondContact O-N 2.88Å; R330-S359 PolarHBondContact NH2-O 3.38Å; R330-F360 HydrophobicContact CG-CE2 4.38Å; R330-F360 VanDerWaalsContact NE-CD2 3.32Å
331	Y	85.3	Confident	82.7	Confident	19 Å²	19	51.9 Å²	51.9	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-53.9	179.9	179.9	-99.1	0	0	0	111.8	F295 R296 M299 Y300 N327 Q328 R333 S334 E335 F360	F295-Y331 HydrophobicContact CD1-CE2 4.26Å; F295-Y331 HydrophobicContact CE1-CD2 4Å; F295-Y331 AromaticContact CE1-CE2 3.6Å; F295-Y331 HydrophobicContact CE1-CE2 3.6Å; F295-Y331 HydrophobicContact CZ-CD2 4.45Å; F295-Y331 HydrophobicContact CZ-CE2 4.46Å; R296-Y331 HydrophobicContact CB-CE1 4.38Å; R296-Y331 WeakPolarHBondContact CB-OH 3.36Å; R296-Y331 HydrophobicContact CG-CE1 4.05Å; M299-Y331 HydrophobicContact CB-CD1 4.04Å; M299-Y331 HydrophobicContact CB-CE1 4.46Å; M299-Y331 HydrophobicContact CB-CG 4.45Å; Y300-Y331 AromaticContact CE1-CD1 3.99Å; Y300-Y331 HydrophobicContact CE1-CD1 3.99Å; Y300-Y331 AromaticContact CE1-CE1 3.84Å; Y300-Y331 HydrophobicContact CE1-CE1 3.84Å; N327-Y331 VanDerWaalsContact O-CB 3.28Å; N327-Y331 WeakPolarHBondContact O-CB 3.48Å; N327-Y331 PolarHBondContact O-N 2.89Å; Q328-Y331 PolarHBondContact O-N 3.46Å; Y331-R333 PolarHBondContact O-N 3.07Å; Y331-S334 WeakPolarHBondContact O-CB 3.4Å; Y331-S334 PolarHBondContact O-N 2.99Å; Y331-S334 VanDerWaalsContact O-N 3.09Å; Y331-E335 WeakPolarHBondContact O-CB 3.23Å; Y331-E335 PolarHBondContact O-N 3.2Å; Y331-F360 HydrophobicContact CD2-CE1 4.33Å
332	M	81.4	Confident	81.7	Confident	39 Å²	39	52.4 Å²	52.4	19%	0.192	24%	0.241	C	C	.	.	H	α-helix	trans	-54.9	-40.7	176.8	-74.1	-170.9	-63.1	0	0	111.6	Y300 Q328 E335 L336	Y300-M332 HydrophobicContact CD1-CG 3.88Å; Y300-M332 HydrophobicContact CD1-SD 4.35Å; Y300-M332 HydrophobicContact CE1-CG 3.73Å; Q328-M332 HydrophobicContact CG-CE 3.53Å; Q328-M332 HydrophobicContact CG-SD 4.29Å; Q328-M332 WeakPolarHBondContact O-CB 3.47Å; Q328-M332 WeakPolarHBondContact O-CG 3.14Å; Q328-M332 PolarHBondContact O-N 3.26Å; M332-E335 PolarHBondContact O-N 3.21Å; M332-L336 WeakPolarHBondContact O-CB 3.29Å; M332-L336 VanDerWaalsContact O-CG 3.24Å; M332-L336 WeakPolarHBondContact O-CG 3.49Å; M332-L336 PolarHBondContact O-N 3.45Å
333	R	79.1	Confident	80.3	Confident	48 Å²	48	57.7 Å²	57.7	18%	0.181	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-46.6	177.1	176.6	175.3	163.4	-172.9	-18.4	112.5	R329 R330 Y331 E335 L336 T337 E474	R329-R333 WeakPolarHBondContact O-CB 3.3Å; R329-R333 PolarHBondContact O-N 3.39Å; R330-R333 PolarHBondContact O-N 3.4Å; Y331-R333 PolarHBondContact O-N 3.07Å; R333-E335 VanDerWaalsContact C-N 3.26Å; R333-E335 PolarHBondContact O-N 2.96Å; R333-L336 PolarHBondContact O-N 3.05Å; R333-T337 WeakPolarHBondContact O-CB 3.36Å; R333-T337 PolarHBondContact O-N 3.11Å; R333-T337 PolarHBondContact O-OG1 3.24Å; R333-E474 IonicContact CZ-OE1 2.75Å; R333-E474 IonicContact CZ-OE2 2.86Å; R333-E474 IonicContact NH2-OE1 2.71Å; R333-E474 PolarHBondContact NH2-OE1 3.06Å; R333-E474 IonicContact NH2-OE2 3.57Å; R333-E474 PolarHBondContact NH2-OE2 3.5Å
334	S	80.4	Confident	78.8	Confident	58 Å²	58	55.9 Å²	55.9	41%	0.406	27%	0.268	S	S	.	.	H	α-helix	trans	-59.4	-42.2	177.7	-171.3	0	0	0	0	111	R330 Y331 T337 A338	R330-S334 WeakPolarHBondContact O-CB 3.42Å; R330-S334 PolarHBondContact O-N 2.88Å; Y331-S334 WeakPolarHBondContact O-CB 3.4Å; Y331-S334 PolarHBondContact O-N 2.99Å; Y331-S334 VanDerWaalsContact O-N 3.09Å; S334-T337 WeakPolarHBondContact O-CB 3.48Å; S334-T337 PolarHBondContact O-N 2.87Å; S334-A338 WeakPolarHBondContact O-CB 3.4Å; S334-A338 PolarHBondContact O-N 3.23Å
335	E	81.4	Confident	77	Confident	14 Å²	14	58.7 Å²	58.7	7%	0.065	28%	0.283	C	S	.	.	H	α-helix	trans	-68.8	-45.5	-178.9	-168.5	-157.6	147.7	0	0	112.6	R296 Y300 Y331 M332 R333 T337 A338 F339	R296-E335 IonicContact CZ-OE1 3.85Å; R296-E335 IonicContact NE-OE1 3.11Å; R296-E335 PolarHBondContact NE-OE1 3.04Å; R296-E335 IonicContact NE-OE2 2.7Å; R296-E335 IonicContact NH1-OE1 2.88Å; R296-E335 IonicContact NH2-OE1 2.7Å; R296-E335 PolarHBondContact NH2-OE1 3.28Å; Y300-E335 PolarHBondContact OH-OE1 3.25Å; Y300-E335 PolarHBondContact OH-OE2 2.79Å; Y331-E335 WeakPolarHBondContact O-CB 3.23Å; Y331-E335 PolarHBondContact O-N 3.2Å; M332-E335 PolarHBondContact O-N 3.21Å; R333-E335 VanDerWaalsContact C-N 3.26Å; R333-E335 PolarHBondContact O-N 2.96Å; E335-T337 PolarHBondContact O-N 2.88Å; E335-A338 PolarHBondContact O-N 3.4Å; E335-F339 WeakPolarHBondContact O-CB 3.42Å; E335-F339 PolarHBondContact O-N 3.5Å
336	L	78.6	Confident	75	Confident	27 Å²	27	63.6 Å²	63.6	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-33.8	174.6	-67	171.6	0	0	0	111.4	R140 I144 M332 R333 W340	R140-L336 HydrophobicContact CB-CD2 4.48Å; I144-L336 HydrophobicContact CD1-CB 4.1Å; I144-L336 HydrophobicContact CD1-CD2 3.57Å; I144-L336 HydrophobicContact CD1-CG 4.39Å; M332-L336 WeakPolarHBondContact O-CB 3.29Å; M332-L336 VanDerWaalsContact O-CG 3.24Å; M332-L336 WeakPolarHBondContact O-CG 3.49Å; M332-L336 PolarHBondContact O-N 3.45Å; R333-L336 PolarHBondContact O-N 3.05Å; L336-W340 WeakPolarHBondContact O-CB 3.3Å; L336-W340 PolarHBondContact O-N 3.08Å
337	T	78.1	Confident	73.3	Confident	37 Å²	37	65 Å²	65	23%	0.227	31%	0.314	C	S	.	.	H	α-helix	trans	-68.7	-42.5	175	-52.9	0	0	0	0	111.6	R333 S334 E335 W340 R341	R333-T337 WeakPolarHBondContact O-CB 3.36Å; R333-T337 PolarHBondContact O-N 3.11Å; R333-T337 PolarHBondContact O-OG1 3.24Å; S334-T337 WeakPolarHBondContact O-CB 3.48Å; S334-T337 PolarHBondContact O-N 2.87Å; E335-T337 PolarHBondContact O-N 2.88Å; T337-W340 WeakPolarHBondContact O-CB 3.29Å; T337-W340 PolarHBondContact O-N 2.89Å; T337-R341 WeakPolarHBondContact O-CG 3.33Å; T337-R341 PolarHBondContact O-N 3.2Å
338	A	77.9	Confident	71.4	Confident	45 Å²	45	63.6 Å²	63.6	37%	0.372	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-45.1	174.6	0	0	0	0	0	110.7	S334 E335 W340 R341 A342	S334-A338 WeakPolarHBondContact O-CB 3.4Å; S334-A338 PolarHBondContact O-N 3.23Å; E335-A338 PolarHBondContact O-N 3.4Å; A338-W340 VanDerWaalsContact C-N 3.26Å; A338-W340 PolarHBondContact O-N 3.38Å; A338-R341 PolarHBondContact O-N 3.08Å; A338-A342 PolarHBondContact O-N 3.45Å
339	F	72	Confident	69.3	Low	21 Å²	21	66.8 Å²	66.8	9%	0.092	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-35.5	176.3	-159.3	-106.5	0	0	0	111.7	I144 W145 K148 E335 M348	I144-F339 HydrophobicContact CB-CD1 3.8Å; I144-F339 HydrophobicContact CB-CE1 4.1Å; I144-F339 HydrophobicContact CD1-CD1 4.12Å; I144-F339 HydrophobicContact CG2-CD1 3.49Å; I144-F339 VanDerWaalsContact CG2-CD1 3.49Å; I144-F339 HydrophobicContact CG2-CE1 4Å; W145-F339 HydrophobicContact CE3-CE1 4.24Å; W145-F339 AromaticContact CE3-CZ 3.71Å; W145-F339 HydrophobicContact CE3-CZ 3.71Å; W145-F339 HydrophobicContact CZ3-CZ 4.09Å; K148-F339 WeakPolarHBondContact CE-O 3.31Å; K148-F339 PolarHBondContact NZ-O 2.86Å; E335-F339 WeakPolarHBondContact O-CB 3.42Å; E335-F339 PolarHBondContact O-N 3.5Å; F339-M348 HydrophobicContact CD1-CE 4.12Å; F339-M348 HydrophobicContact CD2-CB 4.36Å; F339-M348 HydrophobicContact CD2-CE 4.46Å; F339-M348 HydrophobicContact CD2-CG 4.42Å; F339-M348 HydrophobicContact CE1-CE 3.49Å; F339-M348 VanDerWaalsContact CE1-CE 3.49Å; F339-M348 HydrophobicContact CE2-CB 3.77Å; F339-M348 HydrophobicContact CE2-CE 3.9Å; F339-M348 HydrophobicContact CE2-CG 4.16Å; F339-M348 WeakPolarHBondContact CE2-O 3.23Å; F339-M348 HydrophobicContact CZ-CB 4.33Å; F339-M348 HydrophobicContact CZ-CE 3.39Å
340	W	71.4	Confident	67.3	Low	71 Å²	71	65.7 Å²	65.7	27%	0.269	33%	0.332	S	S	.	.	H	α-helix	trans	-66.2	-38.5	172.3	-180	-97.5	0	0	0	113.2	I144 H147 K148 L336 T337 A338 F481	I144-W340 HydrophobicContact CG2-CE3 3.99Å; H147-W340 HydrophobicContact CB-CZ3 4.2Å; H147-W340 AromaticContact CD2-CH2 3.19Å; H147-W340 WeakPolarHBondContact CD2-CH2 3.38Å; H147-W340 AromaticContact CD2-CZ3 3.42Å; H147-W340 VanDerWaalsContact CD2-CZ3 3.42Å; H147-W340 WeakPolarHBondContact CD2-CZ3 3.4Å; H147-W340 AromaticContact CG-CH2 3.93Å; H147-W340 AromaticContact CG-CZ3 3.81Å; H147-W340 AromaticContact NE2-CH2 3.39Å; H147-W340 WeakPolarHBondContact NE2-CH2 3.41Å; K148-W340 WeakPolarHBondContact CE-O 3.16Å; L336-W340 WeakPolarHBondContact O-CB 3.3Å; L336-W340 PolarHBondContact O-N 3.08Å; T337-W340 WeakPolarHBondContact O-CB 3.29Å; T337-W340 PolarHBondContact O-N 2.89Å; A338-W340 VanDerWaalsContact C-N 3.26Å; A338-W340 PolarHBondContact O-N 3.38Å; W340-F481 HydrophobicContact CE3-CE2 4.15Å; W340-F481 AromaticContact CE3-CZ 3.84Å; W340-F481 HydrophobicContact CE3-CZ 3.84Å; W340-F481 HydrophobicContact CH2-CE2 4.4Å; W340-F481 AromaticContact CH2-CZ 3.69Å; W340-F481 HydrophobicContact CH2-CZ 3.69Å; W340-F481 AromaticContact CZ3-CE1 3.88Å; W340-F481 HydrophobicContact CZ3-CE1 3.88Å; W340-F481 AromaticContact CZ3-CE2 3.97Å; W340-F481 HydrophobicContact CZ3-CE2 3.97Å; W340-F481 AromaticContact CZ3-CZ 3.24Å; W340-F481 HydrophobicContact CZ3-CZ 3.24Å
341	R	74.6	Confident	65.2	Low	168 Å²	168	67.1 Å²	67.1	63%	0.634	35%	0.347	S	S	*	.	H	α-helix	trans	-81.9	-20.4	-176.9	-70.7	178.9	-176	176.7	2.6	115	T337 A338 N343	T337-R341 WeakPolarHBondContact O-CG 3.33Å; T337-R341 PolarHBondContact O-N 3.2Å; A338-R341 PolarHBondContact O-N 3.08Å; R341-N343 PolarHBondContact O-OD1 3.49Å
342	A	69.5	Low	63	Low	12 Å²	12	68.9 Å²	68.9	10%	0.099	36%	0.36	C	S	.	.			trans	-57.4	137.3	178.9	0	0	0	0	0	110.7	K148 A338 E347 M348	K148-A342 PolarHBondContact NZ-O 2.91Å; A338-A342 PolarHBondContact O-N 3.45Å; A342-E347 HydrophobicContact CB-CB 3.9Å; A342-M348 HydrophobicContact CB-CG 3.62Å
343	N	57.5	Low	61	Low	141 Å²	141	73.2 Å²	73.2	75%	0.754	38%	0.383	S	S	*	.			trans	-111.3	4	-176	-68.4	-39.2	0	0	0	112.9	R341 E347	R341-N343 PolarHBondContact O-OD1 3.49Å; N343-E347 PolarHBondContact N-OE2 3.11Å
344	S	57	Low	59	Low	47 Å²	47	74.1 Å²	74.1	33%	0.329	39%	0.391	S	S	.	.	S	Bend	trans	-145	156.1	177.3	67.8	0	0	0	0	113	E346 E347 M348	S344-E346 VanDerWaalsContact C-N 3.26Å; S344-E346 PolarHBondContact O-N 2.92Å; S344-E347 PolarHBondContact O-N 3.09Å; S344-E347 VanDerWaalsContact O-N 3.17Å; S344-E347 WeakPolarHBondContact OG-CG 3.37Å; S344-E347 PolarHBondContact OG-N 2.86Å; S344-M348 WeakPolarHBondContact O-CG 3.45Å; S344-M348 PolarHBondContact O-N 2.94Å; S344-M348 VanDerWaalsContact O-N 3.13Å
345	D	52	Low	56.8	Low	60 Å²	60	79.2 Å²	79.2	32%	0.321	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-32.3	176.7	-70.9	-31.6	0	0	0	113.3	W145 Q170 M348 S349	W145-D345 VanDerWaalsContact CH2-OD1 3.23Å; W145-D345 WeakPolarHBondContact CH2-OD1 3.1Å; W145-D345 WeakPolarHBondContact CZ2-OD1 3.46Å; Q170-D345 PolarHBondContact NE2-OD2 3.45Å; D345-M348 PolarHBondContact O-N 3.11Å; D345-S349 VanDerWaalsContact O-CB 3.31Å; D345-S349 WeakPolarHBondContact O-CB 3.34Å; D345-S349 PolarHBondContact O-N 2.71Å; D345-S349 PolarHBondContact O-OG 2.77Å
346	E	48.3	Very low	54.5	Low	143 Å²	143	84.5 Å²	84.5	67%	0.668	44%	0.441	S	S	*	.	H	α-helix	trans	-69.6	-35	177.4	-67.7	-175.4	172.8	0	0	111.3	S344 M348 S349 Q350	S344-E346 VanDerWaalsContact C-N 3.26Å; S344-E346 PolarHBondContact O-N 2.92Å; E346-M348 VanDerWaalsContact C-N 3.34Å; E346-S349 PolarHBondContact O-OG 3.12Å; E346-Q350 WeakPolarHBondContact O-CB 3.41Å; E346-Q350 WeakPolarHBondContact O-CG 3.38Å; E346-Q350 PolarHBondContact O-N 3.44Å; E346-Q350 VanDerWaalsContact O-N 3.17Å
347	E	51	Low	52.3	Low	106 Å²	106	88 Å²	88	50%	0.495	46%	0.46	S	S	.	.	H	α-helix	trans	-73.9	-24.4	172.3	-72.9	175	174.8	0	0	113	A342 N343 S344	A342-E347 HydrophobicContact CB-CB 3.9Å; N343-E347 PolarHBondContact N-OE2 3.11Å; S344-E347 PolarHBondContact O-N 3.09Å; S344-E347 VanDerWaalsContact O-N 3.17Å; S344-E347 WeakPolarHBondContact OG-CG 3.37Å; S344-E347 PolarHBondContact OG-N 2.86Å
