A0A087X140_HUMAN Loading...

Zn regulated GTPase metalloprotein activator 1A

AlphaFold DB , UniProt , Accession A0A087X140, Species HUMAN (Homo sapiens, Human), Gene ZNG1A, Length 347 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	35.5	Very low	32.6	Very low	248 Å²	248	146.9 Å²	146.9	100%	1.222	87%	0.869	S	S	*	*				0	105.3	0	-86.2	173.1	167.7	0	0	107.4
2	L	33.6	Very low	32.9	Very low	174 Å²	174	150.3 Å²	150.3	91%	0.911	87%	0.869	S	S	*	*			trans	-136.9	126	173.1	-81.2	161.8	0	0	0	105.6
3	P	33.9	Very low	33	Very low	119 Å²	119	151.2 Å²	151.2	77%	0.773	87%	0.869	S	S	*	*			trans	-110.7	135	152.6	31.5	-18.5	0	0	0	108.6
4	A	30.4	Very low	33.4	Very low	93 Å²	93	149.1 Å²	149.1	77%	0.769	86%	0.864	S	S	*	*				79.8	92.7	53.3	0	0	0	0	0	114.1
5	V	33.4	Very low	33.8	Very low	159 Å²	159	144.7 Å²	144.7	96%	0.964	85%	0.852	S	S	*	*			trans	34.5	127.4	138.9	-170.3	0	0	0	0	120.8
6	G	29.6	Very low	34.5	Very low	62 Å²	62	148.2 Å²	148.2	64%	0.639	86%	0.857	S	S	*	*			trans	140.8	149.2	132.3	0	0	0	0	0	118.4
7	S	29.3	Very low	35	Very low	122 Å²	122	148.4 Å²	148.4	85%	0.853	85%	0.848	S	S	*	*			trans	80.5	109.6	171.7	71.2	0	0	0	0	115.6
8	A	32.3	Very low	35.6	Very low	92 Å²	92	148.9 Å²	148.9	76%	0.76	85%	0.848	S	S	*	*				116.1	98.3	55.9	0	0	0	0	0	105.8	E10	A8-E10 PolarHBondContact O-N 3.34Å
9	D	30.6	Very low	35.6	Very low	166 Å²	166	147.2 Å²	147.2	89%	0.888	85%	0.845	S	S	*	*			trans	-69.9	118.2	171.4	-68.5	-51.8	0	0	0	108.3	E11	D9-E11 PolarHBondContact O-N 2.81Å
10	E	33.5	Very low	36	Very low	192 Å²	192	145.9 Å²	145.9	90%	0.897	84%	0.842	S	S	*	*			trans	-76.3	102.9	165.7	-69.7	179.4	163.4	0	0	107.2	A8	A8-E10 PolarHBondContact O-N 3.34Å
11	E	36.3	Very low	36.1	Very low	189 Å²	189	148 Å²	148	88%	0.883	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-77.6	117.6	164.6	-76.4	-174.1	162.2	0	0	108.5	D9	D9-E11 PolarHBondContact O-N 2.81Å
12	E	36.1	Very low	36.2	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-66.7	126.1	174.5	-67.6	178.9	152.6	0	0	110.9
13	D	34.1	Very low	36.5	Very low	162 Å²	162	140.4 Å²	140.4	87%	0.866	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-61.1	124.7	169	-104.5	-38.8	0	0	0	110.6	A15	D13-A15 PolarHBondContact O-N 2.82Å
14	P	38.9	Very low	36.3	Very low	123 Å²	123	140.1 Å²	140.1	80%	0.799	81%	0.811	S	S	*	*			trans	-79.6	106.8	172.4	29.4	-28.4	0	0	0	110.4
15	A	39.3	Very low	36.6	Very low	82 Å²	82	143.1 Å²	143.1	68%	0.678	81%	0.813	S	S	*	*			trans	30.7	114.7	149.4	0	0	0	0	0	118.2	D13 E17	D13-A15 PolarHBondContact O-N 2.82Å; A15-E17 PolarHBondContact O-N 2.81Å
16	E	45.8	Very low	36.4	Very low	201 Å²	201	144.2 Å²	144.2	94%	0.939	81%	0.807	S	S	*	*			trans	-51.1	104.3	156.2	-65	-176.1	155.7	0	0	109.4	D18	E16-D18 PolarHBondContact O-N 2.98Å
17	E	42.8	Very low	36.4	Very low	151 Å²	151	146.9 Å²	146.9	71%	0.706	81%	0.811	S	S	*	*			trans	-71.4	107.1	172	-75.4	-179.9	140.5	0	0	108.4	A15 K172	A15-E17 PolarHBondContact O-N 2.81Å; E17-K172 IonicContact OE2-NZ 3.76Å; E17-K172 PolarHBondContact OE2-NZ 2.99Å
18	D	45.2	Very low	36.5	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-53.8	133.9	177	-123	-22.7	0	0	0	111.1	E16	E16-D18 PolarHBondContact O-N 2.98Å
19	C	36.4	Very low	36.5	Very low	116 Å²	116	151.5 Å²	151.5	78%	0.784	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.7	131.1	175.9	-74.4	0	0	0	0	109.8	E21	C19-E21 PolarHBondContact O-N 3.34Å
20	P	43.9	Very low	36.7	Very low	120 Å²	120	148.3 Å²	148.3	78%	0.779	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-65	132.8	179.2	25	-32.2	0	0	0	110.8	L22	P20-L22 PolarHBondContact O-N 2.95Å
21	E	36.4	Very low	36.6	Very low	191 Å²	191	148.1 Å²	148.1	89%	0.893	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.8	128.2	176.8	-150.8	174	-164.4	0	0	109.8	C19 V23	C19-E21 PolarHBondContact O-N 3.34Å; E21-V23 PolarHBondContact O-N 3Å
22	L	38	Very low	36.5	Very low	134 Å²	134	147.8 Å²	147.8	70%	0.702	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-64.4	123.2	-176.9	-67.8	172.9	0	0	0	110.3	P20 P24	P20-L22 PolarHBondContact O-N 2.95Å; L22-P24 WeakPolarHBondContact O-CD 3.35Å
23	V	39.9	Very low	36.4	Very low	129 Å²	129	147.5 Å²	147.5	78%	0.782	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.3	120.3	175.6	-175.2	0	0	0	0	108.8	E21 I25	E21-V23 PolarHBondContact O-N 3Å; V23-I25 PolarHBondContact O-N 3.32Å
24	P	30.3	Very low	36.5	Very low	113 Å²	113	147.8 Å²	147.8	73%	0.734	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.3	121.1	174.1	25.1	-29.9	0	0	0	109	L22 E26	L22-P24 WeakPolarHBondContact O-CD 3.35Å; P24-E26 PolarHBondContact O-N 3.39Å
25	I	36.2	Very low	36.2	Very low	155 Å²	155	151.7 Å²	151.7	80%	0.795	80%	0.801	S	S	*	*			trans	-75.2	114.5	168.2	-60.4	171.3	0	0	0	106.1	V23 T27	V23-I25 PolarHBondContact O-N 3.32Å; I25-T27 PolarHBondContact O-N 3.16Å
26	E	30.3	Very low	36.5	Very low	183 Å²	183	153.2 Å²	153.2	86%	0.855	81%	0.806	S	S	*	*			trans	-58	109.2	170.1	-71.9	-175	169.7	0	0	108.5	P24 T28	P24-E26 PolarHBondContact O-N 3.39Å; E26-T28 PolarHBondContact O-N 3.22Å
27	T	29.1	Very low	36	Very low	118 Å²	118	145.8 Å²	145.8	72%	0.724	78%	0.783	S	S	*	*			trans	-65.5	100.8	169.1	34.7	0	0	0	0	107.4	I25 Q29	I25-T27 PolarHBondContact O-N 3.16Å; T27-Q29 PolarHBondContact O-N 3.29Å
28	T	30.4	Very low	35.9	Very low	134 Å²	134	147.8 Å²	147.8	82%	0.822	80%	0.798	S	S	*	*			trans	-57.4	99.4	156.5	35.6	0	0	0	0	106.6	E26 S30	E26-T28 PolarHBondContact O-N 3.22Å; T28-S30 PolarHBondContact O-N 3.47Å
29	Q	34	Very low	36.2	Very low	177 Å²	177	143.6 Å²	143.6	83%	0.827	79%	0.793	S	S	*	*			trans	-62.2	84.7	167.6	-69.3	175.4	-18.9	0	0	107.1	T27 E31	T27-Q29 PolarHBondContact O-N 3.29Å; Q29-E31 PolarHBondContact O-N 3.37Å
30	S	32.8	Very low	37.7	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	78%	0.783	S	S	*	*			trans	-72.6	107.2	151.3	49.7	0	0	0	0	105.7	T28 E32	T28-S30 PolarHBondContact O-N 3.47Å; S30-E32 VanDerWaalsContact C-N 3.27Å; S30-E32 PolarHBondContact O-N 3.27Å
31	E	33	Very low	39.5	Very low	187 Å²	187	140.6 Å²	140.6	87%	0.874	77%	0.767	S	S	*	*			trans	-51.6	89.1	169.4	-63.9	170.8	162.5	0	0	109.8	Q29	Q29-E31 PolarHBondContact O-N 3.37Å
32	E	32.8	Very low	41.9	Very low	182 Å²	182	132.1 Å²	132.1	85%	0.85	73%	0.728	S	S	*	*			trans	-125	61.5	158.2	-72.4	-170.2	172.5	0	0	107.1	S30	S30-E32 VanDerWaalsContact C-N 3.27Å; S30-E32 PolarHBondContact O-N 3.27Å
33	E	34.5	Very low	44.2	Very low	182 Å²	182	126.6 Å²	126.6	85%	0.85	70%	0.7	S	S	*	*			trans	-71.9	137.3	161.4	-83	-172.8	159.8	0	0	109.8
34	E	36.1	Very low	46.3	Very low	168 Å²	168	120.4 Å²	120.4	79%	0.785	66%	0.662	S	S	*	*			trans	70.8	80.1	162.4	-60.8	-167.2	155.1	0	0	118.8
35	K	33.5	Very low	48.8	Very low	205 Å²	205	115.2 Å²	115.2	89%	0.891	63%	0.629	S	S	*	*				-121.9	76.2	128.7	-81.3	-171.8	179.3	174.6	0	110.9	G37	K35-G37 PolarHBondContact O-N 3.4Å
36	S	45.1	Very low	51.1	Low	114 Å²	114	107.9 Å²	107.9	80%	0.797	59%	0.591	S	S	*	*			trans	-65.6	81.6	151	48.7	0	0	0	0	108.5
37	G	35	Very low	53.6	Low	44 Å²	44	99.2 Å²	99.2	45%	0.454	55%	0.551	S	S	.	*			trans	-124.2	121.3	177.7	0	0	0	0	0	110.2	K35 G39 A40	K35-G37 PolarHBondContact O-N 3.4Å; G37-G39 PolarHBondContact O-N 2.9Å; G37-A40 PolarHBondContact O-N 3.48Å
38	L	41.8	Very low	56.1	Low	193 Å²	193	93.6 Å²	93.6	100%	1.01	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.4	105.4	165.3	-84	75.6	0	0	0	109.3
39	G	49.9	Very low	58	Low	72 Å²	72	87.2 Å²	87.2	74%	0.742	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	133.8	-1.9	-175.8	0	0	0	0	0	116.1	G37 K41	G37-G39 PolarHBondContact O-N 2.9Å; G39-K41 PolarHBondContact O-N 3.16Å
40	A	69.3	Low	59.6	Low	71 Å²	71	79 Å²	79	59%	0.587	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-69.3	123.9	173.3	0	0	0	0	0	111	G37	G37-A40 PolarHBondContact O-N 3.48Å
41	K	81.9	Confident	61.3	Low	102 Å²	102	78.5 Å²	78.5	44%	0.443	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-68.2	144.5	175.5	-61.7	-171.8	-178.7	-172	0	110.5	G39 G157 S158 D159 Y161	G39-K41 PolarHBondContact O-N 3.16Å; K41-G157 WeakPolarHBondContact CE-O 3.49Å; K41-G157 PolarHBondContact NZ-O 2.86Å; K41-S158 WeakPolarHBondContact CE-O 3.33Å; K41-D159 CarbonylContact C-O 3.57Å; K41-D159 VanDerWaalsContact CA-O 3.26Å; K41-D159 WeakPolarHBondContact CA-O 3.38Å; K41-Y161 HydrophobicContact CB-CD1 3.59Å; K41-Y161 HydrophobicContact CB-CE1 4.15Å
42	I	86.3	Confident	62.8	Low	13 Å²	13	72.4 Å²	72.4	7%	0.067	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.8	178.3	-55.6	179.2	0	0	0	109.3	M124 K127 F130 I133 D159 I160 Y161	I42-M124 HydrophobicContact CD1-CE 4.26Å; I42-M124 HydrophobicContact CD1-SD 4.22Å; I42-K127 HydrophobicContact CD1-CG 4.13Å; I42-F130 HydrophobicContact CD1-CD2 4.02Å; I42-F130 HydrophobicContact CD1-CE2 3.42Å; I42-F130 VanDerWaalsContact CD1-CE2 3.42Å; I42-F130 HydrophobicContact CD1-CZ 4.06Å; I42-F130 HydrophobicContact CG2-CD2 4.16Å; I42-F130 HydrophobicContact CG2-CE2 4.08Å; I42-I133 HydrophobicContact CG2-CD1 4.15Å; I42-I133 HydrophobicContact CG2-CG1 3.86Å; I42-D159 PolarHBondContact N-O 2.87Å; I42-I160 HydrophobicContact CB-CG2 4.09Å; I42-I160 VanDerWaalsContact O-CA 3.22Å; I42-I160 WeakPolarHBondContact O-CA 3.3Å; I42-I160 WeakPolarHBondContact O-CB 3.48Å; I42-Y161 PolarHBondContact O-N 3.13Å
43	P	85.5	Confident	64.5	Low	17 Å²	17	64.1 Å²	64.1	11%	0.11	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	138.4	174.7	26.1	-34.2	0	0	0	111.7	D131 Y132 I133 Y161 D163	P43-D131 WeakPolarHBondContact CD-O 3.1Å; P43-Y132 HydrophobicContact CB-CD2 3.96Å; P43-Y132 HydrophobicContact CB-CE2 3.69Å; P43-Y132 HydrophobicContact CG-CD2 3.26Å; P43-Y132 HydrophobicContact CG-CE2 3.51Å; P43-Y132 HydrophobicContact CG-CG 4.06Å; P43-I133 PolarHBondContact O-N 2.95Å; P43-Y161 HydrophobicContact CB-CE1 3.86Å; P43-Y161 HydrophobicContact CB-CE2 4.3Å; P43-D163 HydrophobicContact CB-CB 3.76Å