348	M	48.4	Very low	50.3	Low	22 Å²	22	96 Å²	96	11%	0.108	50%	0.495	C	S	.	.	H	α-helix	trans	-87	-24.8	178.9	-67.1	176.2	72.7	0	0	113.2	W145 K148 F339 A342 S344 D345 E346	W145-M348 HydrophobicContact CD2-CE 3.98Å; W145-M348 HydrophobicContact CE3-CE 3.17Å; W145-M348 HydrophobicContact CE3-SD 4.33Å; W145-M348 HydrophobicContact CH2-CB 4.33Å; W145-M348 HydrophobicContact CH2-CE 4.06Å; W145-M348 HydrophobicContact CH2-SD 4.2Å; W145-M348 HydrophobicContact CZ3-CB 3.76Å; W145-M348 HydrophobicContact CZ3-CE 3.24Å; W145-M348 HydrophobicContact CZ3-CG 4.38Å; W145-M348 HydrophobicContact CZ3-SD 3.86Å; K148-M348 HydrophobicContact CD-CE 3.71Å; K148-M348 HydrophobicContact CD-SD 3.88Å; K148-M348 PolarHBondContact NZ-SD 3Å; F339-M348 HydrophobicContact CD1-CE 4.12Å; F339-M348 HydrophobicContact CD2-CB 4.36Å; F339-M348 HydrophobicContact CD2-CE 4.46Å; F339-M348 HydrophobicContact CD2-CG 4.42Å; F339-M348 HydrophobicContact CE1-CE 3.49Å; F339-M348 VanDerWaalsContact CE1-CE 3.49Å; F339-M348 HydrophobicContact CE2-CB 3.77Å; F339-M348 HydrophobicContact CE2-CE 3.9Å; F339-M348 HydrophobicContact CE2-CG 4.16Å; F339-M348 WeakPolarHBondContact CE2-O 3.23Å; F339-M348 HydrophobicContact CZ-CB 4.33Å; F339-M348 HydrophobicContact CZ-CE 3.39Å; A342-M348 HydrophobicContact CB-CG 3.62Å; S344-M348 WeakPolarHBondContact O-CG 3.45Å; S344-M348 PolarHBondContact O-N 2.94Å; S344-M348 VanDerWaalsContact O-N 3.13Å; D345-M348 PolarHBondContact O-N 3.11Å; E346-M348 VanDerWaalsContact C-N 3.34Å
349	S	43	Very low	48.6	Very low	96 Å²	96	97.8 Å²	97.8	67%	0.671	51%	0.505	S	S	*	.	H	α-helix	trans	-96.7	-22	-179.2	54.8	0	0	0	0	114	D345 E346	D345-S349 VanDerWaalsContact O-CB 3.31Å; D345-S349 WeakPolarHBondContact O-CB 3.34Å; D345-S349 PolarHBondContact O-N 2.71Å; D345-S349 PolarHBondContact O-OG 2.77Å; E346-S349 PolarHBondContact O-OG 3.12Å
350	Q	41.3	Very low	47.2	Very low	114 Å²	114	98.8 Å²	98.8	53%	0.533	51%	0.509	S	S	.	.	S	Bend	trans	-69.8	138.2	169.8	-74	175.6	19.1	0	0	110	E346 P352	E346-Q350 WeakPolarHBondContact O-CB 3.41Å; E346-Q350 WeakPolarHBondContact O-CG 3.38Å; E346-Q350 PolarHBondContact O-N 3.44Å; E346-Q350 VanDerWaalsContact O-N 3.17Å; Q350-P352 WeakPolarHBondContact O-CD 3.42Å; Q350-P352 VanDerWaalsContact O-N 3.11Å
351	D	41	Very low	45.6	Very low	122 Å²	122	101.1 Å²	101.1	65%	0.652	53%	0.531	S	S	*	.			trans	-49.8	123.6	156.8	-90.7	-35.7	0	0	0	105.5	I353	D351-I353 VanDerWaalsContact C-N 3.25Å; D351-I353 PolarHBondContact O-N 2.82Å
352	P	39.9	Very low	44.2	Very low	55 Å²	55	93.9 Å²	93.9	36%	0.357	51%	0.506	S	S	.	.			trans	-60.7	101.9	179.1	23.9	-30.7	0	0	0	105.7	Q350 I354	Q350-P352 WeakPolarHBondContact O-CD 3.42Å; Q350-P352 VanDerWaalsContact O-N 3.11Å; P352-I354 PolarHBondContact O-N 3.15Å
353	I	38.4	Very low	43.2	Very low	130 Å²	130	98.5 Å²	98.5	67%	0.667	53%	0.529	S	S	*	.			trans	-53.2	107.5	151.5	-62.7	173.3	0	0	0	100.9	D351 H355	D351-I353 VanDerWaalsContact C-N 3.25Å; D351-I353 PolarHBondContact O-N 2.82Å; I353-H355 PolarHBondContact O-N 3.05Å
354	I	38	Very low	42.9	Very low	68 Å²	68	98.8 Å²	98.8	35%	0.349	53%	0.53	S	S	.	.			trans	-58.3	99.3	-174	-66	170.8	0	0	0	104.8	P352 T356 P362	P352-I354 PolarHBondContact O-N 3.15Å; I354-T356 PolarHBondContact O-N 3.46Å; I354-P362 HydrophobicContact CD1-CB 4.38Å; I354-P362 VanDerWaalsContact CD1-CD 3.42Å; I354-P362 HydrophobicContact CD1-CG 3.27Å
355	H	34.1	Very low	43.2	Very low	164 Å²	164	101.9 Å²	101.9	76%	0.759	54%	0.543	S	S	*	.			trans	-56.9	116.3	167.4	-78.8	-71	0	0	0	103.9	I353 D357	I353-H355 PolarHBondContact O-N 3.05Å; H355-D357 PolarHBondContact O-N 3.2Å
356	T	32.8	Very low	44.7	Very low	125 Å²	125	100 Å²	100	77%	0.767	53%	0.533	S	S	*	.			trans	-53.4	85.3	-178.3	44.1	0	0	0	0	109.6	I354	I354-T356 PolarHBondContact O-N 3.46Å
357	D	31.9	Very low	46.6	Very low	102 Å²	102	95 Å²	95	55%	0.545	51%	0.51	S	S	.	.			trans	-79.6	122.4	155.7	-150.8	-8.7	0	0	0	104.8	H355 S359 F360	H355-D357 PolarHBondContact O-N 3.2Å; D357-S359 PolarHBondContact O-N 2.82Å; D357-F360 PolarHBondContact O-N 3.49Å
358	E	36.7	Very low	48.4	Very low	203 Å²	203	93.9 Å²	93.9	95%	0.949	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	2	-171	-65.4	-176.8	153.3	0	0	114.2
359	S	42.2	Very low	50.3	Low	83 Å²	83	98.8 Å²	98.8	58%	0.58	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-11.4	-176.8	72	0	0	0	0	115.6	R330 D357	R330-S359 PolarHBondContact NH2-O 3.38Å; D357-S359 PolarHBondContact O-N 2.82Å
360	F	41.8	Very low	52.4	Low	43 Å²	43	96 Å²	96	19%	0.189	51%	0.508	C	S	.	.			trans	-152.9	87.7	177.6	-168	-107.5	0	0	0	113.2	R330 Y331 D357 P362	R330-F360 HydrophobicContact CG-CE2 4.38Å; R330-F360 VanDerWaalsContact NE-CD2 3.32Å; Y331-F360 HydrophobicContact CD2-CE1 4.33Å; D357-F360 PolarHBondContact O-N 3.49Å; F360-P362 HydrophobicContact CE1-CB 4.09Å; F360-P362 HydrophobicContact CZ-CB 4.38Å
361	T	37.7	Very low	54.1	Low	119 Å²	119	96 Å²	96	73%	0.73	51%	0.511	S	S	*	.			trans	-79.1	117.3	152.3	48.9	0	0	0	0	107.1	D363	T361-D363 PolarHBondContact O-N 3.39Å
362	P	45	Very low	56.2	Low	17 Å²	17	93.8 Å²	93.8	11%	0.11	50%	0.497	C	S	.	.			trans	-58.6	132.8	168.6	29	-35.8	0	0	0	107	F295 I354 F360 L364	F295-P362 HydrophobicContact CE1-CB 3.81Å; F295-P362 HydrophobicContact CE1-CG 4.37Å; F295-P362 HydrophobicContact CZ-CB 3.72Å; I354-P362 HydrophobicContact CD1-CB 4.38Å; I354-P362 VanDerWaalsContact CD1-CD 3.42Å; I354-P362 HydrophobicContact CD1-CG 3.27Å; F360-P362 HydrophobicContact CE1-CB 4.09Å; F360-P362 HydrophobicContact CZ-CB 4.38Å; P362-L364 PolarHBondContact O-N 3.04Å
363	D	48.3	Very low	58.4	Low	108 Å²	108	101.5 Å²	101.5	58%	0.578	52%	0.519	S	S	*	.			trans	-63.8	104.1	170.3	-159.1	-12.9	0	0	0	106.6	T361 N365 V366	T361-D363 PolarHBondContact O-N 3.39Å; D363-N365 PolarHBondContact O-N 3.41Å; D363-V366 WeakPolarHBondContact O-CG2 2.9Å
364	L	51.2	Low	61	Low	148 Å²	148	96 Å²	96	78%	0.775	49%	0.49	S	S	*	.	S	Bend	trans	-61.4	-14.2	-178.4	-70.1	165.1	0	0	0	111	P362 V366	P362-L364 PolarHBondContact O-N 3.04Å; L364-V366 PolarHBondContact O-N 3.47Å
365	N	65	Low	63.7	Low	112 Å²	112	96.6 Å²	96.6	60%	0.599	50%	0.497	S	S	*	.			trans	-94.6	58.3	175.1	-67.6	-28.7	0	0	0	112.5	D363 F367	D363-N365 PolarHBondContact O-N 3.41Å; N365-F367 PolarHBondContact O-N 2.92Å
366	V	82	Confident	66.7	Low	19 Å²	19	90.4 Å²	90.4	12%	0.115	47%	0.47	C	S	.	.			trans	-60.6	-29.9	175.3	-171.1	0	0	0	0	112.5	F295 M299 M318 D363 L364	F295-V366 HydrophobicContact CD2-CG2 3.45Å; F295-V366 VanDerWaalsContact CD2-CG2 3.45Å; F295-V366 HydrophobicContact CE2-CG2 3.2Å; F295-V366 HydrophobicContact CZ-CG2 4.39Å; M299-V366 HydrophobicContact SD-CG1 4.23Å; M318-V366 HydrophobicContact CE-CG1 3.6Å; M318-V366 HydrophobicContact CG-CG1 3.99Å; M318-V366 HydrophobicContact SD-CG1 4.16Å; D363-V366 WeakPolarHBondContact O-CG2 2.9Å; L364-V366 PolarHBondContact O-N 3.47Å
367	F	88.4	Confident	69.8	Low	40 Å²	40	84.5 Å²	84.5	18%	0.175	43%	0.433	C	S	.	.	S	Bend	trans	-99.7	115.5	177.5	-71.6	-79.8	0	0	0	109.8	L293 V298 T305 H307 K316 M318 N365	L293-F367 HydrophobicContact CD2-CD2 4.32Å; L293-F367 HydrophobicContact CD2-CE2 3.33Å; L293-F367 HydrophobicContact CD2-CZ 3.52Å; V298-F367 HydrophobicContact CG1-CE2 4.27Å; V298-F367 HydrophobicContact CG1-CZ 4.08Å; T305-F367 WeakPolarHBondContact O-CE1 3.31Å; H307-F367 HydrophobicContact CB-CD1 3.52Å; H307-F367 HydrophobicContact CB-CE1 3.49Å; H307-F367 VanDerWaalsContact CB-CE1 3.49Å; H307-F367 HydrophobicContact CB-CG 4.22Å; H307-F367 HydrophobicContact CB-CZ 4.19Å; K316-F367 HydrophobicContact CB-CB 3.86Å; K316-F367 HydrophobicContact CB-CD1 4.36Å; K316-F367 HydrophobicContact CD-CB 4.15Å; M318-F367 HydrophobicContact CG-CD1 4.02Å; M318-F367 HydrophobicContact CG-CE1 3.71Å; M318-F367 HydrophobicContact CG-CZ 4.06Å; M318-F367 HydrophobicContact SD-CE1 4.31Å; M318-F367 HydrophobicContact SD-CZ 4.16Å; N365-F367 PolarHBondContact O-N 2.92Å
368	Q	88.9	Confident	72.8	Confident	82 Å²	82	83.4 Å²	83.4	38%	0.383	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	164.7	-179.6	-60.6	179.7	4	0	0	110.2	K316 Q317	K316-Q368 CarbonylContact C-O 3.53Å; K316-Q368 WeakPolarHBondContact CA-O 3.15Å; Q317-Q368 PolarHBondContact N-O 2.88Å; Q317-Q368 PolarHBondContact O-N 3.11Å
369	D	88.4	Confident	75.6	Confident	124 Å²	124	75.7 Å²	75.7	66%	0.663	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	154.6	172.1	-63.6	-37.7	0	0	0	110.5	L371	D369-L371 PolarHBondContact O-N 3.34Å; D369-L371 VanDerWaalsContact O-N 3.11Å
370	I	87.4	Confident	78.3	Confident	37 Å²	37	72 Å²	72	19%	0.19	37%	0.368	C	S	.	.			trans	-62.5	116.9	-179.4	-61	164.4	0	0	0	109.5	N222 V315	N222-I370 HydrophobicContact CB-CD1 3.47Å; N222-I370 VanDerWaalsContact CB-CD1 3.47Å; V315-I370 HydrophobicContact CB-CD1 3.98Å; V315-I370 HydrophobicContact CG1-CD1 3.77Å; V315-I370 HydrophobicContact CG1-CG1 4.41Å
371	L	77.9	Confident	80.8	Confident	114 Å²	114	70.1 Å²	70.1	60%	0.597	36%	0.36	S	S	*	.			trans	-75.3	-38.7	-174.8	-75.3	152.4	0	0	0	113.1	D369	D369-L371 PolarHBondContact O-N 3.34Å; D369-L371 VanDerWaalsContact O-N 3.11Å
372	H	83.9	Confident	83.5	Confident	76 Å²	76	67.5 Å²	67.5	35%	0.352	34%	0.342	S	S	.	.			trans	-131.2	120.8	-168	-56.9	-50.8	0	0	0	111.6	Q229 E442	Q229-H372 PolarHBondContact NE2-O 3.47Å; H372-E442 HydrophobicContact CB-CB 4.18Å
373	R	85.9	Confident	85.8	Confident	218 Å²	218	71.8 Å²	71.8	82%	0.823	36%	0.36	S	S	*	.			trans	-75.8	142.6	169.3	-61.7	-176.5	-176.7	175.2	-0	109.8
374	D	93.2	Very high	88	Confident	13 Å²	13	66.7 Å²	66.7	7%	0.07	33%	0.333	C	S	.	.			trans	-104.9	168.6	174.8	70.9	99.7	0	0	0	110.2	S225 V377 D444 I447	S225-D374 WeakPolarHBondContact CB-OD2 3.32Å; S225-D374 PolarHBondContact OG-OD2 3.35Å; D374-V377 WeakPolarHBondContact OD1-CA 3.4Å; D374-V377 WeakPolarHBondContact OD1-CB 3.42Å; D374-V377 VanDerWaalsContact OD1-CG2 3.27Å; D374-V377 WeakPolarHBondContact OD1-CG2 3.34Å; D374-V377 PolarHBondContact OD1-N 3.39Å; D374-D444 VanDerWaalsContact CB-OD1 3.31Å; D374-D444 WeakPolarHBondContact CB-OD1 3.48Å; D374-I447 HydrophobicContact CB-CD1 3.84Å
375	T	95.6	Very high	90	Very high	81 Å²	81	60.8 Å²	60.8	50%	0.497	30%	0.301	S	S	.	.	S	Bend	trans	-112.9	-26.1	178.5	71.9	0	0	0	0	112.1	A379 A441 D444	T375-A379 VanDerWaalsContact O-CB 3.3Å; T375-A379 WeakPolarHBondContact O-CB 3.19Å; T375-A379 PolarHBondContact O-N 3.39Å; T375-A441 HydrophobicContact CG2-CB 4.25Å; T375-D444 WeakPolarHBondContact CB-OD2 3.1Å; T375-D444 PolarHBondContact N-OD1 3.32Å; T375-D444 PolarHBondContact N-OD2 2.79Å; T375-D444 PolarHBondContact OG1-OD2 3.3Å
376	L	96.9	Very high	91.3	Very high	35 Å²	35	63.1 Å²	63.1	18%	0.183	31%	0.308	C	S	.	.	H	α-helix	trans	-67.1	-47.9	-177.3	-68.5	171.9	0	0	0	112.4	F380 F401 L405 D444 I448	L376-F380 WeakPolarHBondContact O-CB 3.22Å; L376-F380 PolarHBondContact O-N 2.69Å; L376-F401 HydrophobicContact CB-CE2 4.33Å; L376-L405 HydrophobicContact CD1-CD2 3.94Å; L376-D444 WeakPolarHBondContact CB-OD1 3.1Å; L376-D444 HydrophobicContact CD1-CB 3.99Å; L376-D444 HydrophobicContact CG-CB 4.3Å; L376-D444 VanDerWaalsContact CG-OD1 3.28Å; L376-D444 WeakPolarHBondContact CG-OD1 3.23Å; L376-D444 PolarHBondContact N-OD1 3.34Å; L376-I448 HydrophobicContact CD1-CD1 4.47Å
377	V	96.9	Very high	91.8	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-70.9	-38.9	179.3	-176.2	0	0	0	0	109.8	L221 I224 S225 L228 D374 F380 L381 F401 I447	L221-V377 HydrophobicContact CD1-CB 4.05Å; L221-V377 HydrophobicContact CD1-CG1 3.87Å; I224-V377 HydrophobicContact CB-CG1 3.91Å; I224-V377 HydrophobicContact CG2-CG1 3.55Å; I224-V377 HydrophobicContact CG2-CG2 4.35Å; S225-V377 WeakPolarHBondContact OG-CB 3.4Å; L228-V377 HydrophobicContact CD1-CG2 3.73Å; D374-V377 WeakPolarHBondContact OD1-CA 3.4Å; D374-V377 WeakPolarHBondContact OD1-CB 3.42Å; D374-V377 VanDerWaalsContact OD1-CG2 3.27Å; D374-V377 WeakPolarHBondContact OD1-CG2 3.34Å; D374-V377 PolarHBondContact OD1-N 3.39Å; V377-F380 WeakPolarHBondContact O-CB 3.31Å; V377-F380 PolarHBondContact O-N 2.94Å; V377-L381 HydrophobicContact CG1-CD1 3.99Å; V377-L381 HydrophobicContact CG1-CG 4.2Å; V377-L381 WeakPolarHBondContact O-CG 3.38Å; V377-L381 PolarHBondContact O-N 3.28Å; V377-F401 HydrophobicContact CG2-CZ 4.3Å; V377-I447 HydrophobicContact CG2-CD1 3.74Å