44	V	84.4	Confident	66	Low	0 Å²	0	56.8 Å²	56.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.7	172.9	-170.6	0	0	0	0	109.7	I133 L135 F150 I160 Y161 L162 D163	V44-I133 CarbonylContact C-O 3.6Å; V44-I133 WeakPolarHBondContact CA-O 3.36Å; V44-I133 HydrophobicContact CB-CB 4.33Å; V44-I133 HydrophobicContact CG1-CB 4.09Å; V44-I133 HydrophobicContact CG1-CG2 3.99Å; V44-I133 HydrophobicContact CG2-CB 3.97Å; V44-I133 HydrophobicContact CG2-CD1 3.97Å; V44-I133 HydrophobicContact CG2-CG1 4.4Å; V44-L135 HydrophobicContact CG1-CB 4.39Å; V44-F150 HydrophobicContact CB-CE1 4.03Å; V44-F150 HydrophobicContact CB-CZ 4.26Å; V44-F150 HydrophobicContact CG1-CE1 3.93Å; V44-F150 HydrophobicContact CG1-CZ 3.71Å; V44-F150 HydrophobicContact CG2-CE1 3.89Å; V44-I160 HydrophobicContact CG2-CB 3.99Å; V44-I160 HydrophobicContact CG2-CD1 3.99Å; V44-I160 HydrophobicContact CG2-CG1 4.31Å; V44-Y161 PolarHBondContact N-O 2.91Å; V44-L162 CarbonylContact O-C 3.56Å; V44-D163 PolarHBondContact O-N 3.47Å
45	T	83.1	Confident	67.9	Low	4 Å²	4	49.2 Å²	49.2	3%	0.025	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.6	170.6	-79.1	0	0	0	0	110.9	I47 Y132 I133 L134 L135 D163 G164 I166	T45-I47 HydrophobicContact CG2-CG1 4.47Å; T45-Y132 WeakPolarHBondContact CB-OH 3.38Å; T45-Y132 PolarHBondContact OG1-OH 2.9Å; T45-I133 PolarHBondContact N-O 2.69Å; T45-L134 HydrophobicContact CG2-CD2 4.01Å; T45-L134 WeakPolarHBondContact O-CA 3.18Å; T45-L135 PolarHBondContact O-N 2.84Å; T45-D163 PolarHBondContact OG1-OD2 3.36Å; T45-G164 VanDerWaalsContact CA-O 3.3Å; T45-G164 WeakPolarHBondContact CA-O 3.4Å; T45-I166 HydrophobicContact CG2-CD1 3.67Å; T45-I166 HydrophobicContact CG2-CG1 3.84Å
46	I	83.9	Confident	69.4	Low	0 Å²	0	41.9 Å²	41.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.1	176.2	-59	175.5	0	0	0	108.4	L135 T137 V146 A147 F150 L162 G164 I165 I166	I46-L135 CarbonylContact C-O 3.39Å; I46-L135 WeakPolarHBondContact CA-O 3.43Å; I46-L135 HydrophobicContact CG1-CB 4.48Å; I46-L135 HydrophobicContact CG1-CD2 4.33Å; I46-T137 HydrophobicContact CG2-CG2 3.47Å; I46-T137 VanDerWaalsContact CG2-CG2 3.47Å; I46-V146 HydrophobicContact CD1-CB 4.22Å; I46-V146 HydrophobicContact CD1-CG1 3.82Å; I46-V146 HydrophobicContact CG1-CG1 4.48Å; I46-A147 HydrophobicContact CD1-CB 4.19Å; I46-F150 HydrophobicContact CD1-CE2 4.13Å; I46-L162 HydrophobicContact CD1-CD1 3.62Å; I46-L162 HydrophobicContact CG1-CD1 3.71Å; I46-G164 PolarHBondContact N-O 2.86Å; I46-I165 HydrophobicContact CB-CB 4.35Å; I46-I165 HydrophobicContact CB-CG1 4.07Å; I46-I165 HydrophobicContact CB-CG2 3.98Å; I46-I165 HydrophobicContact CD1-CD1 4.12Å; I46-I165 HydrophobicContact CD1-CG1 4.16Å; I46-I165 HydrophobicContact CG1-CG1 4.44Å; I46-I165 HydrophobicContact CG2-CG2 4.07Å; I46-I165 CarbonylContact O-C 3.54Å; I46-I165 VanDerWaalsContact O-CA 3.31Å; I46-I165 WeakPolarHBondContact O-CA 3.13Å; I46-I166 PolarHBondContact O-N 2.8Å
47	I	82.9	Confident	70.3	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.9	171.9	-59.5	-176.6	0	0	0	108.3	T45 K55 L58 L59 L134 L135 T137 I166 I168	T45-I47 HydrophobicContact CG2-CG1 4.47Å; I47-K55 HydrophobicContact CG2-CB 4.48Å; I47-K55 HydrophobicContact CG2-CG 4.32Å; I47-L58 HydrophobicContact CD1-CD2 4.24Å; I47-L59 HydrophobicContact CD1-CD2 3.76Å; I47-L59 HydrophobicContact CD1-CG 4.4Å; I47-L134 HydrophobicContact CD1-CD1 4.36Å; I47-L134 HydrophobicContact CD1-CD2 4.01Å; I47-L134 HydrophobicContact CG1-CD2 4.32Å; I47-L135 PolarHBondContact N-O 2.94Å; I47-T137 PolarHBondContact O-N 3.44Å; I47-T137 PolarHBondContact O-OG1 2.81Å; I47-I166 WeakPolarHBondContact CA-O 3.49Å; I47-I168 HydrophobicContact CG2-CD1 3.8Å; I47-I168 HydrophobicContact CG2-CG1 4.07Å
48	T	81.2	Confident	72.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	174.8	-178.2	-166.2	0	0	0	0	111	T137 P143 I165 I166 T167 I168	T48-T137 WeakPolarHBondContact CA-OG1 3.47Å; T48-T137 WeakPolarHBondContact CB-OG1 3.44Å; T48-T137 PolarHBondContact OG1-OG1 2.94Å; T48-P143 HydrophobicContact CG2-CB 4.08Å; T48-P143 HydrophobicContact CG2-CG 4.08Å; T48-I165 HydrophobicContact CG2-CG2 3.99Å; T48-I166 PolarHBondContact N-O 3.36Å; T48-T167 HydrophobicContact CG2-CG2 4.42Å; T48-T167 WeakPolarHBondContact CG2-OG1 2.85Å; T48-T167 CarbonylContact O-C 3.48Å; T48-T167 VanDerWaalsContact O-CA 3.32Å; T48-T167 WeakPolarHBondContact O-CA 3.27Å; T48-I168 PolarHBondContact O-N 3.32Å
49	G	71.5	Confident	73.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	23%	0.227	C	C	.	.			trans	137.9	154.2	-174.2	0	0	0	0	0	111.3	K55 G139 I168	G49-K55 WeakPolarHBondContact O-CD 3.17Å; G49-K55 WeakPolarHBondContact O-CE 3.35Å; G49-K55 PolarHBondContact O-NZ 2.83Å; G49-G139 VanDerWaalsContact O-CA 3.29Å; G49-G139 WeakPolarHBondContact O-CA 3.41Å; G49-I168 WeakPolarHBondContact CA-O 3.21Å
50	Y	66.6	Low	74.3	Confident	5 Å²	5	34.6 Å²	34.6	2%	0.02	22%	0.216	C	C	.	.			trans	-64.1	167.2	-175.2	59.4	-87.9	0	0	0	113.1	G52 A53 K55 V169 D170 G174 H177 A190	Y50-G52 PolarHBondContact O-N 3.05Å; Y50-A53 HydrophobicContact CD1-CB 4.17Å; Y50-A53 HydrophobicContact CD2-CB 4.2Å; Y50-A53 HydrophobicContact CE1-CB 4.05Å; Y50-A53 HydrophobicContact CE2-CB 4.06Å; Y50-A53 HydrophobicContact CG-CB 4.24Å; Y50-A53 VanDerWaalsContact O-CB 3.27Å; Y50-A53 WeakPolarHBondContact O-CB 3.28Å; Y50-A53 PolarHBondContact O-N 3.36Å; Y50-A53 VanDerWaalsContact O-N 3.15Å; Y50-K55 PolarHBondContact O-NZ 2.95Å; Y50-V169 HydrophobicContact CE1-CG1 4.13Å; Y50-D170 WeakPolarHBondContact OH-CA 3.39Å; Y50-D170 WeakPolarHBondContact OH-CB 3.33Å; Y50-D170 PolarHBondContact OH-N 3.32Å; Y50-D170 PolarHBondContact OH-O 2.85Å; Y50-G174 WeakPolarHBondContact OH-CA 3.4Å; Y50-G174 PolarHBondContact OH-N 3.35Å; Y50-H177 HydrophobicContact CD2-CB 4.32Å; Y50-H177 AromaticContact CD2-CD2 3.92Å; Y50-H177 HydrophobicContact CE2-CB 4.27Å; Y50-H177 AromaticContact CE2-CD2 3.36Å; Y50-H177 WeakPolarHBondContact CE2-CD2 3.22Å; Y50-H177 AromaticContact CE2-CG 3.9Å; Y50-H177 AromaticContact CE2-NE2 3.99Å; Y50-H177 AromaticContact CZ-CD2 3.95Å; Y50-A190 HydrophobicContact CD1-CB 3.64Å; Y50-A190 HydrophobicContact CE1-CB 4.35Å; Y50-A190 HydrophobicContact CG-CB 3.93Å
51	L	68.9	Low	74.3	Confident	88 Å²	88	36.7 Å²	36.7	46%	0.461	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	127.5	176.9	-178.6	61.2	0	0	0	111.1	E85	L51-E85 HydrophobicContact CD1-CG 4.46Å; L51-E85 WeakPolarHBondContact CD1-OE1 3.26Å
52	G	64.6	Low	73.9	Confident	59 Å²	59	33.4 Å²	33.4	61%	0.608	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	83	1.6	-178.7	0	0	0	0	0	115.7	Y50 G54	Y50-G52 PolarHBondContact O-N 3.05Å; G52-G54 PolarHBondContact O-N 3.05Å; G52-G54 VanDerWaalsContact O-N 3.12Å
53	A	68.5	Low	73	Confident	8 Å²	8	33.6 Å²	33.6	7%	0.066	20%	0.198	C	C	.	.	S	Bend	trans	-66.3	-9.9	176.7	0	0	0	0	0	114.9	Y50 I168	Y50-A53 HydrophobicContact CD1-CB 4.17Å; Y50-A53 HydrophobicContact CD2-CB 4.2Å; Y50-A53 HydrophobicContact CE1-CB 4.05Å; Y50-A53 HydrophobicContact CE2-CB 4.06Å; Y50-A53 HydrophobicContact CG-CB 4.24Å; Y50-A53 VanDerWaalsContact O-CB 3.27Å; Y50-A53 WeakPolarHBondContact O-CB 3.28Å; Y50-A53 PolarHBondContact O-N 3.36Å; Y50-A53 VanDerWaalsContact O-N 3.15Å; A53-I168 HydrophobicContact CB-CB 4.35Å; A53-I168 HydrophobicContact CB-CG2 4.31Å; A53-I168 WeakPolarHBondContact CB-O 3.21Å; A53-I168 WeakPolarHBondContact O-CG2 3.34Å
54	G	66.5	Low	71.9	Confident	27 Å²	27	36.7 Å²	36.7	28%	0.278	22%	0.217	S	C	.	.	S	Bend	trans	98.5	15.6	-179.9	0	0	0	0	0	115.8	G52 T56 T57 L58	G52-G54 PolarHBondContact O-N 3.05Å; G52-G54 VanDerWaalsContact O-N 3.12Å; G54-T56 PolarHBondContact O-N 3.18Å; G54-T57 WeakPolarHBondContact O-CB 3.38Å; G54-T57 PolarHBondContact O-N 3.42Å; G54-T57 VanDerWaalsContact O-N 3.14Å; G54-L58 PolarHBondContact O-N 2.92Å
55	K	74.9	Confident	71.3	Confident	10 Å²	10	41 Å²	41	4%	0.043	24%	0.237	C	C	.	.	H	α-helix	trans	-51.6	-53.2	176.2	-60.7	-173.4	-58.6	-69.5	0	113.3	I47 G49 Y50 T57 L58 L59 E136 T137 I168	I47-K55 HydrophobicContact CG2-CB 4.48Å; I47-K55 HydrophobicContact CG2-CG 4.32Å; G49-K55 WeakPolarHBondContact O-CD 3.17Å; G49-K55 WeakPolarHBondContact O-CE 3.35Å; G49-K55 PolarHBondContact O-NZ 2.83Å; Y50-K55 PolarHBondContact O-NZ 2.95Å; K55-T57 VanDerWaalsContact C-N 3.29Å; K55-T57 PolarHBondContact O-N 3.25Å; K55-L58 PolarHBondContact O-N 3.29Å; K55-L59 WeakPolarHBondContact O-CG 3.38Å; K55-L59 PolarHBondContact O-N 3.38Å; K55-E136 WeakPolarHBondContact CB-OE1 3.49Å; K55-T137 WeakPolarHBondContact CE-O 3.4Å; K55-I168 HydrophobicContact CB-CD1 4.24Å; K55-I168 HydrophobicContact CG-CB 4.37Å; K55-I168 HydrophobicContact CG-CD1 3.96Å; K55-I168 HydrophobicContact CG-CG1 4.34Å
56	T	65.6	Low	70.7	Confident	51 Å²	51	49.1 Å²	49.1	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-41.1	177.1	-49.7	0	0	0	0	112.3	G54 L58 L59 N60 L88	G54-T56 PolarHBondContact O-N 3.18Å; T56-L58 VanDerWaalsContact C-N 3.34Å; T56-L58 PolarHBondContact O-N 3.14Å; T56-L59 PolarHBondContact O-N 3.41Å; T56-N60 WeakPolarHBondContact O-CB 3.41Å; T56-N60 PolarHBondContact O-N 3.4Å; T56-L88 HydrophobicContact CG2-CD1 3.3Å; T56-L88 HydrophobicContact CG2-CD2 3.83Å; T56-L88 HydrophobicContact CG2-CG 4.17Å
57	T	65.1	Low	70.2	Confident	106 Å²	106	52.1 Å²	52.1	65%	0.65	29%	0.289	S	S	*	.	H	α-helix	trans	-62	-44.3	179.2	-52.3	0	0	0	0	110.9	G54 K55 N60 Y61	G54-T57 WeakPolarHBondContact O-CB 3.38Å; G54-T57 PolarHBondContact O-N 3.42Å; G54-T57 VanDerWaalsContact O-N 3.14Å; K55-T57 VanDerWaalsContact C-N 3.29Å; K55-T57 PolarHBondContact O-N 3.25Å; T57-N60 PolarHBondContact O-N 2.74Å; T57-Y61 PolarHBondContact O-N 2.95Å
58	L	73.9	Confident	69.8	Low	62 Å²	62	58.3 Å²	58.3	33%	0.325	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-44.7	175	178.8	62.6	0	0	0	111.7	I47 G54 K55 T56 Y61 I62 I168	I47-L58 HydrophobicContact CD1-CD2 4.24Å; G54-L58 PolarHBondContact O-N 2.92Å; K55-L58 PolarHBondContact O-N 3.29Å; T56-L58 VanDerWaalsContact C-N 3.34Å; T56-L58 PolarHBondContact O-N 3.14Å; L58-Y61 WeakPolarHBondContact O-CB 3.26Å; L58-Y61 PolarHBondContact O-N 2.86Å; L58-I62 HydrophobicContact CD1-CD1 4.22Å; L58-I62 HydrophobicContact CG-CD1 4.06Å; L58-I62 WeakPolarHBondContact O-CG1 3.4Å; L58-I62 PolarHBondContact O-N 3.44Å; L58-I168 HydrophobicContact CB-CD1 3.93Å; L58-I168 HydrophobicContact CD2-CD1 3.46Å; L58-I168 VanDerWaalsContact CD2-CD1 3.46Å; L58-I168 HydrophobicContact CD2-CG1 4.31Å; L58-I168 HydrophobicContact CG-CD1 4.33Å
59	L	72.4	Confident	69.6	Low	4 Å²	4	64 Å²	64	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-63.7	-43.3	179	-73.9	170.1	0	0	0	112	I47 K55 T56 Y61 I62 L63 V73 L75 L134 E136	I47-L59 HydrophobicContact CD1-CD2 3.76Å; I47-L59 HydrophobicContact CD1-CG 4.4Å; K55-L59 WeakPolarHBondContact O-CG 3.38Å; K55-L59 PolarHBondContact O-N 3.38Å; T56-L59 PolarHBondContact O-N 3.41Å; L59-Y61 VanDerWaalsContact C-N 3.33Å; L59-Y61 PolarHBondContact O-N 3.31Å; L59-I62 PolarHBondContact O-N 3.28Å; L59-L63 WeakPolarHBondContact O-CB 3.22Å; L59-L63 VanDerWaalsContact O-CG 3.26Å; L59-L63 WeakPolarHBondContact O-CG 3.46Å; L59-L63 PolarHBondContact O-N 2.89Å; L59-V73 HydrophobicContact CD1-CG1 4.49Å; L59-V73 HydrophobicContact CD2-CG1 3.86Å; L59-V73 HydrophobicContact CD2-CG2 4.31Å; L59-L75 HydrophobicContact CD1-CD2 3.87Å; L59-L134 HydrophobicContact CD2-CB 4.46Å; L59-L134 HydrophobicContact CD2-CD1 4.25Å; L59-E136 HydrophobicContact CD1-CB 3.77Å; L59-E136 HydrophobicContact CD1-CG 3.82Å; L59-E136 WeakPolarHBondContact CD1-OE2 3.46Å
60	N	63.3	Low	70	Confident	97 Å²	97	68.6 Å²	68.6	52%	0.519	37%	0.374	S	S	.	.	H	α-helix	trans	-60.9	-44.6	177	-171.5	45.8	0	0	0	110.8	T56 T57 I62 L63 T64	T56-N60 WeakPolarHBondContact O-CB 3.41Å; T56-N60 PolarHBondContact O-N 3.4Å; T57-N60 PolarHBondContact O-N 2.74Å; N60-I62 PolarHBondContact O-N 3.05Å; N60-L63 CarbonylContact O-C 3.56Å; N60-L63 PolarHBondContact O-N 3.21Å; N60-L63 VanDerWaalsContact O-N 3.14Å; N60-T64 WeakPolarHBondContact O-CG2 3.5Å; N60-T64 PolarHBondContact O-N 2.7Å; N60-T64 PolarHBondContact O-OG1 2.64Å
61	Y	70.3	Confident	70.9	Confident	116 Å²	116	68.7 Å²	68.7	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-56.3	-49.6	175.2	178.1	-96.8	0	0	0	111.9	T57 L58 L59 L63 T64 E65	T57-Y61 PolarHBondContact O-N 2.95Å; L58-Y61 WeakPolarHBondContact O-CB 3.26Å; L58-Y61 PolarHBondContact O-N 2.86Å; L59-Y61 VanDerWaalsContact C-N 3.33Å; L59-Y61 PolarHBondContact O-N 3.31Å; Y61-L63 VanDerWaalsContact C-N 3.3Å; Y61-L63 PolarHBondContact O-N 2.98Å; Y61-T64 PolarHBondContact O-N 2.95Å; Y61-T64 PolarHBondContact O-OG1 3.28Å; Y61-E65 HydrophobicContact CD1-CG 4.3Å; Y61-E65 HydrophobicContact CD2-CG 3.69Å; Y61-E65 HydrophobicContact CE1-CG 4.05Å; Y61-E65 HydrophobicContact CE2-CG 3.4Å; Y61-E65 HydrophobicContact CG-CG 4.14Å; Y61-E65 VanDerWaalsContact O-CB 3.3Å; Y61-E65 WeakPolarHBondContact O-CB 3.49Å; Y61-E65 WeakPolarHBondContact O-CG 3.3Å; Y61-E65 PolarHBondContact O-N 2.89Å
62	I	72.4	Confident	71.7	Confident	32 Å²	32	64.5 Å²	64.5	16%	0.164	35%	0.353	C	S	.	.	H	α-helix	trans	-59.7	-43	176.6	-65.3	166.8	0	0	0	110.8	L58 L59 N60 T64 H67 V71 L134	L58-I62 HydrophobicContact CD1-CD1 4.22Å; L58-I62 HydrophobicContact CG-CD1 4.06Å; L58-I62 WeakPolarHBondContact O-CG1 3.4Å; L58-I62 PolarHBondContact O-N 3.44Å; L59-I62 PolarHBondContact O-N 3.28Å; N60-I62 PolarHBondContact O-N 3.05Å; I62-T64 VanDerWaalsContact C-N 3.32Å; I62-T64 PolarHBondContact O-N 3.25Å; I62-H67 PolarHBondContact O-CD2 3.06Å; I62-H67 VanDerWaalsContact O-CD2 3.29Å; I62-H67 PolarHBondContact O-NE2 3.13Å; I62-V71 HydrophobicContact CG2-CG1 4.48Å; I62-L134 HydrophobicContact CD1-CD1 3.69Å; I62-L134 HydrophobicContact CG2-CD1 3.86Å
63	L	66.8	Low	72.6	Confident	18 Å²	18	61.7 Å²	61.7	9%	0.094	33%	0.325	C	S	.	.	H	α-helix	trans	-71.9	-21.5	-178.3	-74.8	178.8	0	0	0	113.8	L59 N60 Y61 V73 L103 N105 C107 C109	L59-L63 WeakPolarHBondContact O-CB 3.22Å; L59-L63 VanDerWaalsContact O-CG 3.26Å; L59-L63 WeakPolarHBondContact O-CG 3.46Å; L59-L63 PolarHBondContact O-N 2.89Å; N60-L63 CarbonylContact O-C 3.56Å; N60-L63 PolarHBondContact O-N 3.21Å; N60-L63 VanDerWaalsContact O-N 3.14Å; Y61-L63 VanDerWaalsContact C-N 3.3Å; Y61-L63 PolarHBondContact O-N 2.98Å; L63-V73 HydrophobicContact CD1-CB 4.36Å; L63-V73 HydrophobicContact CD1-CG2 4.16Å; L63-V73 HydrophobicContact CD2-CB 4.12Å; L63-V73 HydrophobicContact CD2-CG2 3.44Å; L63-V73 VanDerWaalsContact CD2-CG2 3.44Å; L63-V73 HydrophobicContact CG-CG2 3.87Å; L63-L103 HydrophobicContact CB-CD1 3.6Å; L63-L103 HydrophobicContact CD1-CD1 4.36Å; L63-L103 HydrophobicContact CD2-CD1 3.73Å; L63-L103 HydrophobicContact CG-CD1 4.09Å; L63-L103 VanDerWaalsContact O-CD1 3.28Å; L63-L103 WeakPolarHBondContact O-CD1 3.26Å; L63-N105 PolarHBondContact O-ND2 3.21Å; L63-N105 PolarHBondContact O-OD1 3.03Å; L63-C107 HydrophobicContact CD2-CB 3.68Å; L63-C109 HydrophobicContact CD1-CB 4.35Å
64	T	63.5	Low	73.2	Confident	82 Å²	82	61.3 Å²	61.3	50%	0.503	32%	0.321	S	S	.	.	H	α-helix	trans	-101.2	-28.9	-178.8	55.6	0	0	0	0	114	N60 Y61 I62	N60-T64 WeakPolarHBondContact O-CG2 3.5Å; N60-T64 PolarHBondContact O-N 2.7Å; N60-T64 PolarHBondContact O-OG1 2.64Å; Y61-T64 PolarHBondContact O-N 2.95Å; Y61-T64 PolarHBondContact O-OG1 3.28Å; I62-T64 VanDerWaalsContact C-N 3.32Å; I62-T64 PolarHBondContact O-N 3.25Å
65	E	71.4	Confident	73.5	Confident	89 Å²	89	62.2 Å²	62.2	42%	0.416	32%	0.32	S	S	.	.	S	Bend	trans	-78.6	158.5	-175.6	-74.7	-58	143.5	0	0	113.8	Y61 H67 N105	Y61-E65 HydrophobicContact CD1-CG 4.3Å; Y61-E65 HydrophobicContact CD2-CG 3.69Å; Y61-E65 HydrophobicContact CE1-CG 4.05Å; Y61-E65 HydrophobicContact CE2-CG 3.4Å; Y61-E65 HydrophobicContact CG-CG 4.14Å; Y61-E65 VanDerWaalsContact O-CB 3.3Å; Y61-E65 WeakPolarHBondContact O-CB 3.49Å; Y61-E65 WeakPolarHBondContact O-CG 3.3Å; Y61-E65 PolarHBondContact O-N 2.89Å; E65-H67 PolarHBondContact O-N 3.39Å; E65-N105 PolarHBondContact O-ND2 3.05Å; E65-N105 VanDerWaalsContact O-ND2 3.16Å
66	Q	69.8	Low	72.9	Confident	175 Å²	175	62.2 Å²	62.2	82%	0.818	32%	0.32	S	S	*	.			trans	-96	80.2	178	-69.4	-171.1	0.7	0	0	111.3
67	H	73.8	Confident	72.4	Confident	64 Å²	64	64.9 Å²	64.9	30%	0.296	33%	0.329	S	S	.	.			trans	-96.1	13.8	178.4	55.6	64.8	0	0	0	113.5	I62 E65 K69	I62-H67 PolarHBondContact O-CD2 3.06Å; I62-H67 VanDerWaalsContact O-CD2 3.29Å; I62-H67 PolarHBondContact O-NE2 3.13Å; E65-H67 PolarHBondContact O-N 3.39Å; H67-K69 PolarHBondContact CE1-O 3.4Å; H67-K69 WeakPolarHBondContact ND1-CB 3.34Å; H67-K69 PolarHBondContact ND1-N 3.21Å; H67-K69 PolarHBondContact ND1-O 3.34Å; H67-K69 PolarHBondContact O-N 3.08Å
68	S	75.2	Confident	71.6	Confident	132 Å²	132	61.5 Å²	61.5	92%	0.923	31%	0.305	S	S	*	.	S	Bend	trans	53.1	22.9	178.5	-56.8	0	0	0	0	115.6
69	K	75.8	Confident	69.8	Low	119 Å²	119	60.8 Å²	60.8	52%	0.517	31%	0.313	S	S	.	.	S	Bend	trans	-120.5	149.6	173.1	-62.4	-172.5	176.8	-176.6	0	109.4	H67 V71	H67-K69 PolarHBondContact CE1-O 3.4Å; H67-K69 WeakPolarHBondContact ND1-CB 3.34Å; H67-K69 PolarHBondContact ND1-N 3.21Å; H67-K69 PolarHBondContact ND1-O 3.34Å; H67-K69 PolarHBondContact O-N 3.08Å; K69-V71 HydrophobicContact CB-CG2 4.17Å
70	R	81.3	Confident	68	Low	96 Å²	96	70.8 Å²	70.8	36%	0.362	36%	0.36	S	S	.	.			trans	-98.4	98.6	174.2	-60.8	174.7	-64.2	162.9	1.8	108.3	G128 K129 F130 D131 Y132	R70-G128 PolarHBondContact NH1-O 2.86Å; R70-G128 PolarHBondContact NH2-O 2.84Å; R70-K129 WeakPolarHBondContact CD-O 3.11Å; R70-F130 CarbonylContact O-C 3.53Å; R70-F130 WeakPolarHBondContact O-CA 3.27Å; R70-F130 WeakPolarHBondContact O-CB 3.46Å; R70-D131 IonicContact CZ-OD1 3.77Å; R70-D131 IonicContact CZ-OD2 2.76Å; R70-D131 IonicContact NE-OD1 3.6Å; R70-D131 IonicContact NE-OD2 2.78Å; R70-D131 PolarHBondContact NE-OD2 2.84Å; R70-D131 VanDerWaalsContact NH2-CG 3.29Å; R70-D131 IonicContact NH2-OD1 2.69Å; R70-D131 PolarHBondContact NH2-OD1 2.99Å; R70-D131 IonicContact NH2-OD2 3.13Å; R70-D131 PolarHBondContact NH2-OD2 3.41Å; R70-D131 VanDerWaalsContact NH2-OD2 3.13Å; R70-D131 PolarHBondContact O-N 3.28Å; R70-Y132 PolarHBondContact O-N 2.79Å
71	V	84.7	Confident	66.7	Low	7 Å²	7	68.2 Å²	68.2	4%	0.042	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.7	-174	-178.6	0	0	0	0	109.6	I62 K69 V73 C107 L108 Y132 L134	I62-V71 HydrophobicContact CG2-CG1 4.48Å; K69-V71 HydrophobicContact CB-CG2 4.17Å; V71-V73 HydrophobicContact CG1-CG2 4.2Å; V71-C107 CarbonylContact O-C 3.57Å; V71-C107 WeakPolarHBondContact O-CA 3.3Å; V71-C107 VanDerWaalsContact O-CB 3.28Å; V71-C107 WeakPolarHBondContact O-CB 3.33Å; V71-L108 PolarHBondContact O-N 3.24Å; V71-Y132 WeakPolarHBondContact CA-O 3.45Å; V71-Y132 HydrophobicContact CG1-CD1 4.33Å; V71-L134 HydrophobicContact CG1-CB 4.31Å; V71-L134 HydrophobicContact CG1-CD1 3.67Å; V71-L134 HydrophobicContact CG1-CG 3.77Å
72	A	86.1	Confident	64.9	Low	1 Å²	1	67.3 Å²	67.3	1%	0.008	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.2	168.6	0	0	0	0	0	109.6	L108 L123 F130 Y132 I133 L134	A72-L108 CarbonylContact C-O 3.6Å; A72-L108 VanDerWaalsContact CA-O 3.25Å; A72-L108 WeakPolarHBondContact CA-O 3.3Å; A72-L108 HydrophobicContact CB-CB 4.38Å; A72-L123 HydrophobicContact CB-CD1 3.7Å; A72-L123 HydrophobicContact CB-CD2 3.6Å; A72-L123 HydrophobicContact CB-CG 4.23Å; A72-F130 HydrophobicContact CB-CB 3.95Å; A72-F130 HydrophobicContact CB-CD1 4.18Å; A72-F130 HydrophobicContact CB-CD2 3.97Å; A72-F130 HydrophobicContact CB-CG 3.75Å; A72-Y132 PolarHBondContact N-O 2.81Å; A72-I133 HydrophobicContact CB-CG1 4.49Å; A72-I133 CarbonylContact O-C 3.53Å; A72-I133 VanDerWaalsContact O-CA 3.3Å; A72-I133 WeakPolarHBondContact O-CA 3.37Å; A72-L134 PolarHBondContact O-N 3.28Å