378	K	95.8	Very high	91.8	Very high	79 Å²	79	69.9 Å²	69.9	34%	0.343	34%	0.338	S	S	.	.	H	α-helix	trans	-57.1	-53.3	174.3	179.4	162.8	178.8	49.3	0	111.7	E217 L221 F380 L381 D382	E217-K378 IonicContact OE1-NZ 2.96Å; L221-K378 HydrophobicContact CD1-CB 3.95Å; L221-K378 HydrophobicContact CD2-CB 4.3Å; L221-K378 HydrophobicContact CD2-CD 4.46Å; K378-F380 VanDerWaalsContact C-N 3.25Å; K378-F380 PolarHBondContact O-N 2.93Å; K378-L381 PolarHBondContact O-N 2.84Å; K378-D382 WeakPolarHBondContact CE-OD2 3.48Å; K378-D382 IonicContact NZ-OD1 3.05Å; K378-D382 PolarHBondContact NZ-OD1 3.08Å; K378-D382 IonicContact NZ-OD2 2.76Å; K378-D382 PolarHBondContact NZ-OD2 3.07Å; K378-D382 WeakPolarHBondContact O-CB 3.24Å; K378-D382 PolarHBondContact O-N 2.87Å
379	A	96.3	Very high	91.7	Very high	41 Å²	41	67.6 Å²	67.6	34%	0.339	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-36.6	179.5	0	0	0	0	0	112.3	T375 Q383	T375-A379 VanDerWaalsContact O-CB 3.3Å; T375-A379 WeakPolarHBondContact O-CB 3.19Å; T375-A379 PolarHBondContact O-N 3.39Å; A379-Q383 WeakPolarHBondContact O-CB 3.29Å; A379-Q383 VanDerWaalsContact O-CG 3.24Å; A379-Q383 WeakPolarHBondContact O-CG 3.31Å; A379-Q383 PolarHBondContact O-N 3.1Å; A379-Q383 PolarHBondContact O-NE2 3.04Å
380	F	97.2	Very high	91.3	Very high	5 Å²	5	65.2 Å²	65.2	2%	0.022	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-50	175.1	168.5	-101.9	0	0	0	112.4	F254 L376 V377 K378 Q383 I384 F397 L398 F401	F254-F380 HydrophobicContact CE1-CE1 4.1Å; F254-F380 AromaticContact CZ-CE1 3.94Å; F254-F380 HydrophobicContact CZ-CE1 3.94Å; L376-F380 WeakPolarHBondContact O-CB 3.22Å; L376-F380 PolarHBondContact O-N 2.69Å; V377-F380 WeakPolarHBondContact O-CB 3.31Å; V377-F380 PolarHBondContact O-N 2.94Å; K378-F380 VanDerWaalsContact C-N 3.25Å; K378-F380 PolarHBondContact O-N 2.93Å; F380-Q383 PolarHBondContact O-N 3.47Å; F380-I384 HydrophobicContact CE1-CD1 4.09Å; F380-I384 HydrophobicContact CE1-CG2 4.4Å; F380-I384 HydrophobicContact CE2-CB 4.34Å; F380-I384 HydrophobicContact CE2-CD1 3.75Å; F380-I384 HydrophobicContact CZ-CB 4.32Å; F380-I384 HydrophobicContact CZ-CD1 3.31Å; F380-I384 HydrophobicContact CZ-CG1 4.37Å; F380-I384 WeakPolarHBondContact O-CB 3.43Å; F380-I384 WeakPolarHBondContact O-CG2 3.01Å; F380-I384 PolarHBondContact O-N 2.6Å; F380-F397 AromaticContact CD2-CD1 3.88Å; F380-F397 HydrophobicContact CD2-CD1 3.88Å; F380-F397 AromaticContact CD2-CE1 3.54Å; F380-F397 HydrophobicContact CD2-CE1 3.54Å; F380-F397 HydrophobicContact CD2-CZ 4.42Å; F380-F397 AromaticContact CE2-CD1 3.65Å; F380-F397 HydrophobicContact CE2-CD1 3.65Å; F380-F397 AromaticContact CE2-CE1 3.83Å; F380-F397 HydrophobicContact CE2-CE1 3.83Å; F380-L398 HydrophobicContact CE2-CB 4.44Å; F380-L398 HydrophobicContact CE2-CD1 4.4Å; F380-L398 HydrophobicContact CZ-CB 4.26Å; F380-L398 HydrophobicContact CZ-CD1 3.78Å; F380-F401 HydrophobicContact CB-CD2 3.85Å; F380-F401 HydrophobicContact CB-CE2 3.74Å; F380-F401 HydrophobicContact CB-CG 4.3Å; F380-F401 HydrophobicContact CB-CZ 4.11Å; F380-F401 HydrophobicContact CD1-CD1 4.42Å; F380-F401 HydrophobicContact CD1-CE1 4.41Å; F380-F401 HydrophobicContact CD2-CB 3.69Å; F380-F401 AromaticContact CD2-CD1 4Å; F380-F401 HydrophobicContact CD2-CD1 4Å; F380-F401 AromaticContact CD2-CD2 3.91Å; F380-F401 HydrophobicContact CD2-CD2 3.91Å; F380-F401 AromaticContact CD2-CG 3.59Å; F380-F401 HydrophobicContact CD2-CG 3.59Å; F380-F401 HydrophobicContact CE2-CB 3.84Å; F380-F401 HydrophobicContact CE2-CD1 4.21Å; F380-F401 HydrophobicContact CE2-CG 4.05Å; F380-F401 HydrophobicContact CG-CD1 4.09Å; F380-F401 HydrophobicContact CG-CD2 4.02Å; F380-F401 HydrophobicContact CG-CE1 4.27Å; F380-F401 HydrophobicContact CG-CE2 4.21Å; F380-F401 AromaticContact CG-CG 3.95Å; F380-F401 HydrophobicContact CG-CG 3.95Å; F380-F401 HydrophobicContact CG-CZ 4.33Å
381	L	95.4	Very high	91.2	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-41.1	179.7	-72.1	178.3	0	0	0	111.8	L206 I211 L220 L221 I224 V377 K378 Q383 I384 F385	L206-L381 HydrophobicContact CD2-CD2 4.4Å; I211-L381 HydrophobicContact CD1-CB 3.95Å; L220-L381 HydrophobicContact CD2-CD2 4.14Å; L220-L381 HydrophobicContact CG-CD1 4.37Å; L220-L381 HydrophobicContact CG-CD2 4.47Å; L221-L381 HydrophobicContact CB-CD1 3.96Å; L221-L381 HydrophobicContact CD1-CD1 4.01Å; I224-L381 HydrophobicContact CD1-CD1 4.29Å; I224-L381 HydrophobicContact CD1-CD2 3.91Å; V377-L381 HydrophobicContact CG1-CD1 3.99Å; V377-L381 HydrophobicContact CG1-CG 4.2Å; V377-L381 WeakPolarHBondContact O-CG 3.38Å; V377-L381 PolarHBondContact O-N 3.28Å; K378-L381 PolarHBondContact O-N 2.84Å; L381-Q383 PolarHBondContact O-N 3.25Å; L381-I384 HydrophobicContact CD2-CG2 4.41Å; L381-F385 HydrophobicContact CD2-CE2 4.15Å; L381-F385 WeakPolarHBondContact O-CD2 3.38Å
382	D	92.9	Very high	91.8	Very high	64 Å²	64	67.1 Å²	67.1	34%	0.342	35%	0.352	S	S	.	.	H	α-helix	trans	-58.2	-31.3	175.7	-68.9	-9.9	0	0	0	110.9	K378 H386	K378-D382 WeakPolarHBondContact CE-OD2 3.48Å; K378-D382 IonicContact NZ-OD1 3.05Å; K378-D382 PolarHBondContact NZ-OD1 3.08Å; K378-D382 IonicContact NZ-OD2 2.76Å; K378-D382 PolarHBondContact NZ-OD2 3.07Å; K378-D382 WeakPolarHBondContact O-CB 3.24Å; K378-D382 PolarHBondContact O-N 2.87Å; D382-H386 PolarHBondContact O-CE1 3.31Å; D382-H386 PolarHBondContact O-ND1 2.84Å
383	Q	94.2	Very high	92.3	Very high	107 Å²	107	67.3 Å²	67.3	50%	0.5	36%	0.355	S	S	.	.	H	α-helix	trans	-95.2	-37.5	-176	-68.6	173.4	35.4	0	0	114.4	A379 F380 L381 F385 H386 F397	A379-Q383 WeakPolarHBondContact O-CB 3.29Å; A379-Q383 VanDerWaalsContact O-CG 3.24Å; A379-Q383 WeakPolarHBondContact O-CG 3.31Å; A379-Q383 PolarHBondContact O-N 3.1Å; A379-Q383 PolarHBondContact O-NE2 3.04Å; F380-Q383 PolarHBondContact O-N 3.47Å; L381-Q383 PolarHBondContact O-N 3.25Å; Q383-F385 VanDerWaalsContact C-N 3.32Å; Q383-F385 PolarHBondContact O-N 2.85Å; Q383-H386 WeakPolarHBondContact O-CB 3.02Å; Q383-H386 PolarHBondContact O-N 2.87Å; Q383-H386 VanDerWaalsContact O-N 3.16Å; Q383-F397 HydrophobicContact CB-CE1 4.02Å; Q383-F397 HydrophobicContact CB-CZ 3.9Å
384	I	94.9	Very high	92.7	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-35.2	-170.5	-170.1	164.2	0	0	0	113.1	L206 F380 L381 H386 L387 R394 F397	L206-I384 HydrophobicContact CD1-CD1 4.07Å; L206-I384 HydrophobicContact CD2-CD1 4.46Å; F380-I384 HydrophobicContact CE1-CD1 4.09Å; F380-I384 HydrophobicContact CE1-CG2 4.4Å; F380-I384 HydrophobicContact CE2-CB 4.34Å; F380-I384 HydrophobicContact CE2-CD1 3.75Å; F380-I384 HydrophobicContact CZ-CB 4.32Å; F380-I384 HydrophobicContact CZ-CD1 3.31Å; F380-I384 HydrophobicContact CZ-CG1 4.37Å; F380-I384 WeakPolarHBondContact O-CB 3.43Å; F380-I384 WeakPolarHBondContact O-CG2 3.01Å; F380-I384 PolarHBondContact O-N 2.6Å; L381-I384 HydrophobicContact CD2-CG2 4.41Å; I384-H386 VanDerWaalsContact C-N 3.27Å; I384-H386 PolarHBondContact O-N 2.76Å; I384-L387 WeakPolarHBondContact O-CB 3.48Å; I384-L387 PolarHBondContact O-N 2.84Å; I384-L387 VanDerWaalsContact O-N 3.13Å; I384-R394 HydrophobicContact CD1-CB 4.15Å; I384-R394 HydrophobicContact CG1-CB 4.08Å; I384-R394 HydrophobicContact CG1-CG 3.91Å; I384-R394 PolarHBondContact O-NE 3.01Å; I384-F397 HydrophobicContact CB-CD1 3.96Å; I384-F397 HydrophobicContact CB-CE1 4.15Å; I384-F397 HydrophobicContact CD1-CD1 4.37Å; I384-F397 HydrophobicContact CG1-CD1 4.1Å
385	F	92.1	Very high	92.8	Very high	24 Å²	24	59 Å²	59	11%	0.105	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.4	-179.1	-72.2	-83.1	0	0	0	113.3	L206 I211 L220 L381 Q383 L387 R394	L206-F385 HydrophobicContact CD2-CE2 4.49Å; L206-F385 HydrophobicContact CD2-CZ 4.25Å; I211-F385 HydrophobicContact CB-CD1 4.37Å; I211-F385 HydrophobicContact CB-CD2 3.73Å; I211-F385 HydrophobicContact CB-CE1 4.41Å; I211-F385 HydrophobicContact CB-CE2 3.78Å; I211-F385 HydrophobicContact CB-CG 4.05Å; I211-F385 HydrophobicContact CB-CZ 4.13Å; I211-F385 HydrophobicContact CD1-CD2 3.82Å; I211-F385 HydrophobicContact CD1-CE2 3.62Å; I211-F385 HydrophobicContact CG1-CD2 3.98Å; I211-F385 HydrophobicContact CG1-CE2 3.62Å; I211-F385 HydrophobicContact CG1-CZ 4.09Å; L220-F385 HydrophobicContact CD2-CE2 4.23Å; L220-F385 HydrophobicContact CD2-CZ 4.11Å; L381-F385 HydrophobicContact CD2-CE2 4.15Å; L381-F385 WeakPolarHBondContact O-CD2 3.38Å; Q383-F385 VanDerWaalsContact C-N 3.32Å; Q383-F385 PolarHBondContact O-N 2.85Å; F385-L387 PolarHBondContact O-N 2.9Å; F385-R394 PolarHBondContact O-NH2 2.95Å
386	H	92.1	Very high	92.8	Very high	161 Å²	161	58.5 Å²	58.5	75%	0.745	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.9	170.1	-66.6	89	0	0	0	112.7	D382 Q383 I384	D382-H386 PolarHBondContact O-CE1 3.31Å; D382-H386 PolarHBondContact O-ND1 2.84Å; Q383-H386 WeakPolarHBondContact O-CB 3.02Å; Q383-H386 PolarHBondContact O-N 2.87Å; Q383-H386 VanDerWaalsContact O-N 3.16Å; I384-H386 VanDerWaalsContact C-N 3.27Å; I384-H386 PolarHBondContact O-N 2.76Å
387	L	92.7	Very high	92.8	Very high	53 Å²	53	59 Å²	59	28%	0.277	33%	0.328	S	S	.	.	S	Bend	trans	-80.3	140.8	176.3	-55.1	176.3	0	0	0	109.9	I384 F385 L393 R394 F397	I384-L387 WeakPolarHBondContact O-CB 3.48Å; I384-L387 PolarHBondContact O-N 2.84Å; I384-L387 VanDerWaalsContact O-N 3.13Å; F385-L387 PolarHBondContact O-N 2.9Å; L387-L393 HydrophobicContact CB-CB 4.3Å; L387-L393 HydrophobicContact CD1-CB 4.41Å; L387-R394 HydrophobicContact CB-CG 3.97Å; L387-R394 PolarHBondContact O-NE 3.2Å; L387-R394 PolarHBondContact O-NH2 3.12Å; L387-F397 HydrophobicContact CD1-CB 3.67Å; L387-F397 HydrophobicContact CD1-CD1 4.15Å; L387-F397 HydrophobicContact CD1-CG 3.88Å
388	K	88.8	Confident	92.8	Very high	149 Å²	149	59.5 Å²	59.5	65%	0.648	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-66.8	135.1	178.9	-70.6	-68	179.2	-172.4	0	111.7	L391	K388-L391 HydrophobicContact CB-CD1 4.04Å
389	P	87.7	Confident	92.8	Very high	33 Å²	33	58.5 Å²	58.5	21%	0.214	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	163.2	170.8	27.9	-31.8	0	0	0	111	N207 D209 L391	N207-P389 WeakPolarHBondContact OD1-CB 2.79Å; D209-P389 WeakPolarHBondContact OD1-CG 3.49Å; P389-L391 PolarHBondContact O-N 2.63Å
390	G	79.8	Confident	92.9	Very high	74 Å²	74	61.8 Å²	61.8	76%	0.763	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	-12.5	176.2	0	0	0	0	0	117.3
391	L	85.1	Confident	93	Very high	112 Å²	112	62.7 Å²	62.7	59%	0.586	35%	0.349	S	S	*	.	S	Bend	trans	-95.9	18	-179.9	-64.1	-178.7	0	0	0	114.2	K388 P389 L393	K388-L391 HydrophobicContact CB-CD1 4.04Å; P389-L391 PolarHBondContact O-N 2.63Å; L391-L393 HydrophobicContact CB-CD1 4.21Å; L391-L393 HydrophobicContact CB-CG 4.06Å; L391-L393 PolarHBondContact O-N 3.46Å
392	S	90.9	Very high	93.1	Very high	79 Å²	79	63.8 Å²	63.8	55%	0.552	36%	0.355	S	S	*	.	S	Bend	trans	58.1	-3.6	-173.8	73.9	0	0	0	0	116.5	R394 S395 T396	S392-R394 PolarHBondContact O-N 3.36Å; S392-S395 PolarHBondContact O-N 2.85Å; S392-S395 PolarHBondContact O-OG 3.04Å; S392-T396 PolarHBondContact O-N 3.01Å; S392-T396 VanDerWaalsContact O-N 3.08Å; S392-T396 PolarHBondContact O-OG1 3.23Å
393	L	94.4	Very high	93.3	Very high	81 Å²	81	64.6 Å²	64.6	42%	0.424	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-46	-178.5	-63.5	176.9	0	0	0	112.5	L387 L391 S395 T396 F397	L387-L393 HydrophobicContact CB-CB 4.3Å; L387-L393 HydrophobicContact CD1-CB 4.41Å; L391-L393 HydrophobicContact CB-CD1 4.21Å; L391-L393 HydrophobicContact CB-CG 4.06Å; L391-L393 PolarHBondContact O-N 3.46Å; L393-S395 VanDerWaalsContact C-N 3.32Å; L393-S395 PolarHBondContact O-N 3.09Å; L393-T396 PolarHBondContact O-N 3.12Å; L393-F397 WeakPolarHBondContact O-CB 3.44Å; L393-F397 PolarHBondContact O-N 3.4Å
394	R	94.4	Very high	93.5	Very high	8 Å²	8	62.9 Å²	62.9	3%	0.03	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-39.6	178.9	-67.2	-170.9	-179.1	-178.2	-2	112.1	I201 L206 D208 D209 I384 F385 L387 S392 F397 L398	I201-R394 HydrophobicContact CD1-CB 3.86Å; L206-R394 WeakPolarHBondContact O-CD 3.24Å; L206-R394 PolarHBondContact O-NH1 3.42Å; D208-R394 PolarHBondContact O-NH1 2.73Å; D209-R394 PolarHBondContact O-NH2 3.19Å; I384-R394 HydrophobicContact CD1-CB 4.15Å; I384-R394 HydrophobicContact CG1-CB 4.08Å; I384-R394 HydrophobicContact CG1-CG 3.91Å; I384-R394 PolarHBondContact O-NE 3.01Å; F385-R394 PolarHBondContact O-NH2 2.95Å; L387-R394 HydrophobicContact CB-CG 3.97Å; L387-R394 PolarHBondContact O-NE 3.2Å; L387-R394 PolarHBondContact O-NH2 3.12Å; S392-R394 PolarHBondContact O-N 3.36Å; R394-F397 PolarHBondContact O-N 3.49Å; R394-L398 VanDerWaalsContact O-CB 3.31Å; R394-L398 WeakPolarHBondContact O-CB 3.43Å; R394-L398 PolarHBondContact O-N 2.92Å
395	S	94.1	Very high	93.7	Very high	49 Å²	49	62.9 Å²	62.9	34%	0.343	36%	0.356	S	S	.	.	H	α-helix	trans	-66	-39.6	175.9	73.5	0	0	0	0	112.5	S392 L393 A399	S392-S395 PolarHBondContact O-N 2.85Å; S392-S395 PolarHBondContact O-OG 3.04Å; L393-S395 VanDerWaalsContact C-N 3.32Å; L393-S395 PolarHBondContact O-N 3.09Å; S395-A399 WeakPolarHBondContact O-CB 3.37Å; S395-A399 PolarHBondContact O-N 2.69Å
396	T	95.9	Very high	93.9	Very high	69 Å²	69	65 Å²	65	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	-67.3	-43.8	177.1	-58.2	0	0	0	0	111	S392 L393 A399 Q400	S392-T396 PolarHBondContact O-N 3.01Å; S392-T396 VanDerWaalsContact O-N 3.08Å; S392-T396 PolarHBondContact O-OG1 3.23Å; L393-T396 PolarHBondContact O-N 3.12Å; T396-A399 PolarHBondContact O-N 3.5Å; T396-Q400 WeakPolarHBondContact O-CG 3.36Å; T396-Q400 PolarHBondContact O-N 3.13Å
397	F	97.2	Very high	94.2	Very high	46 Å²	46	64.9 Å²	64.9	20%	0.202	36%	0.359	C	S	.	.	H	α-helix	trans	-64.9	-42	177.8	-172.3	-114	0	0	0	112.1	F380 Q383 I384 L387 L393 R394 A399 Q400 F401	F380-F397 AromaticContact CD2-CD1 3.88Å; F380-F397 HydrophobicContact CD2-CD1 3.88Å; F380-F397 AromaticContact CD2-CE1 3.54Å; F380-F397 HydrophobicContact CD2-CE1 3.54Å; F380-F397 HydrophobicContact CD2-CZ 4.42Å; F380-F397 AromaticContact CE2-CD1 3.65Å; F380-F397 HydrophobicContact CE2-CD1 3.65Å; F380-F397 AromaticContact CE2-CE1 3.83Å; F380-F397 HydrophobicContact CE2-CE1 3.83Å; Q383-F397 HydrophobicContact CB-CE1 4.02Å; Q383-F397 HydrophobicContact CB-CZ 3.9Å; I384-F397 HydrophobicContact CB-CD1 3.96Å; I384-F397 HydrophobicContact CB-CE1 4.15Å; I384-F397 HydrophobicContact CD1-CD1 4.37Å; I384-F397 HydrophobicContact CG1-CD1 4.1Å; L387-F397 HydrophobicContact CD1-CB 3.67Å; L387-F397 HydrophobicContact CD1-CD1 4.15Å; L387-F397 HydrophobicContact CD1-CG 3.88Å; L393-F397 WeakPolarHBondContact O-CB 3.44Å; L393-F397 PolarHBondContact O-N 3.4Å; R394-F397 PolarHBondContact O-N 3.49Å; F397-A399 PolarHBondContact O-N 3.42Å; F397-Q400 PolarHBondContact O-N 2.88Å; F397-F401 PolarHBondContact O-N 2.98Å
398	L	96.9	Very high	94.5	Very high	10 Å²	10	64.6 Å²	64.6	5%	0.052	36%	0.355	C	S	.	.	H	α-helix	trans	-57.4	-46.7	171	171.8	68.3	0	0	0	111.7	L206 L253 F254 F380 R394 Q400 F401 L402	L206-L398 HydrophobicContact CD1-CD2 4.45Å; L253-L398 HydrophobicContact CB-CD2 3.84Å; L253-L398 HydrophobicContact CD1-CD2 4.13Å; L253-L398 HydrophobicContact CD2-CD2 4.19Å; L253-L398 HydrophobicContact CG-CD2 4.3Å; F254-L398 HydrophobicContact CD1-CD1 4.12Å; F254-L398 HydrophobicContact CE1-CD1 3.69Å; F254-L398 HydrophobicContact CZ-CD1 4.02Å; F380-L398 HydrophobicContact CE2-CB 4.44Å; F380-L398 HydrophobicContact CE2-CD1 4.4Å; F380-L398 HydrophobicContact CZ-CB 4.26Å; F380-L398 HydrophobicContact CZ-CD1 3.78Å; R394-L398 VanDerWaalsContact O-CB 3.31Å; R394-L398 WeakPolarHBondContact O-CB 3.43Å; R394-L398 PolarHBondContact O-N 2.92Å; L398-Q400 VanDerWaalsContact C-N 3.29Å; L398-Q400 PolarHBondContact O-N 3.32Å; L398-F401 WeakPolarHBondContact O-CB 3.44Å; L398-F401 PolarHBondContact O-N 3.35Å; L398-L402 HydrophobicContact CD1-CD1 4.23Å; L398-L402 HydrophobicContact CD1-CG 4.21Å; L398-L402 HydrophobicContact CG-CD1 4.2Å; L398-L402 WeakPolarHBondContact O-CG 3.35Å; L398-L402 PolarHBondContact O-N 3.11Å
399	A	96.8	Very high	94.9	Very high	58 Å²	58	57.5 Å²	57.5	48%	0.479	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-38.5	178.8	0	0	0	0	0	112.2	S395 T396 F397 L403	S395-A399 WeakPolarHBondContact O-CB 3.37Å; S395-A399 PolarHBondContact O-N 2.69Å; T396-A399 PolarHBondContact O-N 3.5Å; F397-A399 PolarHBondContact O-N 3.42Å; A399-L403 WeakPolarHBondContact O-CB 3.28Å; A399-L403 PolarHBondContact O-N 3.35Å
400	Q	97.9	Very high	95.4	Very high	111 Å²	111	60.3 Å²	60.3	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-65.4	-43.6	174.2	-70.3	175.4	0.9	0	0	112	T396 F397 L398 L403 V404	T396-Q400 WeakPolarHBondContact O-CG 3.36Å; T396-Q400 PolarHBondContact O-N 3.13Å; F397-Q400 PolarHBondContact O-N 2.88Å; L398-Q400 VanDerWaalsContact C-N 3.29Å; L398-Q400 PolarHBondContact O-N 3.32Å; Q400-L403 WeakPolarHBondContact O-CB 3.44Å; Q400-L403 PolarHBondContact O-N 2.84Å; Q400-V404 WeakPolarHBondContact O-CG2 3.43Å; Q400-V404 PolarHBondContact O-N 3.39Å
401	F	98.3	Very high	96.3	Very high	23 Å²	23	60.2 Å²	60.2	10%	0.101	32%	0.322	C	S	.	.	H	α-helix	trans	-57.2	-50.8	175.1	175.2	-109.8	0	0	0	111.2	L228 F254 L376 V377 F380 F397 L398 L403 V404 L405	L228-F401 HydrophobicContact CD1-CE1 4.49Å; F254-F401 HydrophobicContact CD1-CE1 4.22Å; F254-F401 HydrophobicContact CE1-CD1 4.11Å; F254-F401 AromaticContact CE1-CE1 3.87Å; F254-F401 HydrophobicContact CE1-CE1 3.87Å; L376-F401 HydrophobicContact CB-CE2 4.33Å; V377-F401 HydrophobicContact CG2-CZ 4.3Å; F380-F401 HydrophobicContact CB-CD2 3.85Å; F380-F401 HydrophobicContact CB-CE2 3.74Å; F380-F401 HydrophobicContact CB-CG 4.3Å; F380-F401 HydrophobicContact CB-CZ 4.11Å; F380-F401 HydrophobicContact CD1-CD1 4.42Å; F380-F401 HydrophobicContact CD1-CE1 4.41Å; F380-F401 HydrophobicContact CD2-CB 3.69Å; F380-F401 AromaticContact CD2-CD1 4Å; F380-F401 HydrophobicContact CD2-CD1 4Å; F380-F401 AromaticContact CD2-CD2 3.91Å; F380-F401 HydrophobicContact CD2-CD2 3.91Å; F380-F401 AromaticContact CD2-CG 3.59Å; F380-F401 HydrophobicContact CD2-CG 3.59Å; F380-F401 HydrophobicContact CE2-CB 3.84Å; F380-F401 HydrophobicContact CE2-CD1 4.21Å; F380-F401 HydrophobicContact CE2-CG 4.05Å; F380-F401 HydrophobicContact CG-CD1 4.09Å; F380-F401 HydrophobicContact CG-CD2 4.02Å; F380-F401 HydrophobicContact CG-CE1 4.27Å; F380-F401 HydrophobicContact CG-CE2 4.21Å; F380-F401 AromaticContact CG-CG 3.95Å; F380-F401 HydrophobicContact CG-CG 3.95Å; F380-F401 HydrophobicContact CG-CZ 4.33Å; F397-F401 PolarHBondContact O-N 2.98Å; L398-F401 WeakPolarHBondContact O-CB 3.44Å; L398-F401 PolarHBondContact O-N 3.35Å; F401-L403 VanDerWaalsContact C-N 3.32Å; F401-L403 PolarHBondContact O-N 3.2Å; F401-V404 PolarHBondContact O-N 2.87Å; F401-L405 HydrophobicContact CD1-CD1 4.17Å; F401-L405 HydrophobicContact CE1-CD1 3.58Å; F401-L405 HydrophobicContact CE1-CG 4.29Å; F401-L405 HydrophobicContact CE2-CD1 4.42Å; F401-L405 HydrophobicContact CE2-CD2 4.31Å; F401-L405 HydrophobicContact CE2-CG 4.37Å; F401-L405 HydrophobicContact CZ-CD1 3.73Å; F401-L405 HydrophobicContact CZ-CD2 4.23Å; F401-L405 HydrophobicContact CZ-CG 4.16Å; F401-L405 WeakPolarHBondContact O-CG 3.46Å; F401-L405 PolarHBondContact O-N 2.88Å
402	L	98	Very high	96.9	Very high	27 Å²	27	54.9 Å²	54.9	14%	0.141	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-40.6	177	-66	176.1	0	0	0	112.3	L253 F254 L398 V404 L405 H406	L253-L402 WeakPolarHBondContact O-CD1 3.47Å; F254-L402 HydrophobicContact CB-CD2 4.24Å; F254-L402 HydrophobicContact CD1-CD2 3.82Å; F254-L402 HydrophobicContact CG-CD2 4.45Å; L398-L402 HydrophobicContact CD1-CD1 4.23Å; L398-L402 HydrophobicContact CD1-CG 4.21Å; L398-L402 HydrophobicContact CG-CD1 4.2Å; L398-L402 WeakPolarHBondContact O-CG 3.35Å; L398-L402 PolarHBondContact O-N 3.11Å; L402-V404 VanDerWaalsContact C-N 3.33Å; L402-V404 PolarHBondContact O-N 3.46Å; L402-L405 PolarHBondContact O-N 3.04Å; L402-H406 PolarHBondContact O-N 3.42Å; L402-H406 PolarHBondContact O-ND1 3.23Å
403	L	98.1	Very high	97.2	Very high	82 Å²	82	51.4 Å²	51.4	43%	0.429	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177	178.8	62.5	0	0	0	111.9	A399 Q400 F401 H406 R407	A399-L403 WeakPolarHBondContact O-CB 3.28Å; A399-L403 PolarHBondContact O-N 3.35Å; Q400-L403 WeakPolarHBondContact O-CB 3.44Å; Q400-L403 PolarHBondContact O-N 2.84Å; F401-L403 VanDerWaalsContact C-N 3.32Å; F401-L403 PolarHBondContact O-N 3.2Å; L403-H406 PolarHBondContact O-N 2.87Å; L403-R407 HydrophobicContact CD1-CG 4.41Å; L403-R407 WeakPolarHBondContact O-CB 3.15Å; L403-R407 VanDerWaalsContact O-CG 3.3Å; L403-R407 WeakPolarHBondContact O-CG 3.32Å; L403-R407 PolarHBondContact O-N 3.39Å
404	V	97.8	Very high	97.3	Very high	71 Å²	71	52.3 Å²	52.3	43%	0.43	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-43.9	176.8	171.9	0	0	0	0	110.9	Q400 F401 L402 H406 R407 K408	Q400-V404 WeakPolarHBondContact O-CG2 3.43Å; Q400-V404 PolarHBondContact O-N 3.39Å; F401-V404 PolarHBondContact O-N 2.87Å; L402-V404 VanDerWaalsContact C-N 3.33Å; L402-V404 PolarHBondContact O-N 3.46Å; V404-H406 PolarHBondContact O-N 3.49Å; V404-R407 PolarHBondContact O-N 2.97Å; V404-K408 HydrophobicContact CG1-CD 4.5Å; V404-K408 PolarHBondContact O-N 3.33Å
405	L	98.3	Very high	97.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-47.4	176.4	-66.1	-175.3	0	0	0	111.8	L228 L376 F401 L402 R407 K408 A409 I447 I448 L451	L228-L405 HydrophobicContact CD1-CD1 4.25Å; L376-L405 HydrophobicContact CD1-CD2 3.94Å; F401-L405 HydrophobicContact CD1-CD1 4.17Å; F401-L405 HydrophobicContact CE1-CD1 3.58Å; F401-L405 HydrophobicContact CE1-CG 4.29Å; F401-L405 HydrophobicContact CE2-CD1 4.42Å; F401-L405 HydrophobicContact CE2-CD2 4.31Å; F401-L405 HydrophobicContact CE2-CG 4.37Å; F401-L405 HydrophobicContact CZ-CD1 3.73Å; F401-L405 HydrophobicContact CZ-CD2 4.23Å; F401-L405 HydrophobicContact CZ-CG 4.16Å; F401-L405 WeakPolarHBondContact O-CG 3.46Å; F401-L405 PolarHBondContact O-N 2.88Å; L402-L405 PolarHBondContact O-N 3.04Å; L405-R407 PolarHBondContact O-N 3.25Å; L405-K408 PolarHBondContact O-N 2.75Å; L405-A409 WeakPolarHBondContact O-CB 3.47Å; L405-A409 PolarHBondContact O-N 2.79Å; L405-I447 HydrophobicContact CD1-CG2 4.42Å; L405-I447 HydrophobicContact CD2-CG2 4.24Å; L405-I448 HydrophobicContact CB-CD1 4.38Å; L405-I448 HydrophobicContact CD2-CD1 3.75Å; L405-L451 HydrophobicContact CB-CD1 3.66Å; L405-L451 HydrophobicContact CD1-CD1 4.27Å
406	H	97.6	Very high	97.5	Very high	67 Å²	67	52.5 Å²	52.5	31%	0.31	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-38.7	178.7	-74.7	83.4	0	0	0	112.5	L402 L403 V404 A409 L410	L402-H406 PolarHBondContact O-N 3.42Å; L402-H406 PolarHBondContact O-ND1 3.23Å; L403-H406 PolarHBondContact O-N 2.87Å; V404-H406 PolarHBondContact O-N 3.49Å; H406-A409 PolarHBondContact O-N 3.15Å; H406-L410 WeakPolarHBondContact O-CB 3.43Å; H406-L410 PolarHBondContact O-N 3.29Å
407	R	98	Very high	97.5	Very high	159 Å²	159	50.5 Å²	50.5	60%	0.6	25%	0.249	S	C	*	.	H	α-helix	trans	-65.9	-41.8	175.6	-75.7	175.9	176.2	-179.4	-0.1	112	L403 V404 L405 L410 T411	L403-R407 HydrophobicContact CD1-CG 4.41Å; L403-R407 WeakPolarHBondContact O-CB 3.15Å; L403-R407 VanDerWaalsContact O-CG 3.3Å; L403-R407 WeakPolarHBondContact O-CG 3.32Å; L403-R407 PolarHBondContact O-N 3.39Å; V404-R407 PolarHBondContact O-N 2.97Å; L405-R407 PolarHBondContact O-N 3.25Å; R407-L410 PolarHBondContact O-N 3.1Å; R407-T411 WeakPolarHBondContact O-CB 3.34Å; R407-T411 PolarHBondContact O-N 3.22Å; R407-T411 PolarHBondContact O-OG1 3.41Å