73	V	82.7	Confident	63.2	Low	0 Å²	0	69.7 Å²	69.7	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.3	176.6	178.4	0	0	0	0	109.3	L59 L63 V71 L75 L108 C109 C110 L134	L59-V73 HydrophobicContact CD1-CG1 4.49Å; L59-V73 HydrophobicContact CD2-CG1 3.86Å; L59-V73 HydrophobicContact CD2-CG2 4.31Å; L63-V73 HydrophobicContact CD1-CB 4.36Å; L63-V73 HydrophobicContact CD1-CG2 4.16Å; L63-V73 HydrophobicContact CD2-CB 4.12Å; L63-V73 HydrophobicContact CD2-CG2 3.44Å; L63-V73 VanDerWaalsContact CD2-CG2 3.44Å; L63-V73 HydrophobicContact CG-CG2 3.87Å; V71-V73 HydrophobicContact CG1-CG2 4.2Å; V73-L75 HydrophobicContact CG1-CD2 3.67Å; V73-L75 HydrophobicContact CG1-CG 4.23Å; V73-L108 PolarHBondContact N-O 2.78Å; V73-C109 WeakPolarHBondContact O-CA 3.41Å; V73-C110 PolarHBondContact O-N 2.8Å; V73-L134 CarbonylContact C-O 3.59Å; V73-L134 WeakPolarHBondContact CA-O 3.36Å; V73-L134 HydrophobicContact CG2-CB 4.1Å; V73-L134 HydrophobicContact CG2-CD1 4.27Å
74	I	82.1	Confident	61.8	Low	0 Å²	0	76 Å²	76	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111	170.1	-58.8	173.7	0	0	0	107.1	A119 I120 L123 I133 L134 L135 E136	I74-A119 HydrophobicContact CD1-CB 4.15Å; I74-A119 HydrophobicContact CG2-CB 3.77Å; I74-I120 HydrophobicContact CD1-CB 4.47Å; I74-I120 HydrophobicContact CD1-CG1 3.59Å; I74-L123 HydrophobicContact CD1-CD2 3.87Å; I74-L123 HydrophobicContact CG1-CD2 4.14Å; I74-I133 HydrophobicContact CD1-CG2 4.16Å; I74-L134 PolarHBondContact N-O 2.88Å; I74-L135 HydrophobicContact CB-CD1 3.74Å; I74-L135 HydrophobicContact CD1-CD1 4.49Å; I74-L135 HydrophobicContact CG2-CD1 3.63Å; I74-E136 PolarHBondContact O-N 3.46Å
75	L	72.9	Confident	60.9	Low	46 Å²	46	77.9 Å²	77.9	24%	0.241	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	110.2	171.1	-53.2	175.7	0	0	0	107	L59 V73 C110 V112 E136	L59-L75 HydrophobicContact CD1-CD2 3.87Å; V73-L75 HydrophobicContact CG1-CD2 3.67Å; V73-L75 HydrophobicContact CG1-CG 4.23Å; L75-C110 PolarHBondContact N-O 2.89Å; L75-V112 PolarHBondContact O-N 2.8Å; L75-E136 HydrophobicContact CD2-CB 4.46Å; L75-E136 WeakPolarHBondContact CD2-OE2 3.25Å
76	N	61.8	Low	59.4	Low	10 Å²	10	80.6 Å²	80.6	5%	0.053	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.7	-175.3	-152.3	-46.8	0	0	0	113.2	F78 G116 L135 E136 T138	N76-F78 HydrophobicContact CB-CD2 3.46Å; N76-F78 VanDerWaalsContact CB-CD2 3.46Å; N76-F78 HydrophobicContact CB-CE2 3.87Å; N76-F78 HydrophobicContact CB-CG 4.22Å; N76-F78 VanDerWaalsContact CG-CG 3.48Å; N76-F78 WeakPolarHBondContact ND2-CD2 3.32Å; N76-F78 WeakPolarHBondContact ND2-CE2 3.36Å; N76-F78 VanDerWaalsContact ND2-CZ 3.27Å; N76-F78 WeakPolarHBondContact ND2-CZ 3.43Å; N76-F78 PolarHBondContact O-N 2.82Å; N76-F78 VanDerWaalsContact OD1-CD2 3.24Å; N76-F78 WeakPolarHBondContact OD1-CD2 3.43Å; N76-F78 WeakPolarHBondContact OD1-CG 3.3Å; N76-F78 PolarHBondContact OD1-N 2.72Å; N76-G116 WeakPolarHBondContact ND2-CA 3.27Å; N76-G116 PolarHBondContact ND2-N 3.13Å; N76-L135 HydrophobicContact CB-CD1 4.27Å; N76-E136 WeakPolarHBondContact CB-O 3.28Å; N76-E136 PolarHBondContact N-O 3.34Å; N76-T138 WeakPolarHBondContact O-CG2 3.26Å
77	E	55.8	Low	57.7	Low	106 Å²	106	77.4 Å²	77.4	50%	0.495	44%	0.435	S	S	.	.			trans	-82.1	50.3	164.3	-67.4	-170.2	154.5	0	0	111.7	G79	E77-G79 PolarHBondContact O-N 2.62Å
78	F	48.7	Very low	56.1	Low	35 Å²	35	80.4 Å²	80.4	15%	0.154	45%	0.452	C	S	.	.			trans	-71.4	89.3	171.9	-77.4	-61.5	0	0	0	111	N76 T138 A141 V146 M149	N76-F78 HydrophobicContact CB-CD2 3.46Å; N76-F78 VanDerWaalsContact CB-CD2 3.46Å; N76-F78 HydrophobicContact CB-CE2 3.87Å; N76-F78 HydrophobicContact CB-CG 4.22Å; N76-F78 VanDerWaalsContact CG-CG 3.48Å; N76-F78 WeakPolarHBondContact ND2-CD2 3.32Å; N76-F78 WeakPolarHBondContact ND2-CE2 3.36Å; N76-F78 VanDerWaalsContact ND2-CZ 3.27Å; N76-F78 WeakPolarHBondContact ND2-CZ 3.43Å; N76-F78 PolarHBondContact O-N 2.82Å; N76-F78 VanDerWaalsContact OD1-CD2 3.24Å; N76-F78 WeakPolarHBondContact OD1-CD2 3.43Å; N76-F78 WeakPolarHBondContact OD1-CG 3.3Å; N76-F78 PolarHBondContact OD1-N 2.72Å; F78-T138 VanDerWaalsContact N-CG2 3.33Å; F78-T138 VanDerWaalsContact O-CG2 3.3Å; F78-T138 WeakPolarHBondContact O-CG2 3.32Å; F78-T138 PolarHBondContact O-OG1 3.47Å; F78-A141 HydrophobicContact CB-CB 4.08Å; F78-V146 HydrophobicContact CD2-CG2 4.2Å; F78-V146 HydrophobicContact CE2-CG1 4.32Å; F78-V146 HydrophobicContact CE2-CG2 4.11Å; F78-M149 HydrophobicContact CE1-CE 4.14Å; F78-M149 HydrophobicContact CZ-CE 4.05Å; F78-M149 HydrophobicContact CZ-SD 4.29Å
79	G	35.8	Very low	54.2	Low	48 Å²	48	77.8 Å²	77.8	50%	0.495	44%	0.439	S	S	.	.	S	Bend	trans	163.8	138.3	169	0	0	0	0	0	113.8	E77 G81	E77-G79 PolarHBondContact O-N 2.62Å; G79-G81 PolarHBondContact O-N 3.46Å
80	E	34.8	Very low	52.1	Low	214 Å²	214	78.5 Å²	78.5	100%	1	45%	0.453	S	S	*	.	S	Bend	trans	-70.8	77.9	162.9	-72.6	-176	158.7	0	0	109
81	G	35.7	Very low	49.7	Very low	43 Å²	43	78 Å²	78	44%	0.443	46%	0.464	S	S	.	.			trans	-151.1	103.3	-176.9	0	0	0	0	0	110.9	G79 A83	G79-G81 PolarHBondContact O-N 3.46Å; G81-A83 PolarHBondContact O-N 2.67Å
82	S	31.3	Very low	47.3	Very low	96 Å²	96	87 Å²	87	67%	0.671	51%	0.506	S	S	*	.			trans	-8.9	110.5	174	56.6	0	0	0	0	118.3	L84	S82-L84 PolarHBondContact O-N 2.9Å
83	A	37	Very low	44.9	Very low	82 Å²	82	90.3 Å²	90.3	68%	0.678	54%	0.539	S	S	*	.	S	Bend	trans	24.3	8.5	130.1	0	0	0	0	0	123.7	G81	G81-A83 PolarHBondContact O-N 2.67Å
84	L	38.4	Very low	42.6	Very low	150 Å²	150	94.5 Å²	94.5	79%	0.785	58%	0.582	S	S	*	*			trans	-99.9	-2.8	-171.2	-99.7	138.9	0	0	0	114.7	S82	S82-L84 PolarHBondContact O-N 2.9Å
85	E	43.3	Very low	40.1	Very low	122 Å²	122	100.9 Å²	100.9	57%	0.57	61%	0.612	S	S	*	*			trans	-103.6	27.3	177.2	-61.6	-155.9	122.3	0	0	113.9	L51 S87	L51-E85 HydrophobicContact CD1-CG 4.46Å; L51-E85 WeakPolarHBondContact CD1-OE1 3.26Å; E85-S87 PolarHBondContact O-N 2.77Å
86	K	39.7	Very low	38.2	Very low	146 Å²	146	105.2 Å²	105.2	64%	0.635	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-69.2	5.3	178.3	-82.9	-173.5	176	-177.4	0	115.6	L88	K86-L88 VanDerWaalsContact C-N 3.33Å; K86-L88 PolarHBondContact O-N 2.74Å
87	S	35.5	Very low	36.9	Very low	108 Å²	108	113.2 Å²	113.2	76%	0.755	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-82.9	2.6	-167.2	-88.2	0	0	0	0	116.2	E85	E85-S87 PolarHBondContact O-N 2.77Å
88	L	39	Very low	36.6	Very low	127 Å²	127	113.1 Å²	113.1	67%	0.665	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-114.7	-5.5	-179.4	-68.7	142.7	0	0	0	114.7	T56 K86	T56-L88 HydrophobicContact CG2-CD1 3.3Å; T56-L88 HydrophobicContact CG2-CD2 3.83Å; T56-L88 HydrophobicContact CG2-CG 4.17Å; K86-L88 VanDerWaalsContact C-N 3.33Å; K86-L88 PolarHBondContact O-N 2.74Å
89	A	35.6	Very low	36.9	Very low	78 Å²	78	116.4 Å²	116.4	65%	0.645	68%	0.681	S	S	*	*			trans	-115	77	172	0	0	0	0	0	109.6
90	V	32.8	Very low	38.1	Very low	134 Å²	134	116.8 Å²	116.8	81%	0.812	67%	0.667	S	S	*	*			trans	-93.2	107.5	168.3	178.4	0	0	0	0	108.6
91	S	30.9	Very low	39.5	Very low	84 Å²	84	110.8 Å²	110.8	59%	0.587	64%	0.642	S	S	*	*			trans	-156.9	162.1	135.2	96.3	0	0	0	0	111.6
92	Q	33.9	Very low	41	Very low	198 Å²	198	114.8 Å²	114.8	93%	0.925	65%	0.649	S	S	*	*	S	Bend	trans	-63.9	141.3	-156.3	-65.3	164.9	-9.6	0	0	114.4
93	G	34.4	Very low	42.7	Very low	69 Å²	69	113.2 Å²	113.2	71%	0.711	63%	0.633	S	S	*	*	S	Bend	trans	123	11.4	148.3	0	0	0	0	0	118.9	E95	G93-E95 PolarHBondContact O-N 2.92Å
94	G	34.7	Very low	43.7	Very low	88 Å²	88	122.1 Å²	122.1	91%	0.907	65%	0.649	S	S	*	*	S	Bend	trans	65.5	0.3	160.8	0	0	0	0	0	117.5
95	E	29.3	Very low	44.9	Very low	135 Å²	135	116.9 Å²	116.9	63%	0.631	62%	0.622	S	S	*	*			trans	-106.7	122.1	167.9	-73.3	-168.5	163.5	0	0	109.1	G93 Y97	G93-E95 PolarHBondContact O-N 2.92Å; E95-Y97 HydrophobicContact CB-CD2 4.11Å; E95-Y97 HydrophobicContact CB-CE2 3.56Å; E95-Y97 WeakPolarHBondContact O-CD2 3.49Å; E95-Y97 PolarHBondContact O-N 2.93Å; E95-Y97 VanDerWaalsContact O-N 3.17Å; E95-Y97 WeakPolarHBondContact OE2-CE2 3.39Å; E95-Y97 PolarHBondContact OE2-OH 2.87Å
96	L	32.9	Very low	45.8	Very low	137 Å²	137	112.9 Å²	112.9	72%	0.717	61%	0.613	S	S	*	*			trans	-80.9	92.2	-178.1	-69.8	160.4	0	0	0	108.9	K113	L96-K113 HydrophobicContact CD1-CD 4.3Å
97	Y	34.8	Very low	47.2	Very low	177 Å²	177	106 Å²	106	69%	0.694	58%	0.583	S	S	*	*			trans	-83.7	147.8	166.7	-68.7	-90.4	0	0	0	109.8	E95 E99	E95-Y97 HydrophobicContact CB-CD2 4.11Å; E95-Y97 HydrophobicContact CB-CE2 3.56Å; E95-Y97 WeakPolarHBondContact O-CD2 3.49Å; E95-Y97 PolarHBondContact O-N 2.93Å; E95-Y97 VanDerWaalsContact O-N 3.17Å; E95-Y97 WeakPolarHBondContact OE2-CE2 3.39Å; E95-Y97 PolarHBondContact OE2-OH 2.87Å; Y97-E99 PolarHBondContact O-N 2.94Å
98	E	49.8	Very low	49	Very low	104 Å²	104	101.2 Å²	101.2	49%	0.486	55%	0.549	S	S	.	.			trans	-64.1	86.4	163.3	-73.6	-174.2	162	0	0	108.8	W100	E98-W100 PolarHBondContact O-N 3.27Å
99	E	54.7	Low	50.1	Low	104 Å²	104	95.9 Å²	95.9	49%	0.486	52%	0.522	S	S	.	.			trans	-86.3	99.1	-178.3	-160.6	171.4	-168.8	0	0	109.7	Y97 L101	Y97-E99 PolarHBondContact O-N 2.94Å; E99-L101 HydrophobicContact CG-CD2 4.21Å; E99-L101 HydrophobicContact CG-CG 4.46Å
100	W	61.5	Low	51.7	Low	56 Å²	56	92.2 Å²	92.2	21%	0.212	49%	0.492	C	S	.	.			trans	-77.2	120.1	169.6	-69.4	88.8	0	0	0	109.4	E98 L108 C110 N122 L123	E98-W100 PolarHBondContact O-N 3.27Å; W100-L108 HydrophobicContact CB-CD1 4.35Å; W100-L108 HydrophobicContact CE3-CD1 3.82Å; W100-L108 HydrophobicContact CE3-CD2 3.61Å; W100-L108 HydrophobicContact CE3-CG 3.62Å; W100-L108 HydrophobicContact CZ3-CD2 3.63Å; W100-L108 HydrophobicContact CZ3-CG 3.93Å; W100-C110 HydrophobicContact CD2-CB 4.05Å; W100-C110 HydrophobicContact CE3-CB 3.55Å; W100-C110 HydrophobicContact CH2-CB 3.67Å; W100-C110 HydrophobicContact CZ2-CB 4.15Å; W100-C110 HydrophobicContact CZ3-CB 3.35Å; W100-N122 HydrophobicContact CZ2-CB 4.32Å; W100-L123 HydrophobicContact CH2-CB 3.94Å; W100-L123 HydrophobicContact CH2-CD1 3.91Å; W100-L123 HydrophobicContact CZ3-CD1 3.71Å