408	K	98	Very high	97.4	Very high	48 Å²	48	53.9 Å²	53.9	21%	0.209	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-43.6	173.5	-82.7	-174	172.7	-107.2	0	110.9	V404 L405 T411 L412 L437 D438 I448	V404-K408 HydrophobicContact CG1-CD 4.5Å; V404-K408 PolarHBondContact O-N 3.33Å; L405-K408 PolarHBondContact O-N 2.75Å; K408-T411 PolarHBondContact O-N 3.23Å; K408-L412 WeakPolarHBondContact O-CB 3.42Å; K408-L412 PolarHBondContact O-N 2.91Å; K408-L437 PolarHBondContact NZ-O 3.23Å; K408-D438 PolarHBondContact NZ-O 3.23Å; K408-I448 HydrophobicContact CB-CD1 3.71Å; K408-I448 HydrophobicContact CB-CG1 4.17Å; K408-I448 HydrophobicContact CB-CG2 4.15Å; K408-I448 HydrophobicContact CD-CD1 4.3Å
409	A	98	Very high	97.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-47.4	176	0	0	0	0	0	112.1	L405 H406 T411 L412 I413 I448 L451 A452 I455	L405-A409 WeakPolarHBondContact O-CB 3.47Å; L405-A409 PolarHBondContact O-N 2.79Å; H406-A409 PolarHBondContact O-N 3.15Å; A409-T411 VanDerWaalsContact C-N 3.33Å; A409-T411 PolarHBondContact O-N 3.44Å; A409-L412 WeakPolarHBondContact O-CB 3.13Å; A409-L412 PolarHBondContact O-N 3.24Å; A409-I413 VanDerWaalsContact O-CG1 3.29Å; A409-I413 WeakPolarHBondContact O-CG1 2.97Å; A409-I413 PolarHBondContact O-N 3.12Å; A409-I448 HydrophobicContact CB-CG2 4.22Å; A409-L451 HydrophobicContact CB-CB 3.88Å; A409-A452 HydrophobicContact CB-CB 4.35Å; A409-I455 HydrophobicContact CB-CD1 4.32Å
410	L	98.1	Very high	97.1	Very high	92 Å²	92	53.9 Å²	53.9	48%	0.482	26%	0.261	S	S	.	.	H	α-helix	trans	-62.6	-40	177	-176.1	62.2	0	0	0	112.3	H406 R407 I413 K414	H406-L410 WeakPolarHBondContact O-CB 3.43Å; H406-L410 PolarHBondContact O-N 3.29Å; R407-L410 PolarHBondContact O-N 3.1Å; L410-I413 PolarHBondContact O-N 3.37Å; L410-K414 WeakPolarHBondContact O-CG 3.4Å; L410-K414 PolarHBondContact O-N 2.81Å
411	T	98.1	Very high	96.9	Very high	71 Å²	71	53.5 Å²	53.5	44%	0.436	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-42.4	177	-54.7	0	0	0	0	110.9	R407 K408 A409 I413 K414 Y415 L437	R407-T411 WeakPolarHBondContact O-CB 3.34Å; R407-T411 PolarHBondContact O-N 3.22Å; R407-T411 PolarHBondContact O-OG1 3.41Å; K408-T411 PolarHBondContact O-N 3.23Å; A409-T411 VanDerWaalsContact C-N 3.33Å; A409-T411 PolarHBondContact O-N 3.44Å; T411-I413 PolarHBondContact O-N 2.9Å; T411-K414 PolarHBondContact O-N 3.42Å; T411-Y415 WeakPolarHBondContact O-CB 3.46Å; T411-Y415 PolarHBondContact O-N 2.69Å; T411-L437 HydrophobicContact CG2-CD2 3.7Å
412	L	97.6	Very high	96.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-44.9	174.4	179.4	146.5	0	0	0	111.6	K408 A409 K414 Y415 I416 L433 L437 L439 L445 I448 M449 A452	K408-L412 WeakPolarHBondContact O-CB 3.42Å; K408-L412 PolarHBondContact O-N 2.91Å; A409-L412 WeakPolarHBondContact O-CB 3.13Å; A409-L412 PolarHBondContact O-N 3.24Å; L412-K414 VanDerWaalsContact C-N 3.31Å; L412-K414 PolarHBondContact O-N 2.96Å; L412-Y415 PolarHBondContact O-N 3.06Å; L412-I416 HydrophobicContact CD2-CD1 3.47Å; L412-I416 VanDerWaalsContact CD2-CD1 3.47Å; L412-I416 HydrophobicContact CG-CD1 4.06Å; L412-I416 WeakPolarHBondContact O-CD1 3.45Å; L412-I416 WeakPolarHBondContact O-CG1 3.46Å; L412-I416 PolarHBondContact O-N 3.31Å; L412-I416 VanDerWaalsContact O-N 3.07Å; L412-L433 HydrophobicContact CD1-CD2 3.99Å; L412-L433 HydrophobicContact CG-CD1 4.37Å; L412-L437 HydrophobicContact CB-CD1 3.93Å; L412-L437 HydrophobicContact CG-CD1 4.4Å; L412-L439 HydrophobicContact CD1-CD1 4Å; L412-L445 HydrophobicContact CD1-CD1 4.25Å; L412-I448 HydrophobicContact CB-CG2 4.18Å; L412-I448 HydrophobicContact CD1-CG2 3.92Å; L412-M449 HydrophobicContact CD1-CG 4.2Å; L412-M449 HydrophobicContact CD1-SD 3.64Å; L412-M449 HydrophobicContact CD2-SD 3.54Å; L412-M449 VanDerWaalsContact CD2-SD 3.54Å; L412-M449 HydrophobicContact CG-SD 4.19Å; L412-A452 HydrophobicContact CD2-CB 3.79Å
413	I	97.4	Very high	96.1	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-47.4	175.9	-66.6	169.1	0	0	0	110.3	A409 L410 T411 I416 E417 A452 I455 K456 L459	A409-I413 VanDerWaalsContact O-CG1 3.29Å; A409-I413 WeakPolarHBondContact O-CG1 2.97Å; A409-I413 PolarHBondContact O-N 3.12Å; L410-I413 PolarHBondContact O-N 3.37Å; T411-I413 PolarHBondContact O-N 2.9Å; I413-I416 PolarHBondContact O-N 3.45Å; I413-E417 HydrophobicContact CG2-CG 4.38Å; I413-E417 WeakPolarHBondContact O-CB 3.41Å; I413-E417 WeakPolarHBondContact O-CG 3.43Å; I413-E417 PolarHBondContact O-N 2.66Å; I413-A452 HydrophobicContact CD1-CB 4.14Å; I413-A452 HydrophobicContact CG1-CB 3.83Å; I413-I455 HydrophobicContact CD1-CB 4.04Å; I413-I455 HydrophobicContact CD1-CG2 3.89Å; I413-K456 HydrophobicContact CD1-CB 4.19Å; I413-K456 HydrophobicContact CG2-CD 3.87Å; I413-L459 HydrophobicContact CD1-CD1 4.5Å; I413-L459 HydrophobicContact CG1-CD1 3.78Å
414	K	97.3	Very high	95.7	Very high	101 Å²	101	65.3 Å²	65.3	44%	0.439	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-42.6	-179.1	-68.8	-70.3	161.5	-154.8	0	112.4	L410 T411 L412 I416 E417 D418	L410-K414 WeakPolarHBondContact O-CG 3.4Å; L410-K414 PolarHBondContact O-N 2.81Å; T411-K414 PolarHBondContact O-N 3.42Å; L412-K414 VanDerWaalsContact C-N 3.31Å; L412-K414 PolarHBondContact O-N 2.96Å; K414-I416 VanDerWaalsContact C-N 3.32Å; K414-I416 PolarHBondContact O-N 3.5Å; K414-E417 IonicContact NZ-OE2 2.89Å; K414-E417 PolarHBondContact NZ-OE2 3.33Å; K414-E417 PolarHBondContact O-N 3.2Å; K414-D418 PolarHBondContact O-N 3.2Å
415	Y	97.1	Very high	95.4	Very high	58 Å²	58	67.1 Å²	67.1	23%	0.227	32%	0.319	C	S	.	.	H	α-helix	trans	-55.4	-47.7	175.3	-168.1	-76.5	0	0	0	111.3	T411 L412 D418 D419 S432 L433 D436	T411-Y415 WeakPolarHBondContact O-CB 3.46Å; T411-Y415 PolarHBondContact O-N 2.69Å; L412-Y415 PolarHBondContact O-N 3.06Å; Y415-D418 PolarHBondContact O-N 2.88Å; Y415-D419 VanDerWaalsContact O-CB 3.32Å; Y415-D419 WeakPolarHBondContact O-CB 3.5Å; Y415-D419 PolarHBondContact O-N 3.38Å; Y415-S432 WeakPolarHBondContact OH-CB 3.27Å; Y415-L433 HydrophobicContact CD1-CB 4.14Å; Y415-L433 HydrophobicContact CD1-CD1 3.77Å; Y415-L433 HydrophobicContact CD1-CG 4.06Å; Y415-L433 HydrophobicContact CE1-CB 3.77Å; Y415-L433 HydrophobicContact CE1-CD1 4.23Å; Y415-L433 HydrophobicContact CE1-CG 4.21Å; Y415-L433 HydrophobicContact CG-CD1 4.45Å; Y415-D436 HydrophobicContact CE2-CB 4.17Å; Y415-D436 WeakPolarHBondContact CE2-OD2 3.26Å; Y415-D436 PolarHBondContact OH-OD2 2.96Å
416	I	95.6	Very high	95	Very high	3 Å²	3	71.3 Å²	71.3	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-67.2	-42.5	178.8	-64.6	158.9	0	0	0	111.3	L412 I413 K414 D418 T420 F427 L433 L459 F462 I463	L412-I416 HydrophobicContact CD2-CD1 3.47Å; L412-I416 VanDerWaalsContact CD2-CD1 3.47Å; L412-I416 HydrophobicContact CG-CD1 4.06Å; L412-I416 WeakPolarHBondContact O-CD1 3.45Å; L412-I416 WeakPolarHBondContact O-CG1 3.46Å; L412-I416 PolarHBondContact O-N 3.31Å; L412-I416 VanDerWaalsContact O-N 3.07Å; I413-I416 PolarHBondContact O-N 3.45Å; K414-I416 VanDerWaalsContact C-N 3.32Å; K414-I416 PolarHBondContact O-N 3.5Å; I416-D418 VanDerWaalsContact C-N 3.32Å; I416-D418 PolarHBondContact O-N 3.19Å; I416-T420 HydrophobicContact CG2-CG2 4.3Å; I416-T420 WeakPolarHBondContact O-CB 3.42Å; I416-T420 WeakPolarHBondContact O-CG2 3.45Å; I416-T420 PolarHBondContact O-N 2.87Å; I416-T420 PolarHBondContact O-OG1 2.93Å; I416-F427 HydrophobicContact CG1-CD2 4.35Å; I416-F427 HydrophobicContact CG1-CE2 4.01Å; I416-F427 HydrophobicContact CG1-CZ 4.32Å; I416-F427 HydrophobicContact CG2-CD2 4.24Å; I416-L433 HydrophobicContact CD1-CD1 4.29Å; I416-L433 HydrophobicContact CG1-CD1 3.86Å; I416-L459 HydrophobicContact CD1-CD2 4.39Å; I416-L459 HydrophobicContact CG2-CD2 4.31Å; I416-F462 HydrophobicContact CG2-CD1 4.32Å; I416-F462 HydrophobicContact CG2-CE1 4.08Å; I416-I463 HydrophobicContact CD1-CD1 3.49Å; I416-I463 VanDerWaalsContact CD1-CD1 3.49Å; I416-I463 HydrophobicContact CG1-CD1 4.33Å
417	E	95.4	Very high	94.7	Very high	27 Å²	27	69.1 Å²	69.1	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-44.5	177.7	-78.8	-178.5	164.3	0	0	111.8	I413 K414 Q421 K422 K456	I413-E417 HydrophobicContact CG2-CG 4.38Å; I413-E417 WeakPolarHBondContact O-CB 3.41Å; I413-E417 WeakPolarHBondContact O-CG 3.43Å; I413-E417 PolarHBondContact O-N 2.66Å; K414-E417 IonicContact NZ-OE2 2.89Å; K414-E417 PolarHBondContact NZ-OE2 3.33Å; K414-E417 PolarHBondContact O-N 3.2Å; E417-Q421 CarbonylContact O-C 3.6Å; E417-Q421 WeakPolarHBondContact O-CA 3.47Å; E417-Q421 PolarHBondContact O-N 2.67Å; E417-Q421 VanDerWaalsContact O-N 3.11Å; E417-K422 HydrophobicContact CB-CG 4.48Å; E417-K422 PolarHBondContact O-N 3.19Å; E417-K456 IonicContact OE1-NZ 3.71Å; E417-K456 PolarHBondContact OE1-NZ 2.87Å
418	D	95.1	Very high	94.3	Very high	117 Å²	117	70 Å²	70	63%	0.626	34%	0.344	S	S	*	.	H	α-helix	trans	-75.3	-41.8	-176.3	-66.9	-23.9	0	0	0	111.6	K414 Y415 I416 T420 Q421	K414-D418 PolarHBondContact O-N 3.2Å; Y415-D418 PolarHBondContact O-N 2.88Å; I416-D418 VanDerWaalsContact C-N 3.32Å; I416-D418 PolarHBondContact O-N 3.19Å; D418-T420 VanDerWaalsContact C-N 3.3Å; D418-T420 PolarHBondContact O-N 3.18Å; D418-Q421 PolarHBondContact O-N 3Å
419	D	94	Very high	94	Very high	65 Å²	65	69.3 Å²	69.3	35%	0.348	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-38.9	175.9	-176.9	77.7	0	0	0	112	Y415 F427 S429	Y415-D419 VanDerWaalsContact O-CB 3.32Å; Y415-D419 WeakPolarHBondContact O-CB 3.5Å; Y415-D419 PolarHBondContact O-N 3.38Å; D419-F427 HydrophobicContact CB-CE2 4.39Å; D419-F427 VanDerWaalsContact OD2-CD2 3.28Å; D419-F427 WeakPolarHBondContact OD2-CD2 3.47Å; D419-S429 PolarHBondContact OD1-OG 3.16Å; D419-S429 PolarHBondContact OD2-OG 2.87Å
420	T	93.6	Very high	93.8	Very high	2 Å²	2	71.8 Å²	71.8	1%	0.012	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	0.6	-174.7	65.4	0	0	0	0	114.8	I416 D418 K422 G423 K424 K425 F427 F462	I416-T420 HydrophobicContact CG2-CG2 4.3Å; I416-T420 WeakPolarHBondContact O-CB 3.42Å; I416-T420 WeakPolarHBondContact O-CG2 3.45Å; I416-T420 PolarHBondContact O-N 2.87Å; I416-T420 PolarHBondContact O-OG1 2.93Å; D418-T420 VanDerWaalsContact C-N 3.3Å; D418-T420 PolarHBondContact O-N 3.18Å; T420-K422 VanDerWaalsContact C-N 3.31Å; T420-K422 PolarHBondContact O-N 2.88Å; T420-G423 PolarHBondContact O-N 2.84Å; T420-G423 PolarHBondContact OG1-N 2.88Å; T420-K424 PolarHBondContact O-N 2.95Å; T420-K425 VanDerWaalsContact CB-O 3.27Å; T420-K425 WeakPolarHBondContact CB-O 3.22Å; T420-K425 WeakPolarHBondContact CG2-O 3.49Å; T420-K425 PolarHBondContact O-N 2.83Å; T420-F427 HydrophobicContact CG2-CB 3.83Å; T420-F427 HydrophobicContact CG2-CD2 3.86Å; T420-F427 HydrophobicContact CG2-CG 4.35Å; T420-F462 HydrophobicContact CG2-CE1 3.65Å; T420-F462 HydrophobicContact CG2-CZ 3.8Å
421	Q	93.1	Very high	93.5	Very high	103 Å²	103	77.4 Å²	77.4	48%	0.481	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	49.2	-169.4	-58.4	-178.7	-17.2	0	0	112.2	E417 D418 K424	E417-Q421 CarbonylContact O-C 3.6Å; E417-Q421 WeakPolarHBondContact O-CA 3.47Å; E417-Q421 PolarHBondContact O-N 2.67Å; E417-Q421 VanDerWaalsContact O-N 3.11Å; D418-Q421 PolarHBondContact O-N 3Å; Q421-K424 HydrophobicContact CB-CB 4.22Å; Q421-K424 HydrophobicContact CB-CD 4.33Å; Q421-K424 WeakPolarHBondContact O-CG 3.27Å
422	K	91.3	Very high	93.4	Very high	167 Å²	167	76.8 Å²	76.8	73%	0.726	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	44.8	-177.3	-54.5	-179.3	-179.8	-178.5	0	112.5	E417 T420	E417-K422 HydrophobicContact CB-CG 4.48Å; E417-K422 PolarHBondContact O-N 3.19Å; T420-K422 VanDerWaalsContact C-N 3.31Å; T420-K422 PolarHBondContact O-N 2.88Å