101	L	63.8	Low	53	Low	88 Å²	88	88.8 Å²	88.8	46%	0.461	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	109.8	178.7	-66.4	169.1	0	0	0	109.4	E99 C109	E99-L101 HydrophobicContact CG-CD2 4.21Å; E99-L101 HydrophobicContact CG-CG 4.46Å; L101-C109 HydrophobicContact CB-CB 4.43Å; L101-C109 PolarHBondContact N-O 3.47Å; L101-C109 PolarHBondContact O-N 2.82Å
102	E	67.6	Low	54.4	Low	127 Å²	127	85.1 Å²	85.1	59%	0.593	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.6	169	-74.8	-174.7	-177.9	0	0	109.2	L108 K129	E102-L108 HydrophobicContact CG-CD1 3.67Å; E102-K129 IonicContact OE1-NZ 2.81Å; E102-K129 PolarHBondContact OE1-NZ 2.97Å
103	L	66.3	Low	55.2	Low	64 Å²	64	82.8 Å²	82.8	34%	0.335	44%	0.435	S	S	.	.			trans	-92.1	157.3	179	-63.8	176.6	0	0	0	111.4	L63 N105 G106 C107	L63-L103 HydrophobicContact CB-CD1 3.6Å; L63-L103 HydrophobicContact CD1-CD1 4.36Å; L63-L103 HydrophobicContact CD2-CD1 3.73Å; L63-L103 HydrophobicContact CG-CD1 4.09Å; L63-L103 VanDerWaalsContact O-CD1 3.28Å; L63-L103 WeakPolarHBondContact O-CD1 3.26Å; L103-N105 VanDerWaalsContact CB-OD1 3.22Å; L103-N105 WeakPolarHBondContact CB-OD1 3.42Å; L103-N105 PolarHBondContact O-N 3.35Å; L103-G106 PolarHBondContact O-N 3.48Å; L103-C107 HydrophobicContact CB-CB 4.38Å; L103-C107 HydrophobicContact CD1-CB 4.21Å; L103-C107 PolarHBondContact N-O 3.06Å
104	R	58.6	Low	56.1	Low	268 Å²	268	82.7 Å²	82.7	100%	1.011	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.8	-176.5	-66.1	-176	-178.9	-177.7	1.3	113.9	G106	R104-G106 VanDerWaalsContact C-N 3.26Å
105	N	64.1	Low	57.2	Low	41 Å²	41	81.4 Å²	81.4	22%	0.219	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	3.3	174.9	63.7	-12.4	0	0	0	113.3	L63 E65 L103 C107	L63-N105 PolarHBondContact O-ND2 3.21Å; L63-N105 PolarHBondContact O-OD1 3.03Å; E65-N105 PolarHBondContact O-ND2 3.05Å; E65-N105 VanDerWaalsContact O-ND2 3.16Å; L103-N105 VanDerWaalsContact CB-OD1 3.22Å; L103-N105 WeakPolarHBondContact CB-OD1 3.42Å; L103-N105 PolarHBondContact O-N 3.35Å; N105-C107 WeakPolarHBondContact OD1-CB 3.49Å; N105-C107 PolarHBondContact OD1-N 3.46Å
106	G	62.4	Low	58.9	Low	37 Å²	37	75 Å²	75	38%	0.381	37%	0.366	S	S	.	.	S	Bend	trans	84.4	7.7	-179.8	0	0	0	0	0	114.2	L103 R104	L103-G106 PolarHBondContact O-N 3.48Å; R104-G106 VanDerWaalsContact C-N 3.26Å
107	C	67.6	Low	60.5	Low	1 Å²	1	70.8 Å²	70.8	1%	0.007	34%	0.343	C	S	.	.			trans	-78.7	153	171.1	-67.8	0	0	0	0	111.5	L63 V71 L103 N105	L63-C107 HydrophobicContact CD2-CB 3.68Å; V71-C107 CarbonylContact O-C 3.57Å; V71-C107 WeakPolarHBondContact O-CA 3.3Å; V71-C107 VanDerWaalsContact O-CB 3.28Å; V71-C107 WeakPolarHBondContact O-CB 3.33Å; L103-C107 HydrophobicContact CB-CB 4.38Å; L103-C107 HydrophobicContact CD1-CB 4.21Å; L103-C107 PolarHBondContact N-O 3.06Å; N105-C107 WeakPolarHBondContact OD1-CB 3.49Å; N105-C107 PolarHBondContact OD1-N 3.46Å
108	L	74.5	Confident	62.3	Low	8 Å²	8	68.7 Å²	68.7	4%	0.042	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124	-178.2	-177.6	69.3	0	0	0	109	V71 A72 V73 W100 E102 L123 K126	V71-L108 PolarHBondContact O-N 3.24Å; A72-L108 CarbonylContact C-O 3.6Å; A72-L108 VanDerWaalsContact CA-O 3.25Å; A72-L108 WeakPolarHBondContact CA-O 3.3Å; A72-L108 HydrophobicContact CB-CB 4.38Å; V73-L108 PolarHBondContact N-O 2.78Å; W100-L108 HydrophobicContact CB-CD1 4.35Å; W100-L108 HydrophobicContact CE3-CD1 3.82Å; W100-L108 HydrophobicContact CE3-CD2 3.61Å; W100-L108 HydrophobicContact CE3-CG 3.62Å; W100-L108 HydrophobicContact CZ3-CD2 3.63Å; W100-L108 HydrophobicContact CZ3-CG 3.93Å; E102-L108 HydrophobicContact CG-CD1 3.67Å; L108-L123 HydrophobicContact CD2-CD1 3.56Å; L108-K126 HydrophobicContact CD2-CD 4.43Å
109	C	61.2	Low	63.5	Low	16 Å²	16	63.8 Å²	63.8	11%	0.108	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.7	177.1	-174.2	0	0	0	0	110.7	L63 V73 L101	L63-C109 HydrophobicContact CD1-CB 4.35Å; V73-C109 WeakPolarHBondContact O-CA 3.41Å; L101-C109 HydrophobicContact CB-CB 4.43Å; L101-C109 PolarHBondContact N-O 3.47Å; L101-C109 PolarHBondContact O-N 2.82Å
110	C	69	Low	64.6	Low	1 Å²	1	59 Å²	59	1%	0.007	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.4	172.8	-165.8	0	0	0	0	111.1	V73 L75 W100 V112	V73-C110 PolarHBondContact O-N 2.8Å; L75-C110 PolarHBondContact N-O 2.89Å; W100-C110 HydrophobicContact CD2-CB 4.05Å; W100-C110 HydrophobicContact CE3-CB 3.55Å; W100-C110 HydrophobicContact CH2-CB 3.67Å; W100-C110 HydrophobicContact CZ2-CB 4.15Å; W100-C110 HydrophobicContact CZ3-CB 3.35Å; C110-V112 HydrophobicContact CB-CG2 4.24Å; C110-V112 WeakPolarHBondContact SG-CG2 3.49Å
111	S	61.5	Low	65.4	Low	62 Å²	62	60.6 Å²	60.6	43%	0.434	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119	166.4	-172.5	0	0	0	0	108.1
112	V	59.6	Low	66.1	Low	6 Å²	6	58.5 Å²	58.5	4%	0.036	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.6	-176.1	-170.9	0	0	0	0	110.4	L75 C110 D114 A119	L75-V112 PolarHBondContact O-N 2.8Å; C110-V112 HydrophobicContact CB-CG2 4.24Å; C110-V112 WeakPolarHBondContact SG-CG2 3.49Å; V112-D114 HydrophobicContact CG1-CB 3.93Å; V112-A119 HydrophobicContact CB-CB 3.92Å; V112-A119 HydrophobicContact CG1-CB 3.9Å; V112-A119 HydrophobicContact CG2-CB 3.62Å
113	K	51.1	Low	66.7	Low	150 Å²	150	52.5 Å²	52.5	65%	0.652	26%	0.26	S	S	*	.	S	Bend	trans	-90.1	-18.5	176.5	-142.1	-177.4	-175.2	-173.8	0	112.9	L96	L96-K113 HydrophobicContact CD1-CD 4.3Å
114	D	52.4	Low	67.4	Low	66 Å²	66	50.8 Å²	50.8	35%	0.353	25%	0.251	S	S	.	.	S	Bend	trans	-87.9	161.2	179.9	-81.6	1.9	0	0	0	112.1	V112 G116 R118	V112-D114 HydrophobicContact CG1-CB 3.93Å; D114-G116 PolarHBondContact O-N 2.7Å; D114-R118 HydrophobicContact CB-CB 4.37Å; D114-R118 IonicContact OD2-CZ 3.63Å; D114-R118 IonicContact OD2-NH1 3.68Å; D114-R118 PolarHBondContact OD2-NH1 3.19Å
115	S	59.2	Low	68.5	Low	62 Å²	62	45.5 Å²	45.5	43%	0.434	24%	0.238	S	C	.	.			trans	-48	127.3	173.6	58.7	0	0	0	0	110.9	L117 R118	S115-L117 PolarHBondContact O-N 2.99Å; S115-R118 PolarHBondContact O-N 3.41Å
116	G	63.3	Low	69.3	Low	1 Å²	1	46.7 Å²	46.7	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-55.2	-15.3	-173.2	0	0	0	0	0	116.7	N76 D114 A119 I120	N76-G116 WeakPolarHBondContact ND2-CA 3.27Å; N76-G116 PolarHBondContact ND2-N 3.13Å; D114-G116 PolarHBondContact O-N 2.7Å; G116-A119 WeakPolarHBondContact O-CB 3.44Å; G116-A119 PolarHBondContact O-N 3.49Å; G116-I120 WeakPolarHBondContact O-CD1 3.35Å; G116-I120 WeakPolarHBondContact O-CG1 3.34Å; G116-I120 PolarHBondContact O-N 3.07Å
117	L	68.3	Low	70.2	Confident	47 Å²	47	49.5 Å²	49.5	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-54.8	-52.8	164.2	-76.9	171.8	0	0	0	112.2	S115 A119 I120 E121 M149 L156	S115-L117 PolarHBondContact O-N 2.99Å; L117-A119 VanDerWaalsContact C-N 3.28Å; L117-A119 PolarHBondContact O-N 2.97Å; L117-I120 PolarHBondContact O-N 3.39Å; L117-I120 VanDerWaalsContact O-N 3.09Å; L117-E121 WeakPolarHBondContact O-CG 3.45Å; L117-E121 PolarHBondContact O-N 3.29Å; L117-M149 HydrophobicContact CD1-CG 4.27Å; L117-M149 HydrophobicContact CD1-SD 4.3Å; L117-M149 HydrophobicContact CD2-CB 3.74Å; L117-M149 HydrophobicContact CD2-CG 4.27Å; L117-M149 HydrophobicContact CD2-SD 4.34Å; L117-M149 HydrophobicContact CG-CB 4.19Å; L117-M149 HydrophobicContact CG-CG 4.16Å; L117-M149 HydrophobicContact CG-SD 3.82Å; L117-L156 HydrophobicContact CD2-CD1 3.34Å
118	R	71.3	Confident	70.8	Confident	133 Å²	133	51.7 Å²	51.7	50%	0.502	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-36	179	-63.1	-177.8	119.8	-168.8	5.4	111.9	D114 S115 I120 E121 N122	D114-R118 HydrophobicContact CB-CB 4.37Å; D114-R118 IonicContact OD2-CZ 3.63Å; D114-R118 IonicContact OD2-NH1 3.68Å; D114-R118 PolarHBondContact OD2-NH1 3.19Å; S115-R118 PolarHBondContact O-N 3.41Å; R118-I120 VanDerWaalsContact C-N 3.31Å; R118-I120 PolarHBondContact O-N 3.12Å; R118-E121 PolarHBondContact O-N 3.33Å; R118-N122 VanDerWaalsContact O-CB 3.31Å; R118-N122 WeakPolarHBondContact O-CB 2.82Å; R118-N122 VanDerWaalsContact O-CG 3.25Å; R118-N122 PolarHBondContact O-N 3.49Å
119	A	75.1	Confident	71.2	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-44.1	174.5	0	0	0	0	0	111.2	I74 V112 G116 L117 L123	I74-A119 HydrophobicContact CD1-CB 4.15Å; I74-A119 HydrophobicContact CG2-CB 3.77Å; V112-A119 HydrophobicContact CB-CB 3.92Å; V112-A119 HydrophobicContact CG1-CB 3.9Å; V112-A119 HydrophobicContact CG2-CB 3.62Å; G116-A119 WeakPolarHBondContact O-CB 3.44Å; G116-A119 PolarHBondContact O-N 3.49Å; L117-A119 VanDerWaalsContact C-N 3.28Å; L117-A119 PolarHBondContact O-N 2.97Å; A119-L123 VanDerWaalsContact O-CB 3.27Å; A119-L123 WeakPolarHBondContact O-CB 3.09Å; A119-L123 PolarHBondContact O-N 3.23Å
120	I	78.1	Confident	72.4	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-69.9	-45.3	178.2	-64.1	162.5	0	0	0	110.5	I74 G116 L117 R118 N122 L123 M124 L135 F150 L156 I160	I74-I120 HydrophobicContact CD1-CB 4.47Å; I74-I120 HydrophobicContact CD1-CG1 3.59Å; G116-I120 WeakPolarHBondContact O-CD1 3.35Å; G116-I120 WeakPolarHBondContact O-CG1 3.34Å; G116-I120 PolarHBondContact O-N 3.07Å; L117-I120 PolarHBondContact O-N 3.39Å; L117-I120 VanDerWaalsContact O-N 3.09Å; R118-I120 VanDerWaalsContact C-N 3.31Å; R118-I120 PolarHBondContact O-N 3.12Å; I120-N122 VanDerWaalsContact C-N 3.33Å; I120-N122 PolarHBondContact O-N 2.83Å; I120-L123 CarbonylContact O-C 3.55Å; I120-L123 WeakPolarHBondContact O-CB 3.31Å; I120-L123 PolarHBondContact O-N 3.14Å; I120-L123 VanDerWaalsContact O-N 3.12Å; I120-M124 HydrophobicContact CG2-CG 4.23Å; I120-M124 WeakPolarHBondContact O-CB 3.15Å; I120-M124 VanDerWaalsContact O-CG 3.26Å; I120-M124 WeakPolarHBondContact O-CG 3.32Å; I120-M124 PolarHBondContact O-N 2.93Å; I120-L135 HydrophobicContact CD1-CD2 4.49Å; I120-F150 HydrophobicContact CD1-CE1 3.75Å; I120-F150 HydrophobicContact CD1-CZ 3.55Å; I120-L156 HydrophobicContact CB-CD2 4.16Å; I120-L156 HydrophobicContact CG2-CD2 3.38Å; I120-I160 HydrophobicContact CG2-CD1 3.44Å; I120-I160 VanDerWaalsContact CG2-CD1 3.44Å