423	G	89.2	Confident	93.3	Very high	39 Å²	39	76.9 Å²	76.9	40%	0.402	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	6.7	176.1	0	0	0	0	0	115.5	T420 K425	T420-G423 PolarHBondContact O-N 2.84Å; T420-G423 PolarHBondContact OG1-N 2.88Å; G423-K425 PolarHBondContact O-N 3.38Å
424	K	90.3	Very high	93.2	Very high	175 Å²	175	78.5 Å²	78.5	76%	0.761	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-27.4	174.1	-71.6	-178.9	179	-176.4	0	112.6	T420 Q421	T420-K424 PolarHBondContact O-N 2.95Å; Q421-K424 HydrophobicContact CB-CB 4.22Å; Q421-K424 HydrophobicContact CB-CD 4.33Å; Q421-K424 WeakPolarHBondContact O-CG 3.27Å
425	K	91.4	Very high	93.1	Very high	108 Å²	108	78.7 Å²	78.7	47%	0.47	38%	0.384	S	S	.	.	S	Bend	trans	-118.9	147	177.8	-63	179.3	-176.5	175.6	0	109.8	T420 G423 F462	T420-K425 VanDerWaalsContact CB-O 3.27Å; T420-K425 WeakPolarHBondContact CB-O 3.22Å; T420-K425 WeakPolarHBondContact CG2-O 3.49Å; T420-K425 PolarHBondContact O-N 2.83Å; G423-K425 PolarHBondContact O-N 3.38Å; K425-F462 WeakPolarHBondContact O-CZ 3.16Å
426	P	89.7	Confident	93	Very high	89 Å²	89	80.8 Å²	80.8	58%	0.578	40%	0.399	S	S	*	.			trans	-64.2	144.5	173.4	28.1	-34.8	0	0	0	110.6
427	F	90.6	Very high	93	Very high	21 Å²	21	82 Å²	82	9%	0.092	41%	0.406	C	S	.	.			trans	-74.2	131.5	176.5	-174.7	-107.8	0	0	0	110.9	I416 D419 T420 L430 L433 F462 I463	I416-F427 HydrophobicContact CG1-CD2 4.35Å; I416-F427 HydrophobicContact CG1-CE2 4.01Å; I416-F427 HydrophobicContact CG1-CZ 4.32Å; I416-F427 HydrophobicContact CG2-CD2 4.24Å; D419-F427 HydrophobicContact CB-CE2 4.39Å; D419-F427 VanDerWaalsContact OD2-CD2 3.28Å; D419-F427 WeakPolarHBondContact OD2-CD2 3.47Å; T420-F427 HydrophobicContact CG2-CB 3.83Å; T420-F427 HydrophobicContact CG2-CD2 3.86Å; T420-F427 HydrophobicContact CG2-CG 4.35Å; F427-L430 HydrophobicContact CE1-CB 3.89Å; F427-L430 HydrophobicContact CE1-CD1 4.22Å; F427-L433 HydrophobicContact CE1-CD1 4.4Å; F427-L433 HydrophobicContact CE2-CD1 4.27Å; F427-L433 HydrophobicContact CZ-CB 4.21Å; F427-L433 HydrophobicContact CZ-CD1 3.59Å; F427-F462 HydrophobicContact CB-CD1 4.32Å; F427-F462 HydrophobicContact CB-CE1 3.77Å; F427-F462 HydrophobicContact CB-CZ 4.45Å; F427-I463 HydrophobicContact CD1-CB 4.44Å; F427-I463 HydrophobicContact CD1-CG1 4.02Å; F427-I463 HydrophobicContact CD1-CG2 3.87Å; F427-I463 HydrophobicContact CE1-CG2 4.22Å; F427-I463 HydrophobicContact CG-CG1 4.42Å
428	K	89.9	Confident	93	Very high	178 Å²	178	86.1 Å²	86.1	77%	0.774	43%	0.429	S	S	*	.			trans	-132.6	-5.9	-179.8	-65.2	-175.8	179.2	-178.6	0	113.8	L430	K428-L430 PolarHBondContact O-N 2.93Å
429	S	91.6	Very high	93.1	Very high	33 Å²	33	80.6 Å²	80.6	23%	0.231	40%	0.399	C	S	.	.			trans	-96.6	28.1	-167.5	-54.8	0	0	0	0	113.7	D419 R431 S432 L433	D419-S429 PolarHBondContact OD1-OG 3.16Å; D419-S429 PolarHBondContact OD2-OG 2.87Å; S429-R431 VanDerWaalsContact C-N 3.32Å; S429-R431 PolarHBondContact O-N 3.04Å; S429-S432 PolarHBondContact O-N 3Å; S429-L433 PolarHBondContact O-N 2.91Å
430	L	92.8	Very high	93.1	Very high	53 Å²	53	82 Å²	82	28%	0.277	41%	0.41	S	S	.	.	H	α-helix	trans	-57.9	-41.1	-173.8	-176.8	63.6	0	0	0	113	F427 K428 L433 K434 L445 F464	F427-L430 HydrophobicContact CE1-CB 3.89Å; F427-L430 HydrophobicContact CE1-CD1 4.22Å; K428-L430 PolarHBondContact O-N 2.93Å; L430-L433 PolarHBondContact O-N 3.45Å; L430-K434 HydrophobicContact CD1-CG 4.5Å; L430-K434 HydrophobicContact CG-CD 4.48Å; L430-K434 WeakPolarHBondContact O-CG 3.36Å; L430-K434 PolarHBondContact O-N 2.97Å; L430-L445 HydrophobicContact CD1-CD2 4.4Å; L430-F464 HydrophobicContact CD1-CZ 4.28Å; L430-F464 HydrophobicContact CD2-CE1 3.76Å; L430-F464 HydrophobicContact CD2-CZ 4.31Å
431	R	93.4	Very high	93.1	Very high	209 Å²	209	83 Å²	83	79%	0.789	42%	0.419	S	S	*	.	H	α-helix	trans	-63.4	-44	180	-173.9	178	-178.5	176.4	1.1	111.9	S429 K434 I435	S429-R431 VanDerWaalsContact C-N 3.32Å; S429-R431 PolarHBondContact O-N 3.04Å; R431-K434 PolarHBondContact O-N 2.88Å; R431-I435 HydrophobicContact CG-CD1 4.32Å; R431-I435 WeakPolarHBondContact O-CG1 3.44Å; R431-I435 PolarHBondContact O-N 3.08Å
432	S	95.1	Very high	93.1	Very high	58 Å²	58	81 Å²	81	41%	0.406	41%	0.409	S	S	.	.	H	α-helix	trans	-64.9	-45.5	177.4	-52.8	0	0	0	0	110.6	Y415 S429 K434 I435 D436	Y415-S432 WeakPolarHBondContact OH-CB 3.27Å; S429-S432 PolarHBondContact O-N 3Å; S432-K434 VanDerWaalsContact C-N 3.31Å; S432-K434 PolarHBondContact O-N 3.35Å; S432-I435 PolarHBondContact O-N 2.67Å; S432-D436 WeakPolarHBondContact O-CB 3.5Å; S432-D436 PolarHBondContact O-N 3.45Å
433	L	95.8	Very high	93.2	Very high	2 Å²	2	73 Å²	73	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-53.9	-46.3	176.2	-177.1	157.1	0	0	0	112.1	L412 Y415 I416 F427 S429 L430 I435 L437 L445	L412-L433 HydrophobicContact CD1-CD2 3.99Å; L412-L433 HydrophobicContact CG-CD1 4.37Å; Y415-L433 HydrophobicContact CD1-CB 4.14Å; Y415-L433 HydrophobicContact CD1-CD1 3.77Å; Y415-L433 HydrophobicContact CD1-CG 4.06Å; Y415-L433 HydrophobicContact CE1-CB 3.77Å; Y415-L433 HydrophobicContact CE1-CD1 4.23Å; Y415-L433 HydrophobicContact CE1-CG 4.21Å; Y415-L433 HydrophobicContact CG-CD1 4.45Å; I416-L433 HydrophobicContact CD1-CD1 4.29Å; I416-L433 HydrophobicContact CG1-CD1 3.86Å; F427-L433 HydrophobicContact CE1-CD1 4.4Å; F427-L433 HydrophobicContact CE2-CD1 4.27Å; F427-L433 HydrophobicContact CZ-CB 4.21Å; F427-L433 HydrophobicContact CZ-CD1 3.59Å; S429-L433 PolarHBondContact O-N 2.91Å; L430-L433 PolarHBondContact O-N 3.45Å; L433-I435 VanDerWaalsContact C-N 3.28Å; L433-I435 PolarHBondContact O-N 2.89Å; L433-L437 HydrophobicContact CD2-CD1 4.05Å; L433-L437 HydrophobicContact CG-CD1 3.94Å; L433-L437 WeakPolarHBondContact O-CB 3.35Å; L433-L437 WeakPolarHBondContact O-CG 3.17Å; L433-L437 PolarHBondContact O-N 3.26Å; L433-L437 VanDerWaalsContact O-N 3.08Å; L433-L445 HydrophobicContact CD2-CD1 4.21Å
434	K	95.3	Very high	93.6	Very high	41 Å²	41	71.5 Å²	71.5	18%	0.178	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-35.7	179.2	-72.8	-175.5	71.1	168.6	0	112.9	L430 R431 S432 L439 T440 E442 L445	L430-K434 HydrophobicContact CD1-CG 4.5Å; L430-K434 HydrophobicContact CG-CD 4.48Å; L430-K434 WeakPolarHBondContact O-CG 3.36Å; L430-K434 PolarHBondContact O-N 2.97Å; R431-K434 PolarHBondContact O-N 2.88Å; S432-K434 VanDerWaalsContact C-N 3.31Å; S432-K434 PolarHBondContact O-N 3.35Å; K434-L439 WeakPolarHBondContact CE-O 3.42Å; K434-L439 WeakPolarHBondContact CG-O 3.31Å; K434-L439 CarbonylContact O-C 3.19Å; K434-L439 PolarHBondContact O-N 3.29Å; K434-T440 VanDerWaalsContact CE-O 3.31Å; K434-T440 WeakPolarHBondContact CE-O 3.46Å; K434-T440 PolarHBondContact NZ-O 3.32Å; K434-T440 PolarHBondContact O-N 3.4Å; K434-E442 IonicContact NZ-OE2 2.65Å; K434-E442 PolarHBondContact NZ-OE2 3.26Å; K434-L445 HydrophobicContact CD-CD2 3.89Å; K434-L445 HydrophobicContact CG-CD2 4.03Å
435	I	95.8	Very high	93.8	Very high	105 Å²	105	63.1 Å²	63.1	54%	0.538	32%	0.321	S	S	.	.	H	α-helix	trans	-78.1	-50.7	179.8	-64.3	167.1	0	0	0	110	R431 S432 L433 L437 D438	R431-I435 HydrophobicContact CG-CD1 4.32Å; R431-I435 WeakPolarHBondContact O-CG1 3.44Å; R431-I435 PolarHBondContact O-N 3.08Å; S432-I435 PolarHBondContact O-N 2.67Å; L433-I435 VanDerWaalsContact C-N 3.28Å; L433-I435 PolarHBondContact O-N 2.89Å; I435-L437 VanDerWaalsContact C-N 3.3Å; I435-L437 PolarHBondContact O-N 2.91Å; I435-D438 PolarHBondContact O-N 3.02Å
436	D	95.2	Very high	94	Very high	102 Å²	102	58.9 Å²	58.9	55%	0.545	30%	0.303	S	S	.	.	H	α-helix	trans	-64.3	-33.9	-173.6	-63.1	-20.9	0	0	0	112.5	Y415 S432	Y415-D436 HydrophobicContact CE2-CB 4.17Å; Y415-D436 WeakPolarHBondContact CE2-OD2 3.26Å; Y415-D436 PolarHBondContact OH-OD2 2.96Å; S432-D436 WeakPolarHBondContact O-CB 3.5Å; S432-D436 PolarHBondContact O-N 3.45Å
437	L	95.1	Very high	94.4	Very high	28 Å²	28	54.7 Å²	54.7	15%	0.147	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	3.9	-178.2	-59	-173.8	0	0	0	114.2	K408 T411 L412 L433 I435 L439	K408-L437 PolarHBondContact NZ-O 3.23Å; T411-L437 HydrophobicContact CG2-CD2 3.7Å; L412-L437 HydrophobicContact CB-CD1 3.93Å; L412-L437 HydrophobicContact CG-CD1 4.4Å; L433-L437 HydrophobicContact CD2-CD1 4.05Å; L433-L437 HydrophobicContact CG-CD1 3.94Å; L433-L437 WeakPolarHBondContact O-CB 3.35Å; L433-L437 WeakPolarHBondContact O-CG 3.17Å; L433-L437 PolarHBondContact O-N 3.26Å; L433-L437 VanDerWaalsContact O-N 3.08Å; I435-L437 VanDerWaalsContact C-N 3.3Å; I435-L437 PolarHBondContact O-N 2.91Å; L437-L439 HydrophobicContact CB-CD1 3.92Å; L437-L439 HydrophobicContact CB-CG 4.06Å; L437-L439 HydrophobicContact CD1-CD1 4.39Å
438	D	95.4	Very high	94.7	Very high	114 Å²	114	53.7 Å²	53.7	61%	0.61	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	57.2	-175.5	-172.5	43.5	0	0	0	111.1	K408 I435	K408-D438 PolarHBondContact NZ-O 3.23Å; I435-D438 PolarHBondContact O-N 3.02Å
439	L	95.7	Very high	95	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.235	C	C	.	.			trans	-130.2	42.2	-179.6	-61.9	175.7	0	0	0	110.2	L412 K434 L437 A441 D444 L445 I448	L412-L439 HydrophobicContact CD1-CD1 4Å; K434-L439 WeakPolarHBondContact CE-O 3.42Å; K434-L439 WeakPolarHBondContact CG-O 3.31Å; K434-L439 CarbonylContact O-C 3.19Å; K434-L439 PolarHBondContact O-N 3.29Å; L437-L439 HydrophobicContact CB-CD1 3.92Å; L437-L439 HydrophobicContact CB-CG 4.06Å; L437-L439 HydrophobicContact CD1-CD1 4.39Å; L439-A441 VanDerWaalsContact C-N 3.35Å; L439-D444 HydrophobicContact CD2-CB 4.23Å; L439-L445 HydrophobicContact CB-CB 4.4Å; L439-L445 HydrophobicContact CB-CD1 4.29Å; L439-L445 HydrophobicContact CD1-CD1 4.07Å; L439-I448 HydrophobicContact CD1-CB 4.25Å; L439-I448 HydrophobicContact CD1-CG1 4.42Å; L439-I448 HydrophobicContact CD1-CG2 4.19Å; L439-I448 HydrophobicContact CD2-CB 4.38Å; L439-I448 HydrophobicContact CD2-CG1 3.73Å
440	T	94.2	Very high	95.2	Very high	93 Å²	93	43.8 Å²	43.8	57%	0.571	23%	0.225	S	C	*	.			trans	-69.5	-34.8	-178.5	52.7	0	0	0	0	112.1	K434	K434-T440 VanDerWaalsContact CE-O 3.31Å; K434-T440 WeakPolarHBondContact CE-O 3.46Å; K434-T440 PolarHBondContact NZ-O 3.32Å; K434-T440 PolarHBondContact O-N 3.4Å
441	A	94.7	Very high	95.4	Very high	25 Å²	25	41.8 Å²	41.8	21%	0.207	21%	0.214	C	C	.	.	S	Bend	trans	-73.2	131.7	173.4	0	0	0	0	0	110.7	T375 L439 G443 D444 L445	T375-A441 HydrophobicContact CG2-CB 4.25Å; L439-A441 VanDerWaalsContact C-N 3.35Å; A441-G443 VanDerWaalsContact C-N 3.33Å; A441-G443 PolarHBondContact O-N 2.9Å; A441-D444 HydrophobicContact CB-CB 4.38Å; A441-D444 WeakPolarHBondContact CB-OD2 3.28Å; A441-D444 PolarHBondContact O-N 3.19Å; A441-L445 PolarHBondContact O-N 2.85Å; A441-L445 VanDerWaalsContact O-N 3.1Å
442	E	92.8	Very high	95.6	Very high	60 Å²	60	31.8 Å²	31.8	28%	0.28	18%	0.177	S	C	.	.	H	α-helix	trans	-67.2	-34.8	-175.7	-160.6	63	-157.7	0	0	112.3	H372 K434 D444 L445 N446	H372-E442 HydrophobicContact CB-CB 4.18Å; K434-E442 IonicContact NZ-OE2 2.65Å; K434-E442 PolarHBondContact NZ-OE2 3.26Å; E442-D444 PolarHBondContact O-N 2.83Å; E442-L445 PolarHBondContact O-N 3.21Å; E442-N446 WeakPolarHBondContact O-CB 3.22Å; E442-N446 VanDerWaalsContact O-CG 3.25Å; E442-N446 PolarHBondContact O-N 2.9Å; E442-N446 PolarHBondContact O-ND2 3.43Å
443	G	93.7	Very high	95.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-42.4	175.6	0	0	0	0	0	112.7	Q229 A441 N446 I447	Q229-G443 PolarHBondContact NE2-O 3.1Å; A441-G443 VanDerWaalsContact C-N 3.33Å; A441-G443 PolarHBondContact O-N 2.9Å; G443-N446 PolarHBondContact O-N 3.36Å; G443-I447 WeakPolarHBondContact O-CG1 3.16Å; G443-I447 PolarHBondContact O-N 3.08Å; G443-I447 VanDerWaalsContact O-N 3.1Å
444	D	96.7	Very high	95.5	Very high	6 Å²	6	30.9 Å²	30.9	3%	0.032	17%	0.165	C	C	.	.	H	α-helix	trans	-67.2	-42.2	177	-65.4	-35.9	0	0	0	111.3	D374 T375 L376 L439 A441 E442 N446 I447 I448	D374-D444 VanDerWaalsContact CB-OD1 3.31Å; D374-D444 WeakPolarHBondContact CB-OD1 3.48Å; T375-D444 WeakPolarHBondContact CB-OD2 3.1Å; T375-D444 PolarHBondContact N-OD1 3.32Å; T375-D444 PolarHBondContact N-OD2 2.79Å; T375-D444 PolarHBondContact OG1-OD2 3.3Å; L376-D444 WeakPolarHBondContact CB-OD1 3.1Å; L376-D444 HydrophobicContact CD1-CB 3.99Å; L376-D444 HydrophobicContact CG-CB 4.3Å; L376-D444 VanDerWaalsContact CG-OD1 3.28Å; L376-D444 WeakPolarHBondContact CG-OD1 3.23Å; L376-D444 PolarHBondContact N-OD1 3.34Å; L439-D444 HydrophobicContact CD2-CB 4.23Å; A441-D444 HydrophobicContact CB-CB 4.38Å; A441-D444 WeakPolarHBondContact CB-OD2 3.28Å; A441-D444 PolarHBondContact O-N 3.19Å; E442-D444 PolarHBondContact O-N 2.83Å; D444-N446 VanDerWaalsContact C-N 3.31Å; D444-N446 PolarHBondContact O-N 3.35Å; D444-I447 PolarHBondContact O-N 2.88Å; D444-I448 WeakPolarHBondContact O-CG1 3.46Å; D444-I448 PolarHBondContact O-N 3.43Å; D444-I448 VanDerWaalsContact O-N 3.1Å
445	L	95.9	Very high	95.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.7	-46.2	174.3	178.5	64.1	0	0	0	110.8	L412 L430 L433 K434 L439 A441 E442 I447 I448 M449	L412-L445 HydrophobicContact CD1-CD1 4.25Å; L430-L445 HydrophobicContact CD1-CD2 4.4Å; L433-L445 HydrophobicContact CD2-CD1 4.21Å; K434-L445 HydrophobicContact CD-CD2 3.89Å; K434-L445 HydrophobicContact CG-CD2 4.03Å; L439-L445 HydrophobicContact CB-CB 4.4Å; L439-L445 HydrophobicContact CB-CD1 4.29Å; L439-L445 HydrophobicContact CD1-CD1 4.07Å; A441-L445 PolarHBondContact O-N 2.85Å; A441-L445 VanDerWaalsContact O-N 3.1Å; E442-L445 PolarHBondContact O-N 3.21Å; L445-I447 PolarHBondContact O-N 2.79Å; L445-I448 PolarHBondContact O-N 2.93Å; L445-M449 HydrophobicContact CD1-CG 3.79Å; L445-M449 HydrophobicContact CG-CG 4.03Å; L445-M449 WeakPolarHBondContact O-CB 3.44Å; L445-M449 VanDerWaalsContact O-CG 3.22Å; L445-M449 WeakPolarHBondContact O-CG 3.23Å; L445-M449 PolarHBondContact O-N 2.87Å
446	N	94.9	Very high	95.4	Very high	19 Å²	19	31.8 Å²	31.8	10%	0.102	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-39.6	179.9	-74.2	-28.9	0	0	0	112.6	Q229 E442 G443 D444 A450	Q229-N446 HydrophobicContact CB-CB 4.37Å; Q229-N446 HydrophobicContact CG-CB 3.91Å; E442-N446 WeakPolarHBondContact O-CB 3.22Å; E442-N446 VanDerWaalsContact O-CG 3.25Å; E442-N446 PolarHBondContact O-N 2.9Å; E442-N446 PolarHBondContact O-ND2 3.43Å; G443-N446 PolarHBondContact O-N 3.36Å; D444-N446 VanDerWaalsContact C-N 3.31Å; D444-N446 PolarHBondContact O-N 3.35Å; N446-A450 WeakPolarHBondContact O-CB 3.27Å; N446-A450 PolarHBondContact O-N 3Å
447	I	97.1	Very high	95.2	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-60.7	-51.3	174.6	-69.1	170.8	0	0	0	110.6	L228 Q229 D374 V377 L405 G443 D444 L445 M449 A450 L451	L228-I447 HydrophobicContact CB-CB 4.46Å; L228-I447 HydrophobicContact CB-CD1 4.33Å; L228-I447 HydrophobicContact CB-CG1 3.9Å; L228-I447 HydrophobicContact CB-CG2 3.99Å; L228-I447 HydrophobicContact CD1-CG2 4.37Å; Q229-I447 HydrophobicContact CG-CD1 4.46Å; Q229-I447 HydrophobicContact CG-CG1 3.57Å; D374-I447 HydrophobicContact CB-CD1 3.84Å; V377-I447 HydrophobicContact CG2-CD1 3.74Å; L405-I447 HydrophobicContact CD1-CG2 4.42Å; L405-I447 HydrophobicContact CD2-CG2 4.24Å; G443-I447 WeakPolarHBondContact O-CG1 3.16Å; G443-I447 PolarHBondContact O-N 3.08Å; G443-I447 VanDerWaalsContact O-N 3.1Å; D444-I447 PolarHBondContact O-N 2.88Å; L445-I447 PolarHBondContact O-N 2.79Å; I447-M449 PolarHBondContact O-N 3.25Å; I447-A450 PolarHBondContact O-N 3.37Å; I447-L451 HydrophobicContact CG2-CD1 4.42Å; I447-L451 WeakPolarHBondContact O-CG 3.37Å; I447-L451 PolarHBondContact O-N 2.98Å; I447-L451 VanDerWaalsContact O-N 3.09Å
448	I	97.8	Very high	95	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.9	-38.4	-177.1	-61	-52.7	0	0	0	111.4	L376 L405 K408 A409 L412 L439 D444 L445 L451 A452	L376-I448 HydrophobicContact CD1-CD1 4.47Å; L405-I448 HydrophobicContact CB-CD1 4.38Å; L405-I448 HydrophobicContact CD2-CD1 3.75Å; K408-I448 HydrophobicContact CB-CD1 3.71Å; K408-I448 HydrophobicContact CB-CG1 4.17Å; K408-I448 HydrophobicContact CB-CG2 4.15Å; K408-I448 HydrophobicContact CD-CD1 4.3Å; A409-I448 HydrophobicContact CB-CG2 4.22Å; L412-I448 HydrophobicContact CB-CG2 4.18Å; L412-I448 HydrophobicContact CD1-CG2 3.92Å; L439-I448 HydrophobicContact CD1-CB 4.25Å; L439-I448 HydrophobicContact CD1-CG1 4.42Å; L439-I448 HydrophobicContact CD1-CG2 4.19Å; L439-I448 HydrophobicContact CD2-CB 4.38Å; L439-I448 HydrophobicContact CD2-CG1 3.73Å; D444-I448 WeakPolarHBondContact O-CG1 3.46Å; D444-I448 PolarHBondContact O-N 3.43Å; D444-I448 VanDerWaalsContact O-N 3.1Å; L445-I448 PolarHBondContact O-N 2.93Å; I448-L451 PolarHBondContact O-N 2.76Å; I448-A452 WeakPolarHBondContact O-CB 3.41Å; I448-A452 PolarHBondContact O-N 3.29Å
449	M	95.6	Very high	94.7	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-64.9	-41.5	175.4	-79	-62.8	-45.6	0	0	112.3	L412 L445 I447 A452 E453 L459 H460 I463 F464	L412-M449 HydrophobicContact CD1-CG 4.2Å; L412-M449 HydrophobicContact CD1-SD 3.64Å; L412-M449 HydrophobicContact CD2-SD 3.54Å; L412-M449 VanDerWaalsContact CD2-SD 3.54Å; L412-M449 HydrophobicContact CG-SD 4.19Å; L445-M449 HydrophobicContact CD1-CG 3.79Å; L445-M449 HydrophobicContact CG-CG 4.03Å; L445-M449 WeakPolarHBondContact O-CB 3.44Å; L445-M449 VanDerWaalsContact O-CG 3.22Å; L445-M449 WeakPolarHBondContact O-CG 3.23Å; L445-M449 PolarHBondContact O-N 2.87Å; I447-M449 PolarHBondContact O-N 3.25Å; M449-A452 PolarHBondContact O-N 2.85Å; M449-E453 WeakPolarHBondContact O-CB 3.47Å; M449-E453 PolarHBondContact O-N 2.86Å; M449-L459 HydrophobicContact CE-CB 4.4Å; M449-H460 WeakPolarHBondContact CB-NE2 3.48Å; M449-I463 HydrophobicContact CE-CD1 3.61Å; M449-I463 HydrophobicContact SD-CD1 4.04Å; M449-F464 HydrophobicContact CE-CE2 4.22Å
450	A	95.9	Very high	94.4	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-43.4	176	0	0	0	0	0	111.8	L228 N446 I447 E453 K454	L228-A450 VanDerWaalsContact O-CB 3.32Å; L228-A450 WeakPolarHBondContact O-CB 3.42Å; N446-A450 WeakPolarHBondContact O-CB 3.27Å; N446-A450 PolarHBondContact O-N 3Å; I447-A450 PolarHBondContact O-N 3.37Å; A450-E453 PolarHBondContact O-N 3.32Å; A450-K454 WeakPolarHBondContact O-CG 3.2Å; A450-K454 PolarHBondContact O-N 3.42Å; A450-K454 VanDerWaalsContact O-N 3.17Å
451	L	97	Very high	94.1	Very high	11 Å²	11	24.3 Å²	24.3	6%	0.058	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-40.8	173.4	-68.8	175.1	0	0	0	112	L405 A409 I447 I448 E453 K454 I455	L405-L451 HydrophobicContact CB-CD1 3.66Å; L405-L451 HydrophobicContact CD1-CD1 4.27Å; A409-L451 HydrophobicContact CB-CB 3.88Å; I447-L451 HydrophobicContact CG2-CD1 4.42Å; I447-L451 WeakPolarHBondContact O-CG 3.37Å; I447-L451 PolarHBondContact O-N 2.98Å; I447-L451 VanDerWaalsContact O-N 3.09Å; I448-L451 PolarHBondContact O-N 2.76Å; L451-E453 VanDerWaalsContact C-N 3.34Å; L451-E453 PolarHBondContact O-N 3.38Å; L451-K454 HydrophobicContact CD2-CD 4.45Å; L451-K454 PolarHBondContact O-N 2.89Å; L451-I455 WeakPolarHBondContact O-CG1 3.31Å; L451-I455 PolarHBondContact O-N 3Å
452	A	97.1	Very high	93.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-39.5	176.7	0	0	0	0	0	112.1	A409 L412 I413 I448 M449 I455 K456 L459	A409-A452 HydrophobicContact CB-CB 4.35Å; L412-A452 HydrophobicContact CD2-CB 3.79Å; I413-A452 HydrophobicContact CD1-CB 4.14Å; I413-A452 HydrophobicContact CG1-CB 3.83Å; I448-A452 WeakPolarHBondContact O-CB 3.41Å; I448-A452 PolarHBondContact O-N 3.29Å; M449-A452 PolarHBondContact O-N 2.85Å; A452-I455 PolarHBondContact O-N 2.79Å; A452-K456 PolarHBondContact O-N 3.5Å; A452-L459 HydrophobicContact CB-CD1 4.02Å
453	E	95.5	Very high	93.5	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.019	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-40.2	175.9	-172	63.8	-159.9	0	0	112.4	M449 A450 L451 I455 K456 P457 G458 L459 H460	M449-E453 WeakPolarHBondContact O-CB 3.47Å; M449-E453 PolarHBondContact O-N 2.86Å; A450-E453 PolarHBondContact O-N 3.32Å; L451-E453 VanDerWaalsContact C-N 3.34Å; L451-E453 PolarHBondContact O-N 3.38Å; E453-I455 VanDerWaalsContact C-N 3.32Å; E453-I455 PolarHBondContact O-N 2.83Å; E453-K456 CarbonylContact O-C 3.51Å; E453-K456 PolarHBondContact O-N 3.48Å; E453-P457 VanDerWaalsContact O-CA 3.26Å; E453-P457 WeakPolarHBondContact O-CA 3.31Å; E453-P457 VanDerWaalsContact O-N 3.08Å; E453-G458 PolarHBondContact OE1-N 3.24Å; E453-L459 WeakPolarHBondContact OE2-CA 3.31Å; E453-L459 PolarHBondContact OE2-N 2.88Å; E453-H460 IonicContact OE2-CD2 2.75Å; E453-H460 PolarHBondContact OE2-N 3.39Å
454	K	94	Very high	93.1	Very high	36 Å²	36	27.9 Å²	27.9	16%	0.157	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-40.4	175.7	-67.7	171.6	72.3	-178.4	0	112	C231 E259 A450 L451	C231-K454 HydrophobicContact CB-CD 4.11Å; C231-K454 HydrophobicContact CB-CG 3.98Å; C231-K454 VanDerWaalsContact O-CD 3.3Å; C231-K454 WeakPolarHBondContact O-CD 3.15Å; C231-K454 WeakPolarHBondContact O-CE 3.49Å; E259-K454 WeakPolarHBondContact OE1-CE 3.45Å; E259-K454 IonicContact OE1-NZ 3.03Å; E259-K454 PolarHBondContact OE1-NZ 3.4Å; E259-K454 IonicContact OE2-NZ 3.95Å; E259-K454 PolarHBondContact OE2-NZ 2.96Å; A450-K454 WeakPolarHBondContact O-CG 3.2Å; A450-K454 PolarHBondContact O-N 3.42Å; A450-K454 VanDerWaalsContact O-N 3.17Å; L451-K454 HydrophobicContact CD2-CD 4.45Å; L451-K454 PolarHBondContact O-N 2.89Å
455	I	94.4	Very high	92.1	Very high	90 Å²	90	29.2 Å²	29.2	46%	0.462	17%	0.169	S	C	.	.	H	α-helix	trans	-75.1	-41.5	-179.8	-62.8	165.8	0	0	0	110.7	A409 I413 L451 A452 E453	A409-I455 HydrophobicContact CB-CD1 4.32Å; I413-I455 HydrophobicContact CD1-CB 4.04Å; I413-I455 HydrophobicContact CD1-CG2 3.89Å; L451-I455 WeakPolarHBondContact O-CG1 3.31Å; L451-I455 PolarHBondContact O-N 3Å; A452-I455 PolarHBondContact O-N 2.79Å; E453-I455 VanDerWaalsContact C-N 3.32Å; E453-I455 PolarHBondContact O-N 2.83Å
456	K	94.6	Very high	90.7	Very high	75 Å²	75	39 Å²	39	33%	0.326	21%	0.206	S	C	.	.	S	Bend	trans	-136	91.9	-178.8	-172	179.2	-178.2	-176.2	0	110.1	I413 E417 A452 E453 L459	I413-K456 HydrophobicContact CD1-CB 4.19Å; I413-K456 HydrophobicContact CG2-CD 3.87Å; E417-K456 IonicContact OE1-NZ 3.71Å; E417-K456 PolarHBondContact OE1-NZ 2.87Å; A452-K456 PolarHBondContact O-N 3.5Å; E453-K456 CarbonylContact O-C 3.51Å; E453-K456 PolarHBondContact O-N 3.48Å; K456-L459 HydrophobicContact CB-CD1 3.95Å; K456-L459 HydrophobicContact CB-CG 4.48Å; K456-L459 HydrophobicContact CD-CD1 4.37Å; K456-L459 HydrophobicContact CD-CD2 4.46Å; K456-L459 HydrophobicContact CD-CG 4.48Å; K456-L459 HydrophobicContact CG-CD1 4.37Å; K456-L459 HydrophobicContact CG-CG 4.44Å; K456-L459 WeakPolarHBondContact O-CD1 3.41Å; K456-L459 WeakPolarHBondContact O-CG 3.43Å
457	P	92.1	Very high	88.8	Confident	83 Å²	83	42.5 Å²	42.5	54%	0.539	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	146	-179.4	-25.2	34.7	0	0	0	113.2	E453	E453-P457 VanDerWaalsContact O-CA 3.26Å; E453-P457 WeakPolarHBondContact O-CA 3.31Å; E453-P457 VanDerWaalsContact O-N 3.08Å
458	G	89.3	Confident	86.6	Confident	36 Å²	36	45.3 Å²	45.3	37%	0.371	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.4	-2.6	177.7	0	0	0	0	0	115.2	E453 F462	E453-G458 PolarHBondContact OE1-N 3.24Å; G458-F462 VanDerWaalsContact O-CB 3.26Å; G458-F462 WeakPolarHBondContact O-CB 3.31Å; G458-F462 PolarHBondContact O-N 3.2Å