121	E	78.5	Confident	73.1	Confident	89 Å²	89	59.5 Å²	59.5	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-55.7	-47	175.7	-72	171.7	173.1	0	0	111.9	L117 R118 L123 M124 Q125	L117-E121 WeakPolarHBondContact O-CG 3.45Å; L117-E121 PolarHBondContact O-N 3.29Å; R118-E121 PolarHBondContact O-N 3.33Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-L123 PolarHBondContact O-N 3.29Å; E121-M124 PolarHBondContact O-N 3.11Å; E121-Q125 PolarHBondContact O-N 3.22Å
122	N	77.4	Confident	74.3	Confident	44 Å²	44	58.3 Å²	58.3	24%	0.235	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-39.6	176.5	-74.2	-13.7	0	0	0	111.8	W100 R118 I120 M124 Q125	W100-N122 HydrophobicContact CZ2-CB 4.32Å; R118-N122 VanDerWaalsContact O-CB 3.31Å; R118-N122 WeakPolarHBondContact O-CB 2.82Å; R118-N122 VanDerWaalsContact O-CG 3.25Å; R118-N122 PolarHBondContact O-N 3.49Å; I120-N122 VanDerWaalsContact C-N 3.33Å; I120-N122 PolarHBondContact O-N 2.83Å; N122-M124 VanDerWaalsContact C-N 3.32Å; N122-M124 PolarHBondContact O-N 3.13Å; N122-Q125 WeakPolarHBondContact O-CB 3.44Å; N122-Q125 PolarHBondContact O-N 3.32Å
123	L	80.3	Confident	75.6	Confident	1 Å²	1	58 Å²	58	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-39.9	175.3	179.8	60.8	0	0	0	111.4	A72 I74 W100 L108 A119 I120 E121 Q125 K126 F130 I133	A72-L123 HydrophobicContact CB-CD1 3.7Å; A72-L123 HydrophobicContact CB-CD2 3.6Å; A72-L123 HydrophobicContact CB-CG 4.23Å; I74-L123 HydrophobicContact CD1-CD2 3.87Å; I74-L123 HydrophobicContact CG1-CD2 4.14Å; W100-L123 HydrophobicContact CH2-CB 3.94Å; W100-L123 HydrophobicContact CH2-CD1 3.91Å; W100-L123 HydrophobicContact CZ3-CD1 3.71Å; L108-L123 HydrophobicContact CD2-CD1 3.56Å; A119-L123 VanDerWaalsContact O-CB 3.27Å; A119-L123 WeakPolarHBondContact O-CB 3.09Å; A119-L123 PolarHBondContact O-N 3.23Å; I120-L123 CarbonylContact O-C 3.55Å; I120-L123 WeakPolarHBondContact O-CB 3.31Å; I120-L123 PolarHBondContact O-N 3.14Å; I120-L123 VanDerWaalsContact O-N 3.12Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-L123 PolarHBondContact O-N 3.29Å; L123-Q125 PolarHBondContact O-N 2.97Å; L123-K126 WeakPolarHBondContact O-CA 3.36Å; L123-K126 WeakPolarHBondContact O-CB 3.44Å; L123-K126 PolarHBondContact O-N 2.79Å; L123-F130 HydrophobicContact CD1-CD1 3.88Å; L123-F130 HydrophobicContact CD1-CE1 3.47Å; L123-F130 VanDerWaalsContact CD1-CE1 3.47Å; L123-F130 HydrophobicContact CD1-CZ 3.87Å; L123-F130 HydrophobicContact CD2-CE2 4.28Å; L123-F130 HydrophobicContact CD2-CZ 4.18Å; L123-F130 HydrophobicContact CG-CD1 4.45Å; L123-F130 HydrophobicContact CG-CE1 3.71Å; L123-F130 HydrophobicContact CG-CE2 4.13Å; L123-F130 HydrophobicContact CG-CZ 3.54Å; L123-F130 VanDerWaalsContact O-CE1 3.3Å; L123-F130 WeakPolarHBondContact O-CE1 2.98Å; L123-F130 WeakPolarHBondContact O-CZ 3.45Å; L123-I133 HydrophobicContact CD2-CD1 3.74Å; L123-I133 HydrophobicContact CD2-CG1 3.84Å; L123-I133 HydrophobicContact CD2-CG2 3.97Å
124	M	81.9	Confident	77.3	Confident	29 Å²	29	51.4 Å²	51.4	14%	0.143	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-22.3	179.7	-71.2	-54.2	-61.7	0	0	113.3	I42 I120 E121 N122 K126 K127 F130 I133 D159 I160	I42-M124 HydrophobicContact CD1-CE 4.26Å; I42-M124 HydrophobicContact CD1-SD 4.22Å; I120-M124 HydrophobicContact CG2-CG 4.23Å; I120-M124 WeakPolarHBondContact O-CB 3.15Å; I120-M124 VanDerWaalsContact O-CG 3.26Å; I120-M124 WeakPolarHBondContact O-CG 3.32Å; I120-M124 PolarHBondContact O-N 2.93Å; E121-M124 PolarHBondContact O-N 3.11Å; N122-M124 VanDerWaalsContact C-N 3.32Å; N122-M124 PolarHBondContact O-N 3.13Å; M124-K126 PolarHBondContact O-N 3.49Å; M124-K126 VanDerWaalsContact O-N 3.14Å; M124-K127 HydrophobicContact CE-CB 4.37Å; M124-K127 HydrophobicContact CE-CD 3.85Å; M124-K127 HydrophobicContact CE-CG 4.14Å; M124-K127 VanDerWaalsContact O-CB 3.26Å; M124-K127 WeakPolarHBondContact O-CB 3.1Å; M124-K127 PolarHBondContact O-N 2.79Å; M124-F130 HydrophobicContact SD-CE2 4.37Å; M124-F130 HydrophobicContact SD-CZ 4.11Å; M124-I133 HydrophobicContact SD-CD1 4.4Å; M124-D159 HydrophobicContact CE-CB 3.61Å; M124-I160 HydrophobicContact CE-CG2 3.86Å; M124-I160 HydrophobicContact CG-CG2 4.33Å; M124-I160 HydrophobicContact SD-CG2 3.43Å; M124-I160 WeakPolarHBondContact SD-CG2 3.49Å
125	Q	82.1	Confident	78.8	Confident	156 Å²	156	48.3 Å²	48.3	73%	0.729	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.3	168.6	-61.5	175.5	19	0	0	112.8	E121 N122 L123	E121-Q125 PolarHBondContact O-N 3.22Å; N122-Q125 WeakPolarHBondContact O-CB 3.44Å; N122-Q125 PolarHBondContact O-N 3.32Å; L123-Q125 PolarHBondContact O-N 2.97Å
126	K	79.5	Confident	79.9	Confident	66 Å²	66	46.4 Å²	46.4	29%	0.287	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	20.8	176.6	-62	-175.1	-178.2	170.7	0	113.1	L108 L123 M124 G128 K129 F130	L108-K126 HydrophobicContact CD2-CD 4.43Å; L123-K126 WeakPolarHBondContact O-CA 3.36Å; L123-K126 WeakPolarHBondContact O-CB 3.44Å; L123-K126 PolarHBondContact O-N 2.79Å; M124-K126 PolarHBondContact O-N 3.49Å; M124-K126 VanDerWaalsContact O-N 3.14Å; K126-G128 PolarHBondContact O-N 2.92Å; K126-K129 HydrophobicContact CB-CD 4.46Å; K126-K129 WeakPolarHBondContact O-CB 3.48Å; K126-K129 PolarHBondContact O-N 2.97Å; K126-K129 VanDerWaalsContact O-N 3.16Å; K126-F130 HydrophobicContact CB-CE1 4.39Å
127	K	81.3	Confident	80.3	Confident	96 Å²	96	46.3 Å²	46.3	42%	0.417	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	133.6	176.5	-170.3	178.7	-170.1	178.4	0	111.2	I42 M124 D159	I42-K127 HydrophobicContact CD1-CG 4.13Å; M124-K127 HydrophobicContact CE-CB 4.37Å; M124-K127 HydrophobicContact CE-CD 3.85Å; M124-K127 HydrophobicContact CE-CG 4.14Å; M124-K127 VanDerWaalsContact O-CB 3.26Å; M124-K127 WeakPolarHBondContact O-CB 3.1Å; M124-K127 PolarHBondContact O-N 2.79Å; K127-D159 IonicContact NZ-OD1 3.19Å; K127-D159 PolarHBondContact NZ-OD1 3.43Å; K127-D159 IonicContact NZ-OD2 3.37Å; K127-D159 PolarHBondContact NZ-OD2 3.47Å
128	G	81.9	Confident	80.2	Confident	48 Å²	48	45.3 Å²	45.3	50%	0.495	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.9	-13.4	-176.4	0	0	0	0	0	114.9	R70 K126	R70-G128 PolarHBondContact NH1-O 2.86Å; R70-G128 PolarHBondContact NH2-O 2.84Å; K126-G128 PolarHBondContact O-N 2.92Å
129	K	82.9	Confident	79.6	Confident	106 Å²	106	39.2 Å²	39.2	46%	0.461	20%	0.198	S	C	.	.	S	Bend	trans	-83.4	-23.1	169.2	-73.8	-166.4	165.8	-166	0	113.9	R70 E102 K126	R70-K129 WeakPolarHBondContact CD-O 3.11Å; E102-K129 IonicContact OE1-NZ 2.81Å; E102-K129 PolarHBondContact OE1-NZ 2.97Å; K126-K129 HydrophobicContact CB-CD 4.46Å; K126-K129 WeakPolarHBondContact O-CB 3.48Å; K126-K129 PolarHBondContact O-N 2.97Å; K126-K129 VanDerWaalsContact O-N 3.16Å
130	F	85.6	Confident	78.6	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.018	21%	0.214	C	C	.	.			trans	-133.8	156.6	-179.8	57.6	-86.1	0	0	0	109.9	I42 R70 A72 L123 M124 K126 I133	I42-F130 HydrophobicContact CD1-CD2 4.02Å; I42-F130 HydrophobicContact CD1-CE2 3.42Å; I42-F130 VanDerWaalsContact CD1-CE2 3.42Å; I42-F130 HydrophobicContact CD1-CZ 4.06Å; I42-F130 HydrophobicContact CG2-CD2 4.16Å; I42-F130 HydrophobicContact CG2-CE2 4.08Å; R70-F130 CarbonylContact O-C 3.53Å; R70-F130 WeakPolarHBondContact O-CA 3.27Å; R70-F130 WeakPolarHBondContact O-CB 3.46Å; A72-F130 HydrophobicContact CB-CB 3.95Å; A72-F130 HydrophobicContact CB-CD1 4.18Å; A72-F130 HydrophobicContact CB-CD2 3.97Å; A72-F130 HydrophobicContact CB-CG 3.75Å; L123-F130 HydrophobicContact CD1-CD1 3.88Å; L123-F130 HydrophobicContact CD1-CE1 3.47Å; L123-F130 VanDerWaalsContact CD1-CE1 3.47Å; L123-F130 HydrophobicContact CD1-CZ 3.87Å; L123-F130 HydrophobicContact CD2-CE2 4.28Å; L123-F130 HydrophobicContact CD2-CZ 4.18Å; L123-F130 HydrophobicContact CG-CD1 4.45Å; L123-F130 HydrophobicContact CG-CE1 3.71Å; L123-F130 HydrophobicContact CG-CE2 4.13Å; L123-F130 HydrophobicContact CG-CZ 3.54Å; L123-F130 VanDerWaalsContact O-CE1 3.3Å; L123-F130 WeakPolarHBondContact O-CE1 2.98Å; L123-F130 WeakPolarHBondContact O-CZ 3.45Å; M124-F130 HydrophobicContact SD-CE2 4.37Å; M124-F130 HydrophobicContact SD-CZ 4.11Å; K126-F130 HydrophobicContact CB-CE1 4.39Å; F130-I133 HydrophobicContact CD2-CG1 3.95Å; F130-I133 HydrophobicContact CE2-CD1 3.81Å; F130-I133 HydrophobicContact CE2-CG1 3.72Å
131	D	84.6	Confident	77.8	Confident	78 Å²	78	42.4 Å²	42.4	42%	0.417	22%	0.217	S	C	.	.	S	Bend	trans	-118	-6.4	-177.6	-53.1	-55	0	0	0	112.1	P43 R70	P43-D131 WeakPolarHBondContact CD-O 3.1Å; R70-D131 IonicContact CZ-OD1 3.77Å; R70-D131 IonicContact CZ-OD2 2.76Å; R70-D131 IonicContact NE-OD1 3.6Å; R70-D131 IonicContact NE-OD2 2.78Å; R70-D131 PolarHBondContact NE-OD2 2.84Å; R70-D131 VanDerWaalsContact NH2-CG 3.29Å; R70-D131 IonicContact NH2-OD1 2.69Å; R70-D131 PolarHBondContact NH2-OD1 2.99Å; R70-D131 IonicContact NH2-OD2 3.13Å; R70-D131 PolarHBondContact NH2-OD2 3.41Å; R70-D131 VanDerWaalsContact NH2-OD2 3.13Å; R70-D131 PolarHBondContact O-N 3.28Å
132	Y	85.9	Confident	77	Confident	38 Å²	38	40.6 Å²	40.6	15%	0.149	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	143.2	-174.7	-159.7	-81.6	0	0	0	110.2	P43 T45 R70 V71 A72 L134 D163	P43-Y132 HydrophobicContact CB-CD2 3.96Å; P43-Y132 HydrophobicContact CB-CE2 3.69Å; P43-Y132 HydrophobicContact CG-CD2 3.26Å; P43-Y132 HydrophobicContact CG-CE2 3.51Å; P43-Y132 HydrophobicContact CG-CG 4.06Å; T45-Y132 WeakPolarHBondContact CB-OH 3.38Å; T45-Y132 PolarHBondContact OG1-OH 2.9Å; R70-Y132 PolarHBondContact O-N 2.79Å; V71-Y132 WeakPolarHBondContact CA-O 3.45Å; V71-Y132 HydrophobicContact CG1-CD1 4.33Å; A72-Y132 PolarHBondContact N-O 2.81Å; Y132-L134 HydrophobicContact CD1-CD2 4.28Å; Y132-L134 HydrophobicContact CD1-CG 4.19Å; Y132-L134 HydrophobicContact CE1-CD2 3.69Å; Y132-L134 HydrophobicContact CE1-CG 4.11Å; Y132-D163 PolarHBondContact OH-OD2 3.03Å
133	I	87.3	Confident	76.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.7	175.6	-54.6	174	0	0	0	109.9	I42 P43 V44 T45 A72 I74 L123 M124 F130 I160	I42-I133 HydrophobicContact CG2-CD1 4.15Å; I42-I133 HydrophobicContact CG2-CG1 3.86Å; P43-I133 PolarHBondContact O-N 2.95Å; V44-I133 CarbonylContact C-O 3.6Å; V44-I133 WeakPolarHBondContact CA-O 3.36Å; V44-I133 HydrophobicContact CB-CB 4.33Å; V44-I133 HydrophobicContact CG1-CB 4.09Å; V44-I133 HydrophobicContact CG1-CG2 3.99Å; V44-I133 HydrophobicContact CG2-CB 3.97Å; V44-I133 HydrophobicContact CG2-CD1 3.97Å; V44-I133 HydrophobicContact CG2-CG1 4.4Å; T45-I133 PolarHBondContact N-O 2.69Å; A72-I133 HydrophobicContact CB-CG1 4.49Å; A72-I133 CarbonylContact O-C 3.53Å; A72-I133 VanDerWaalsContact O-CA 3.3Å; A72-I133 WeakPolarHBondContact O-CA 3.37Å; I74-I133 HydrophobicContact CD1-CG2 4.16Å; L123-I133 HydrophobicContact CD2-CD1 3.74Å; L123-I133 HydrophobicContact CD2-CG1 3.84Å; L123-I133 HydrophobicContact CD2-CG2 3.97Å; M124-I133 HydrophobicContact SD-CD1 4.4Å; F130-I133 HydrophobicContact CD2-CG1 3.95Å; F130-I133 HydrophobicContact CE2-CD1 3.81Å; F130-I133 HydrophobicContact CE2-CG1 3.72Å; I133-I160 HydrophobicContact CD1-CG2 4.31Å
134	L	85.8	Confident	75.7	Confident	10 Å²	10	39 Å²	39	5%	0.052	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.9	166.7	-71.2	175.8	0	0	0	109.2	T45 I47 L59 I62 V71 A72 V73 I74 Y132	T45-L134 HydrophobicContact CG2-CD2 4.01Å; T45-L134 WeakPolarHBondContact O-CA 3.18Å; I47-L134 HydrophobicContact CD1-CD1 4.36Å; I47-L134 HydrophobicContact CD1-CD2 4.01Å; I47-L134 HydrophobicContact CG1-CD2 4.32Å; L59-L134 HydrophobicContact CD2-CB 4.46Å; L59-L134 HydrophobicContact CD2-CD1 4.25Å; I62-L134 HydrophobicContact CD1-CD1 3.69Å; I62-L134 HydrophobicContact CG2-CD1 3.86Å; V71-L134 HydrophobicContact CG1-CB 4.31Å; V71-L134 HydrophobicContact CG1-CD1 3.67Å; V71-L134 HydrophobicContact CG1-CG 3.77Å; A72-L134 PolarHBondContact O-N 3.28Å; V73-L134 CarbonylContact C-O 3.59Å; V73-L134 WeakPolarHBondContact CA-O 3.36Å; V73-L134 HydrophobicContact CG2-CB 4.1Å; V73-L134 HydrophobicContact CG2-CD1 4.27Å; I74-L134 PolarHBondContact N-O 2.88Å; Y132-L134 HydrophobicContact CD1-CD2 4.28Å; Y132-L134 HydrophobicContact CD1-CG 4.19Å; Y132-L134 HydrophobicContact CE1-CD2 3.69Å; Y132-L134 HydrophobicContact CE1-CG 4.11Å
135	L	85.1	Confident	74.9	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	110.9	177.3	179.5	61.2	0	0	0	109	V44 T45 I46 I47 I74 N76 I120 V146 F150	V44-L135 HydrophobicContact CG1-CB 4.39Å; T45-L135 PolarHBondContact O-N 2.84Å; I46-L135 CarbonylContact C-O 3.39Å; I46-L135 WeakPolarHBondContact CA-O 3.43Å; I46-L135 HydrophobicContact CG1-CB 4.48Å; I46-L135 HydrophobicContact CG1-CD2 4.33Å; I47-L135 PolarHBondContact N-O 2.94Å; I74-L135 HydrophobicContact CB-CD1 3.74Å; I74-L135 HydrophobicContact CD1-CD1 4.49Å; I74-L135 HydrophobicContact CG2-CD1 3.63Å; N76-L135 HydrophobicContact CB-CD1 4.27Å; I120-L135 HydrophobicContact CD1-CD2 4.49Å; L135-V146 HydrophobicContact CD2-CG1 3.4Å; L135-V146 HydrophobicContact CG-CG1 4.49Å; L135-F150 HydrophobicContact CD2-CE2 4.37Å; L135-F150 HydrophobicContact CD2-CZ 4.22Å
136	E	82.2	Confident	74.3	Confident	22 Å²	22	32.7 Å²	32.7	10%	0.103	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	132.7	170.2	-170.6	177.9	-168.7	0	0	109.8	K55 L59 I74 L75 N76	K55-E136 WeakPolarHBondContact CB-OE1 3.49Å; L59-E136 HydrophobicContact CD1-CB 3.77Å; L59-E136 HydrophobicContact CD1-CG 3.82Å; L59-E136 WeakPolarHBondContact CD1-OE2 3.46Å; I74-E136 PolarHBondContact O-N 3.46Å; L75-E136 HydrophobicContact CD2-CB 4.46Å; L75-E136 WeakPolarHBondContact CD2-OE2 3.25Å; N76-E136 WeakPolarHBondContact CB-O 3.28Å; N76-E136 PolarHBondContact N-O 3.34Å
137	T	71.3	Confident	73.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.			trans	-104.8	145.9	167.6	66.5	0	0	0	0	109.6	I46 I47 T48 K55 V146	I46-T137 HydrophobicContact CG2-CG2 3.47Å; I46-T137 VanDerWaalsContact CG2-CG2 3.47Å; I47-T137 PolarHBondContact O-N 3.44Å; I47-T137 PolarHBondContact O-OG1 2.81Å; T48-T137 WeakPolarHBondContact CA-OG1 3.47Å; T48-T137 WeakPolarHBondContact CB-OG1 3.44Å; T48-T137 PolarHBondContact OG1-OG1 2.94Å; K55-T137 WeakPolarHBondContact CE-O 3.4Å; T137-V146 HydrophobicContact CG2-CB 4.48Å; T137-V146 HydrophobicContact CG2-CG1 4.42Å; T137-V146 HydrophobicContact CG2-CG2 4.09Å
138	T	66.9	Low	72.9	Confident	25 Å²	25	27.1 Å²	27.1	15%	0.153	16%	0.164	C	C	.	.			trans	-58.6	161.1	173.5	73.6	0	0	0	0	111.2	N76 F78 L140 A141	N76-T138 WeakPolarHBondContact O-CG2 3.26Å; F78-T138 VanDerWaalsContact N-CG2 3.33Å; F78-T138 VanDerWaalsContact O-CG2 3.3Å; F78-T138 WeakPolarHBondContact O-CG2 3.32Å; F78-T138 PolarHBondContact O-OG1 3.47Å; T138-L140 PolarHBondContact O-N 3.12Å; T138-L140 PolarHBondContact OG1-N 3.14Å; T138-A141 PolarHBondContact O-N 3.43Å; T138-A141 VanDerWaalsContact O-N 3.14Å; T138-A141 WeakPolarHBondContact OG1-CB 3.22Å; T138-A141 PolarHBondContact OG1-N 2.76Å; T138-A141 VanDerWaalsContact OG1-N 3.12Å
139	G	57.8	Low	72.1	Confident	5 Å²	5	26.8 Å²	26.8	5%	0.052	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.6	175.3	0	0	0	0	0	114.9	G49 S193	G49-G139 VanDerWaalsContact O-CA 3.29Å; G49-G139 WeakPolarHBondContact O-CA 3.41Å; G139-S193 PolarHBondContact O-OG 2.98Å
140	L	55.3	Low	71.2	Confident	64 Å²	64	22.5 Å²	22.5	34%	0.335	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-12.1	-178.7	-68	174.2	0	0	0	113.7	T138 E189 R192	T138-L140 PolarHBondContact O-N 3.12Å; T138-L140 PolarHBondContact OG1-N 3.14Å; L140-E189 HydrophobicContact CD2-CB 4.07Å; L140-E189 HydrophobicContact CD2-CG 3.37Å; L140-E189 WeakPolarHBondContact CD2-OE1 3.43Å; L140-R192 WeakPolarHBondContact O-CD 3.47Å; L140-R192 PolarHBondContact O-NH1 2.83Å
141	A	59.8	Low	70	Confident	9 Å²	9	29.2 Å²	29.2	7%	0.074	16%	0.157	C	C	.	.			trans	-74.2	141.8	-176.3	0	0	0	0	0	111.2	F78 T138 P143	F78-A141 HydrophobicContact CB-CB 4.08Å; T138-A141 PolarHBondContact O-N 3.43Å; T138-A141 VanDerWaalsContact O-N 3.14Å; T138-A141 WeakPolarHBondContact OG1-CB 3.22Å; T138-A141 PolarHBondContact OG1-N 2.76Å; T138-A141 VanDerWaalsContact OG1-N 3.12Å; A141-P143 WeakPolarHBondContact O-CD 3.44Å
142	D	62.8	Low	68.5	Low	50 Å²	50	31.2 Å²	31.2	27%	0.267	17%	0.172	S	C	.	.			trans	-84.2	112.7	171.4	-176.9	-3.6	0	0	0	109.5	G144 A145 V146	D142-G144 PolarHBondContact O-N 2.76Å; D142-G144 PolarHBondContact OD1-N 3.23Å; D142-A145 HydrophobicContact CB-CB 4.22Å; D142-A145 PolarHBondContact O-N 3.43Å; D142-V146 PolarHBondContact O-N 3.43Å
143	P	65.1	Low	67.3	Low	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-22.7	177.6	27.3	-35.9	0	0	0	112.6	T48 A141 A147 I165 I200	T48-P143 HydrophobicContact CG2-CB 4.08Å; T48-P143 HydrophobicContact CG2-CG 4.08Å; A141-P143 WeakPolarHBondContact O-CD 3.44Å; P143-A147 WeakPolarHBondContact O-CB 3.46Å; P143-A147 PolarHBondContact O-N 2.76Å; P143-I165 HydrophobicContact CB-CD1 4.4Å; P143-I165 HydrophobicContact CB-CG2 3.88Å; P143-I200 HydrophobicContact CB-CD1 4.22Å; P143-I200 HydrophobicContact CG-CD1 4.39Å
144	G	64.3	Low	65.9	Low	13 Å²	13	35.8 Å²	35.8	13%	0.134	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-43.8	175.4	0	0	0	0	0	112.7	D142 V146 A147 S148 I200	D142-G144 PolarHBondContact O-N 2.76Å; D142-G144 PolarHBondContact OD1-N 3.23Å; G144-V146 VanDerWaalsContact C-N 3.32Å; G144-V146 PolarHBondContact O-N 3.35Å; G144-A147 PolarHBondContact O-N 2.79Å; G144-S148 WeakPolarHBondContact O-CB 3.32Å; G144-S148 PolarHBondContact O-N 3.33Å; G144-I200 VanDerWaalsContact CA-CD1 3.49Å
145	A	65.4	Low	64.6	Low	48 Å²	48	43 Å²	43	40%	0.397	25%	0.245	S	C	.	.	H	α-helix	trans	-61.7	-43.1	175.4	0	0	0	0	0	111	D142 S148	D142-A145 HydrophobicContact CB-CB 4.22Å; D142-A145 PolarHBondContact O-N 3.43Å; A145-S148 PolarHBondContact O-N 2.86Å; A145-S148 PolarHBondContact O-OG 3.31Å
146	V	68.8	Low	63.6	Low	4 Å²	4	43.6 Å²	43.6	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-68.2	-42	177.8	-177.3	0	0	0	0	111.7	I46 F78 L135 T137 D142 G144 S148 M149 F150	I46-V146 HydrophobicContact CD1-CB 4.22Å; I46-V146 HydrophobicContact CD1-CG1 3.82Å; I46-V146 HydrophobicContact CG1-CG1 4.48Å; F78-V146 HydrophobicContact CD2-CG2 4.2Å; F78-V146 HydrophobicContact CE2-CG1 4.32Å; F78-V146 HydrophobicContact CE2-CG2 4.11Å; L135-V146 HydrophobicContact CD2-CG1 3.4Å; L135-V146 HydrophobicContact CG-CG1 4.49Å; T137-V146 HydrophobicContact CG2-CB 4.48Å; T137-V146 HydrophobicContact CG2-CG1 4.42Å; T137-V146 HydrophobicContact CG2-CG2 4.09Å; D142-V146 PolarHBondContact O-N 3.43Å; G144-V146 VanDerWaalsContact C-N 3.32Å; G144-V146 PolarHBondContact O-N 3.35Å; V146-S148 PolarHBondContact O-N 3.35Å; V146-M149 HydrophobicContact CB-CE 4.48Å; V146-M149 HydrophobicContact CG2-CE 4.24Å; V146-M149 WeakPolarHBondContact O-CB 3.21Å; V146-M149 PolarHBondContact O-N 3.49Å; V146-F150 HydrophobicContact CG1-CE2 4.41Å; V146-F150 WeakPolarHBondContact O-CD2 3.35Å; V146-F150 WeakPolarHBondContact O-CE2 3.41Å
147	A	68.6	Low	62.6	Low	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.4	-35.7	174.9	0	0	0	0	0	112.1	I46 P143 G144 M149 F150 W151 L162 I165 I200	I46-A147 HydrophobicContact CD1-CB 4.19Å; P143-A147 WeakPolarHBondContact O-CB 3.46Å; P143-A147 PolarHBondContact O-N 2.76Å; G144-A147 PolarHBondContact O-N 2.79Å; A147-M149 VanDerWaalsContact C-N 3.26Å; A147-M149 PolarHBondContact O-N 3.47Å; A147-F150 PolarHBondContact O-N 3.12Å; A147-W151 HydrophobicContact CB-CH2 3.89Å; A147-W151 HydrophobicContact CB-CZ3 3.94Å; A147-L162 HydrophobicContact CB-CD2 3.68Å; A147-I165 HydrophobicContact CB-CD1 3.83Å; A147-I200 HydrophobicContact CB-CD1 4.27Å
148	S	64.5	Low	62.5	Low	44 Å²	44	47 Å²	47	31%	0.308	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-29.7	-179.3	79.7	0	0	0	0	113.9	G144 A145 V146 F150 W151 V152	G144-S148 WeakPolarHBondContact O-CB 3.32Å; G144-S148 PolarHBondContact O-N 3.33Å; A145-S148 PolarHBondContact O-N 2.86Å; A145-S148 PolarHBondContact O-OG 3.31Å; V146-S148 PolarHBondContact O-N 3.35Å; S148-F150 PolarHBondContact O-N 2.81Å; S148-W151 PolarHBondContact O-N 2.89Å; S148-V152 WeakPolarHBondContact O-CG2 3.21Å; S148-V152 PolarHBondContact O-N 3.03Å