459	L	90.7	Very high	84.2	Confident	9 Å²	9	54.9 Å²	54.9	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-46.5	-179.4	-75.2	171.7	0	0	0	112.1	I413 I416 M449 A452 E453 K456 S461 F462 I463	I413-L459 HydrophobicContact CD1-CD1 4.5Å; I413-L459 HydrophobicContact CG1-CD1 3.78Å; I416-L459 HydrophobicContact CD1-CD2 4.39Å; I416-L459 HydrophobicContact CG2-CD2 4.31Å; M449-L459 HydrophobicContact CE-CB 4.4Å; A452-L459 HydrophobicContact CB-CD1 4.02Å; E453-L459 WeakPolarHBondContact OE2-CA 3.31Å; E453-L459 PolarHBondContact OE2-N 2.88Å; K456-L459 HydrophobicContact CB-CD1 3.95Å; K456-L459 HydrophobicContact CB-CG 4.48Å; K456-L459 HydrophobicContact CD-CD1 4.37Å; K456-L459 HydrophobicContact CD-CD2 4.46Å; K456-L459 HydrophobicContact CD-CG 4.48Å; K456-L459 HydrophobicContact CG-CD1 4.37Å; K456-L459 HydrophobicContact CG-CG 4.44Å; K456-L459 WeakPolarHBondContact O-CD1 3.41Å; K456-L459 WeakPolarHBondContact O-CG 3.43Å; L459-S461 VanDerWaalsContact C-N 3.3Å; L459-S461 PolarHBondContact O-N 3.35Å; L459-F462 PolarHBondContact O-N 2.72Å; L459-F462 VanDerWaalsContact O-N 3.13Å; L459-I463 WeakPolarHBondContact O-CG1 3.32Å; L459-I463 PolarHBondContact O-N 3.38Å
460	H	88.6	Confident	81.7	Confident	5 Å²	5	58.1 Å²	58.1	2%	0.023	30%	0.299	C	S	.	.	H	α-helix	trans	-57.4	-45.2	177.3	-105	-88.5	0	0	0	111.4	H322 M449 E453 F462 I463 F464	H322-H460 HydrophobicContact CB-CB 4.03Å; H322-H460 AromaticContact ND1-ND1 3.76Å; M449-H460 WeakPolarHBondContact CB-NE2 3.48Å; E453-H460 IonicContact OE2-CD2 2.75Å; E453-H460 PolarHBondContact OE2-N 3.39Å; H460-F462 VanDerWaalsContact C-N 3.35Å; H460-I463 PolarHBondContact O-N 3.18Å; H460-F464 AromaticContact ND1-CD2 3.88Å; H460-F464 WeakPolarHBondContact O-CB 3.29Å; H460-F464 PolarHBondContact O-N 3.25Å
461	S	87.3	Confident	79.3	Confident	48 Å²	48	60.5 Å²	60.5	34%	0.336	32%	0.315	S	S	.	.	H	α-helix	trans	-68.7	-33.3	177.7	-65.3	0	0	0	0	112.4	L459 G465	L459-S461 VanDerWaalsContact C-N 3.3Å; L459-S461 PolarHBondContact O-N 3.35Å; S461-G465 WeakPolarHBondContact O-CA 3.4Å; S461-G465 PolarHBondContact O-N 3.21Å
462	F	88.7	Confident	76.6	Confident	75 Å²	75	65.2 Å²	65.2	33%	0.329	35%	0.345	S	S	.	.	H	α-helix	trans	-69.8	-35	177.5	177	-107.1	0	0	0	113	I416 T420 K425 F427 G458 L459 H460	I416-F462 HydrophobicContact CG2-CD1 4.32Å; I416-F462 HydrophobicContact CG2-CE1 4.08Å; T420-F462 HydrophobicContact CG2-CE1 3.65Å; T420-F462 HydrophobicContact CG2-CZ 3.8Å; K425-F462 WeakPolarHBondContact O-CZ 3.16Å; F427-F462 HydrophobicContact CB-CD1 4.32Å; F427-F462 HydrophobicContact CB-CE1 3.77Å; F427-F462 HydrophobicContact CB-CZ 4.45Å; G458-F462 VanDerWaalsContact O-CB 3.26Å; G458-F462 WeakPolarHBondContact O-CB 3.31Å; G458-F462 PolarHBondContact O-N 3.2Å; L459-F462 PolarHBondContact O-N 2.72Å; L459-F462 VanDerWaalsContact O-N 3.13Å; H460-F462 VanDerWaalsContact C-N 3.35Å
463	I	87.4	Confident	73.9	Confident	30 Å²	30	72.8 Å²	72.8	15%	0.154	38%	0.38	C	S	.	.	H	α-helix	trans	-88.3	-45.8	-177.5	-61.5	168.9	0	0	0	111.8	I416 F427 M449 L459 H460	I416-I463 HydrophobicContact CD1-CD1 3.49Å; I416-I463 VanDerWaalsContact CD1-CD1 3.49Å; I416-I463 HydrophobicContact CG1-CD1 4.33Å; F427-I463 HydrophobicContact CD1-CB 4.44Å; F427-I463 HydrophobicContact CD1-CG1 4.02Å; F427-I463 HydrophobicContact CD1-CG2 3.87Å; F427-I463 HydrophobicContact CE1-CG2 4.22Å; F427-I463 HydrophobicContact CG-CG1 4.42Å; M449-I463 HydrophobicContact CE-CD1 3.61Å; M449-I463 HydrophobicContact SD-CD1 4.04Å; L459-I463 WeakPolarHBondContact O-CG1 3.32Å; L459-I463 PolarHBondContact O-N 3.38Å; H460-I463 PolarHBondContact O-N 3.18Å
464	F	85.8	Confident	71.5	Confident	55 Å²	55	76 Å²	76	24%	0.241	40%	0.395	C	S	.	.	H	α-helix	trans	-113.4	-12.2	-170.2	-56	-70.5	0	0	0	113.6	L430 M449 H460	L430-F464 HydrophobicContact CD1-CZ 4.28Å; L430-F464 HydrophobicContact CD2-CE1 3.76Å; L430-F464 HydrophobicContact CD2-CZ 4.31Å; M449-F464 HydrophobicContact CE-CE2 4.22Å; H460-F464 AromaticContact ND1-CD2 3.88Å; H460-F464 WeakPolarHBondContact O-CB 3.29Å; H460-F464 PolarHBondContact O-N 3.25Å
465	G	75.3	Confident	69.1	Low	35 Å²	35	81.6 Å²	81.6	36%	0.361	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-66	142.4	-173.2	0	0	0	0	0	113	S461	S461-G465 WeakPolarHBondContact O-CA 3.4Å; S461-G465 PolarHBondContact O-N 3.21Å
466	R	65.4	Low	66.6	Low	206 Å²	206	81.6 Å²	81.6	78%	0.777	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-82	142.4	167.9	-62.8	-175.9	-175.9	-174	3.2	109.6	F468	R466-F468 PolarHBondContact O-N 3.12Å
467	P	54.8	Low	64.6	Low	91 Å²	91	82 Å²	82	59%	0.591	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-60.5	132.3	173.2	23.3	-30.9	0	0	0	110.4	Y469	P467-Y469 HydrophobicContact CB-CE2 4.36Å; P467-Y469 HydrophobicContact CG-CE2 4.16Å
468	F	51.3	Low	62.4	Low	60 Å²	60	81.9 Å²	81.9	26%	0.263	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-88.4	119.1	174	-124.2	-79.1	0	0	0	108.5	Y326 R329 R466	Y326-F468 AromaticContact CD2-CD2 3.43Å; Y326-F468 HydrophobicContact CD2-CD2 3.43Å; Y326-F468 VanDerWaalsContact CD2-CD2 3.43Å; Y326-F468 AromaticContact CD2-CE2 3.08Å; Y326-F468 HydrophobicContact CD2-CE2 3.08Å; Y326-F468 HydrophobicContact CD2-CZ 4.03Å; Y326-F468 AromaticContact CE2-CD2 3.41Å; Y326-F468 HydrophobicContact CE2-CD2 3.41Å; Y326-F468 VanDerWaalsContact CE2-CD2 3.41Å; Y326-F468 AromaticContact CE2-CE2 3.16Å; Y326-F468 HydrophobicContact CE2-CE2 3.16Å; Y326-F468 HydrophobicContact CE2-CG 4.22Å; Y326-F468 AromaticContact CE2-CZ 3.77Å; Y326-F468 HydrophobicContact CE2-CZ 3.77Å; Y326-F468 AromaticContact CG-CE2 3.84Å; Y326-F468 HydrophobicContact CG-CE2 3.84Å; Y326-F468 AromaticContact CZ-CE2 3.99Å; R329-F468 HydrophobicContact CB-CE2 4.5Å; R329-F468 HydrophobicContact CB-CZ 4.43Å; R329-F468 HydrophobicContact CG-CZ 4.3Å; R466-F468 PolarHBondContact O-N 3.12Å
469	Y	48.3	Very low	60.2	Low	201 Å²	201	84.4 Å²	84.4	79%	0.788	42%	0.417	S	S	*	.			trans	-95.2	107.5	169.6	-62.7	-80.8	0	0	0	108.4	P467	P467-Y469 HydrophobicContact CB-CE2 4.36Å; P467-Y469 HydrophobicContact CG-CE2 4.16Å
470	T	43.5	Very low	58.1	Low	69 Å²	69	87.3 Å²	87.3	42%	0.423	44%	0.436	S	S	.	.			trans	-93.1	126.5	169.2	20.1	0	0	0	0	108.7
471	S	44.9	Very low	56	Low	51 Å²	51	88.8 Å²	88.8	36%	0.357	44%	0.442	S	S	.	.			trans	-69.7	158.8	169.3	77.1	0	0	0	0	110.3	Q473 E474 R475	S471-Q473 PolarHBondContact O-N 3.43Å; S471-E474 VanDerWaalsContact CB-OE2 3.29Å; S471-E474 WeakPolarHBondContact CB-OE2 3.5Å; S471-E474 PolarHBondContact N-OE2 2.9Å; S471-E474 PolarHBondContact O-N 2.9Å; S471-E474 WeakPolarHBondContact OG-CG 3.38Å; S471-E474 PolarHBondContact OG-OE2 3.37Å; S471-R475 PolarHBondContact O-N 2.95Å
472	V	40.3	Very low	54.4	Low	111 Å²	111	90.9 Å²	90.9	67%	0.673	45%	0.448	S	S	*	.	H	α-helix	trans	-61.5	-46	-175	179.4	0	0	0	0	111.6	E474 R475 D476	V472-E474 PolarHBondContact O-N 3.43Å; V472-R475 PolarHBondContact O-N 3.18Å; V472-D476 VanDerWaalsContact O-CG 3.26Å; V472-D476 PolarHBondContact O-N 2.98Å
473	Q	40.7	Very low	52.6	Low	159 Å²	159	91.7 Å²	91.7	74%	0.743	45%	0.454	S	S	*	.	H	α-helix	trans	-59.6	-33.4	177	-81.9	177.6	-24.5	0	0	113.2	S471 M477	S471-Q473 PolarHBondContact O-N 3.43Å; Q473-M477 PolarHBondContact O-N 3.48Å
474	E	44.5	Very low	50.6	Low	71 Å²	71	95.1 Å²	95.1	33%	0.332	47%	0.471	S	S	.	.	H	α-helix	trans	-85.4	-29.7	-176.6	-62.7	167.6	134.6	0	0	112.1	R333 S471 V472 D476 M477 L478	R333-E474 IonicContact CZ-OE1 2.75Å; R333-E474 IonicContact CZ-OE2 2.86Å; R333-E474 IonicContact NH2-OE1 2.71Å; R333-E474 PolarHBondContact NH2-OE1 3.06Å; R333-E474 IonicContact NH2-OE2 3.57Å; R333-E474 PolarHBondContact NH2-OE2 3.5Å; S471-E474 VanDerWaalsContact CB-OE2 3.29Å; S471-E474 WeakPolarHBondContact CB-OE2 3.5Å; S471-E474 PolarHBondContact N-OE2 2.9Å; S471-E474 PolarHBondContact O-N 2.9Å; S471-E474 WeakPolarHBondContact OG-CG 3.38Å; S471-E474 PolarHBondContact OG-OE2 3.37Å; V472-E474 PolarHBondContact O-N 3.43Å; E474-D476 VanDerWaalsContact C-N 3.32Å; E474-M477 PolarHBondContact O-N 3.04Å; E474-L478 PolarHBondContact O-N 3.04Å
475	R	43.8	Very low	48.6	Very low	154 Å²	154	97.5 Å²	97.5	58%	0.581	48%	0.484	S	S	*	.	H	α-helix	trans	-63.1	-43	167.1	-177.9	-179.9	179	164.1	-1	110.1	S471 V472 M477 L478 M479	S471-R475 PolarHBondContact O-N 2.95Å; V472-R475 PolarHBondContact O-N 3.18Å; R475-M477 VanDerWaalsContact C-N 3.33Å; R475-M477 PolarHBondContact O-N 2.77Å; R475-L478 PolarHBondContact O-N 3.06Å; R475-M479 HydrophobicContact CG-CG 4.19Å; R475-M479 WeakPolarHBondContact O-CB 3.5Å; R475-M479 WeakPolarHBondContact O-CG 3.02Å; R475-M479 PolarHBondContact O-N 3.02Å
476	D	42.3	Very low	46.9	Very low	89 Å²	89	101.4 Å²	101.4	48%	0.476	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-37.8	178.5	-66.1	-20	0	0	0	111.5	V472 E474 M479 T480	V472-D476 VanDerWaalsContact O-CG 3.26Å; V472-D476 PolarHBondContact O-N 2.98Å; E474-D476 VanDerWaalsContact C-N 3.32Å; D476-M479 PolarHBondContact O-N 3.03Å; D476-T480 VanDerWaalsContact O-CB 3.3Å; D476-T480 WeakPolarHBondContact O-CB 3.48Å; D476-T480 PolarHBondContact O-N 2.84Å; D476-T480 PolarHBondContact O-OG1 3.38Å
477	M	51.4	Low	45.7	Very low	85 Å²	85	94.4 Å²	94.4	42%	0.419	47%	0.473	S	S	.	.	H	α-helix	trans	-63.1	-47.8	172.3	-75.2	-172.5	-167.9	0	0	113.2	Q473 E474 R475 M479 T480 F481	Q473-M477 PolarHBondContact O-N 3.48Å; E474-M477 PolarHBondContact O-N 3.04Å; R475-M477 VanDerWaalsContact C-N 3.33Å; R475-M477 PolarHBondContact O-N 2.77Å; M477-M479 VanDerWaalsContact C-N 3.3Å; M477-M479 PolarHBondContact O-N 3.21Å; M477-T480 PolarHBondContact O-N 3.1Å; M477-F481 WeakPolarHBondContact O-CD2 3.33Å; M477-F481 PolarHBondContact O-N 3.46Å
478	L	46.3	Very low	45	Very low	80 Å²	80	94.6 Å²	94.6	42%	0.419	46%	0.464	S	S	.	.	H	α-helix	trans	-68.6	-28.2	180	-71.7	170.3	0	0	0	113.2	E474 R475 T480	E474-L478 PolarHBondContact O-N 3.04Å; R475-L478 PolarHBondContact O-N 3.06Å; L478-T480 VanDerWaalsContact C-N 3.28Å
479	M	43.8	Very low	44.6	Very low	88 Å²	88	97.3 Å²	97.3	43%	0.433	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-7.2	172	-61	-71.9	-78.9	0	0	111.7	S77 G78 R475 D476 M477	S77-M479 CarbonylContact C-O 3.34Å; S77-M479 WeakPolarHBondContact CB-O 3.25Å; S77-M479 PolarHBondContact OG-O 3.11Å; G78-M479 PolarHBondContact N-O 3.43Å; R475-M479 HydrophobicContact CG-CG 4.19Å; R475-M479 WeakPolarHBondContact O-CB 3.5Å; R475-M479 WeakPolarHBondContact O-CG 3.02Å; R475-M479 PolarHBondContact O-N 3.02Å; D476-M479 PolarHBondContact O-N 3.03Å; M477-M479 VanDerWaalsContact C-N 3.3Å; M477-M479 PolarHBondContact O-N 3.21Å
480	T	46.3	Very low	44.2	Very low	70 Å²	70	88.7 Å²	88.7	43%	0.429	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-21.8	174.9	-58.3	0	0	0	0	112	D476 M477 L478	D476-T480 VanDerWaalsContact O-CB 3.3Å; D476-T480 WeakPolarHBondContact O-CB 3.48Å; D476-T480 PolarHBondContact O-N 2.84Å; D476-T480 PolarHBondContact O-OG1 3.38Å; M477-T480 PolarHBondContact O-N 3.1Å; L478-T480 VanDerWaalsContact C-N 3.28Å
481	F	43.2	Very low	44.3	Very low	37 Å²	37	90.5 Å²	90.5	16%	0.162	46%	0.457	C	S	.	.			trans	-126.5	0	-170	-60.6	-64.2	0	0	0	116.4	R143 I144 W340 M477	R143-F481 VanDerWaalsContact CD-OXT 3.23Å; R143-F481 WeakPolarHBondContact CD-OXT 3.38Å; R143-F481 PolarHBondContact NH1-OXT 3.12Å; I144-F481 HydrophobicContact CG1-CD1 4.25Å; I144-F481 HydrophobicContact CG1-CG 4.39Å; W340-F481 HydrophobicContact CE3-CE2 4.15Å; W340-F481 AromaticContact CE3-CZ 3.84Å; W340-F481 HydrophobicContact CE3-CZ 3.84Å; W340-F481 HydrophobicContact CH2-CE2 4.4Å; W340-F481 AromaticContact CH2-CZ 3.69Å; W340-F481 HydrophobicContact CH2-CZ 3.69Å; W340-F481 AromaticContact CZ3-CE1 3.88Å; W340-F481 HydrophobicContact CZ3-CE1 3.88Å; W340-F481 AromaticContact CZ3-CE2 3.97Å; W340-F481 HydrophobicContact CZ3-CE2 3.97Å; W340-F481 AromaticContact CZ3-CZ 3.24Å; W340-F481 HydrophobicContact CZ3-CZ 3.24Å; M477-F481 WeakPolarHBondContact O-CD2 3.33Å; M477-F481 PolarHBondContact O-N 3.46Å

Retrieved 481 of 481 residues in 308.3 ms (Link to these results)

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