149	M	64.4	Low	63	Low	42 Å²	42	48.7 Å²	48.7	21%	0.207	29%	0.286	C	S	.	.	H	α-helix	trans	-57.2	-37.2	175.5	-64.7	175.3	-157.6	0	0	112.1	F78 L117 V146 A147 W151 D153	F78-M149 HydrophobicContact CE1-CE 4.14Å; F78-M149 HydrophobicContact CZ-CE 4.05Å; F78-M149 HydrophobicContact CZ-SD 4.29Å; L117-M149 HydrophobicContact CD1-CG 4.27Å; L117-M149 HydrophobicContact CD1-SD 4.3Å; L117-M149 HydrophobicContact CD2-CB 3.74Å; L117-M149 HydrophobicContact CD2-CG 4.27Å; L117-M149 HydrophobicContact CD2-SD 4.34Å; L117-M149 HydrophobicContact CG-CB 4.19Å; L117-M149 HydrophobicContact CG-CG 4.16Å; L117-M149 HydrophobicContact CG-SD 3.82Å; V146-M149 HydrophobicContact CB-CE 4.48Å; V146-M149 HydrophobicContact CG2-CE 4.24Å; V146-M149 WeakPolarHBondContact O-CB 3.21Å; V146-M149 PolarHBondContact O-N 3.49Å; A147-M149 VanDerWaalsContact C-N 3.26Å; A147-M149 PolarHBondContact O-N 3.47Å; M149-W151 PolarHBondContact O-N 3.33Å; M149-D153 PolarHBondContact O-N 3.01Å
150	F	64	Low	64.1	Low	16 Å²	16	48.6 Å²	48.6	7%	0.07	28%	0.284	C	S	.	.	H	α-helix	trans	-73.4	-14.9	178.8	-61.3	-87.8	0	0	0	113.6	V44 I46 I120 L135 V146 A147 S148 I160 L162	V44-F150 HydrophobicContact CB-CE1 4.03Å; V44-F150 HydrophobicContact CB-CZ 4.26Å; V44-F150 HydrophobicContact CG1-CE1 3.93Å; V44-F150 HydrophobicContact CG1-CZ 3.71Å; V44-F150 HydrophobicContact CG2-CE1 3.89Å; I46-F150 HydrophobicContact CD1-CE2 4.13Å; I120-F150 HydrophobicContact CD1-CE1 3.75Å; I120-F150 HydrophobicContact CD1-CZ 3.55Å; L135-F150 HydrophobicContact CD2-CE2 4.37Å; L135-F150 HydrophobicContact CD2-CZ 4.22Å; V146-F150 HydrophobicContact CG1-CE2 4.41Å; V146-F150 WeakPolarHBondContact O-CD2 3.35Å; V146-F150 WeakPolarHBondContact O-CE2 3.41Å; A147-F150 PolarHBondContact O-N 3.12Å; S148-F150 PolarHBondContact O-N 2.81Å; F150-I160 HydrophobicContact CD1-CD1 3.85Å; F150-I160 HydrophobicContact CD1-CG1 4.25Å; F150-I160 HydrophobicContact CE1-CD1 3.62Å; F150-I160 HydrophobicContact CE1-CG1 4.42Å; F150-L162 HydrophobicContact CB-CB 4.44Å; F150-L162 HydrophobicContact CD2-CD1 4.39Å; F150-L162 HydrophobicContact CE2-CD1 4.43Å; F150-L162 HydrophobicContact CG-CB 4.45Å
151	W	60.1	Low	65.1	Low	144 Å²	144	50.4 Å²	50.4	55%	0.545	29%	0.287	S	S	.	.	H	α-helix	trans	-97.3	-33.2	176.6	-65.4	-46.4	0	0	0	112.7	A147 S148 M149 L162	A147-W151 HydrophobicContact CB-CH2 3.89Å; A147-W151 HydrophobicContact CB-CZ3 3.94Å; S148-W151 PolarHBondContact O-N 2.89Å; M149-W151 PolarHBondContact O-N 3.33Å; W151-L162 HydrophobicContact CH2-CD2 4.35Å; W151-L162 HydrophobicContact CZ2-CD2 4.09Å
152	V	53.6	Low	65.9	Low	121 Å²	121	51.8 Å²	51.8	73%	0.733	29%	0.293	S	S	*	.	H	α-helix	trans	-76.8	-34.3	-178.6	175.7	0	0	0	0	111.7	S148 A154	S148-V152 WeakPolarHBondContact O-CG2 3.21Å; S148-V152 PolarHBondContact O-N 3.03Å; V152-A154 PolarHBondContact O-N 3.44Å
153	D	60.1	Low	66.8	Low	45 Å²	45	53.2 Å²	53.2	24%	0.241	30%	0.301	C	S	.	.			trans	-94.7	102	-175.1	-162.3	-51.1	0	0	0	111.9	M149 E155 L156 G157	M149-D153 PolarHBondContact O-N 3.01Å; D153-E155 PolarHBondContact O-N 3.33Å; D153-E155 WeakPolarHBondContact OD1-CA 3.41Å; D153-E155 WeakPolarHBondContact OD1-CB 3.12Å; D153-E155 PolarHBondContact OD1-N 3.33Å; D153-L156 HydrophobicContact CB-CB 4.07Å; D153-L156 HydrophobicContact CB-CD1 3.71Å; D153-L156 HydrophobicContact CB-CG 4.35Å; D153-L156 PolarHBondContact O-N 3.45Å; D153-L156 PolarHBondContact OD1-N 3.07Å; D153-G157 PolarHBondContact O-N 3.26Å
154	A	57.3	Low	67.3	Low	89 Å²	89	54.3 Å²	54.3	74%	0.736	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.7	179.8	0	0	0	0	0	113.3	V152 S158	V152-A154 PolarHBondContact O-N 3.44Å; A154-S158 PolarHBondContact O-N 3.02Å
155	E	60.1	Low	68	Low	162 Å²	162	55 Å²	55	76%	0.757	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-44.8	-179.8	-160.2	162.8	-163.7	0	0	109.7	D153 S158	D153-E155 PolarHBondContact O-N 3.33Å; D153-E155 WeakPolarHBondContact OD1-CA 3.41Å; D153-E155 WeakPolarHBondContact OD1-CB 3.12Å; D153-E155 PolarHBondContact OD1-N 3.33Å; E155-S158 PolarHBondContact O-N 3.36Å; E155-S158 PolarHBondContact O-OG 3.26Å
156	L	64	Low	68.7	Low	13 Å²	13	56.8 Å²	56.8	7%	0.068	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-45.4	170	-79.8	154.3	0	0	0	112	L117 I120 D153 S158 D159 I160	L117-L156 HydrophobicContact CD2-CD1 3.34Å; I120-L156 HydrophobicContact CB-CD2 4.16Å; I120-L156 HydrophobicContact CG2-CD2 3.38Å; D153-L156 HydrophobicContact CB-CB 4.07Å; D153-L156 HydrophobicContact CB-CD1 3.71Å; D153-L156 HydrophobicContact CB-CG 4.35Å; D153-L156 PolarHBondContact O-N 3.45Å; D153-L156 PolarHBondContact OD1-N 3.07Å; L156-S158 PolarHBondContact O-N 2.99Å; L156-D159 PolarHBondContact O-N 3.19Å; L156-D159 VanDerWaalsContact O-N 3.13Å; L156-I160 HydrophobicContact CB-CD1 4.37Å; L156-I160 HydrophobicContact CB-CG1 4.44Å; L156-I160 HydrophobicContact CD2-CD1 3.49Å; L156-I160 VanDerWaalsContact CD2-CD1 3.49Å; L156-I160 HydrophobicContact CD2-CG1 4.31Å; L156-I160 VanDerWaalsContact O-CG1 3.3Å; L156-I160 WeakPolarHBondContact O-CG1 3.31Å; L156-I160 PolarHBondContact O-N 2.95Å; L156-I160 VanDerWaalsContact O-N 3.07Å
157	G	59.8	Low	69.2	Low	25 Å²	25	58 Å²	58	26%	0.258	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-14.9	-178.4	0	0	0	0	0	115.1	K41 D153	K41-G157 WeakPolarHBondContact CE-O 3.49Å; K41-G157 PolarHBondContact NZ-O 2.86Å; D153-G157 PolarHBondContact O-N 3.26Å
158	S	69.6	Low	69.6	Low	68 Å²	68	59.3 Å²	59.3	48%	0.476	33%	0.329	S	S	.	.	H	α-helix	trans	-77.2	-34.8	177.2	74.1	0	0	0	0	113.2	K41 A154 E155 L156	K41-S158 WeakPolarHBondContact CE-O 3.33Å; A154-S158 PolarHBondContact O-N 3.02Å; E155-S158 PolarHBondContact O-N 3.36Å; E155-S158 PolarHBondContact O-OG 3.26Å; L156-S158 PolarHBondContact O-N 2.99Å
159	D	78.1	Confident	70.1	Confident	61 Å²	61	60.5 Å²	60.5	33%	0.326	33%	0.334	S	S	.	.	H	α-helix	trans	-111.9	-22.8	-169.7	-87.1	-21.9	0	0	0	114.2	K41 I42 M124 K127 L156	K41-D159 CarbonylContact C-O 3.57Å; K41-D159 VanDerWaalsContact CA-O 3.26Å; K41-D159 WeakPolarHBondContact CA-O 3.38Å; I42-D159 PolarHBondContact N-O 2.87Å; M124-D159 HydrophobicContact CE-CB 3.61Å; K127-D159 IonicContact NZ-OD1 3.19Å; K127-D159 PolarHBondContact NZ-OD1 3.43Å; K127-D159 IonicContact NZ-OD2 3.37Å; K127-D159 PolarHBondContact NZ-OD2 3.47Å; L156-D159 PolarHBondContact O-N 3.19Å; L156-D159 VanDerWaalsContact O-N 3.13Å
160	I	80.8	Confident	70.6	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	164.6	179.2	70.8	-179.7	0	0	0	110.9	I42 V44 I120 M124 I133 F150 L156	I42-I160 HydrophobicContact CB-CG2 4.09Å; I42-I160 VanDerWaalsContact O-CA 3.22Å; I42-I160 WeakPolarHBondContact O-CA 3.3Å; I42-I160 WeakPolarHBondContact O-CB 3.48Å; V44-I160 HydrophobicContact CG2-CB 3.99Å; V44-I160 HydrophobicContact CG2-CD1 3.99Å; V44-I160 HydrophobicContact CG2-CG1 4.31Å; I120-I160 HydrophobicContact CG2-CD1 3.44Å; I120-I160 VanDerWaalsContact CG2-CD1 3.44Å; M124-I160 HydrophobicContact CE-CG2 3.86Å; M124-I160 HydrophobicContact CG-CG2 4.33Å; M124-I160 HydrophobicContact SD-CG2 3.43Å; M124-I160 WeakPolarHBondContact SD-CG2 3.49Å; I133-I160 HydrophobicContact CD1-CG2 4.31Å; F150-I160 HydrophobicContact CD1-CD1 3.85Å; F150-I160 HydrophobicContact CD1-CG1 4.25Å; F150-I160 HydrophobicContact CE1-CD1 3.62Å; F150-I160 HydrophobicContact CE1-CG1 4.42Å; L156-I160 HydrophobicContact CB-CD1 4.37Å; L156-I160 HydrophobicContact CB-CG1 4.44Å; L156-I160 HydrophobicContact CD2-CD1 3.49Å; L156-I160 VanDerWaalsContact CD2-CD1 3.49Å; L156-I160 HydrophobicContact CD2-CG1 4.31Å; L156-I160 VanDerWaalsContact O-CG1 3.3Å; L156-I160 WeakPolarHBondContact O-CG1 3.31Å; L156-I160 PolarHBondContact O-N 2.95Å; L156-I160 VanDerWaalsContact O-N 3.07Å
161	Y	76.2	Confident	70.9	Confident	103 Å²	103	65.8 Å²	65.8	40%	0.404	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149.6	171.4	70.4	-78.3	0	0	0	111	K41 I42 P43 V44 D163	K41-Y161 HydrophobicContact CB-CD1 3.59Å; K41-Y161 HydrophobicContact CB-CE1 4.15Å; I42-Y161 PolarHBondContact O-N 3.13Å; P43-Y161 HydrophobicContact CB-CE1 3.86Å; P43-Y161 HydrophobicContact CB-CE2 4.3Å; V44-Y161 PolarHBondContact N-O 2.91Å; Y161-D163 HydrophobicContact CE2-CB 4.1Å; Y161-D163 PolarHBondContact O-N 2.81Å
162	L	77.3	Confident	71.5	Confident	37 Å²	37	64.9 Å²	64.9	19%	0.194	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	110.9	172.4	-175.3	67.6	0	0	0	109.5	V44 I46 A147 F150 W151 I165	V44-L162 CarbonylContact O-C 3.56Å; I46-L162 HydrophobicContact CD1-CD1 3.62Å; I46-L162 HydrophobicContact CG1-CD1 3.71Å; A147-L162 HydrophobicContact CB-CD2 3.68Å; F150-L162 HydrophobicContact CB-CB 4.44Å; F150-L162 HydrophobicContact CD2-CD1 4.39Å; F150-L162 HydrophobicContact CE2-CD1 4.43Å; F150-L162 HydrophobicContact CG-CB 4.45Å; W151-L162 HydrophobicContact CH2-CD2 4.35Å; W151-L162 HydrophobicContact CZ2-CD2 4.09Å; L162-I165 HydrophobicContact CD1-CG1 4.38Å; L162-I165 HydrophobicContact CD2-CD1 4.34Å; L162-I165 HydrophobicContact CD2-CG1 4.37Å
163	D	80.1	Confident	72.2	Confident	80 Å²	80	64.2 Å²	64.2	43%	0.428	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-45.7	178.2	-177.9	41.7	0	0	0	110.8	P43 V44 T45 Y132 Y161	P43-D163 HydrophobicContact CB-CB 3.76Å; V44-D163 PolarHBondContact O-N 3.47Å; T45-D163 PolarHBondContact OG1-OD2 3.36Å; Y132-D163 PolarHBondContact OH-OD2 3.03Å; Y161-D163 HydrophobicContact CE2-CB 4.1Å; Y161-D163 PolarHBondContact O-N 2.81Å
164	G	75.3	Confident	72.6	Confident	23 Å²	23	62.1 Å²	62.1	24%	0.237	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	172.3	179.4	0	0	0	0	0	114.7	T45 I46	T45-G164 VanDerWaalsContact CA-O 3.3Å; T45-G164 WeakPolarHBondContact CA-O 3.4Å; I46-G164 PolarHBondContact N-O 2.86Å
165	I	79.1	Confident	73.2	Confident	28 Å²	28	64.2 Å²	64.2	14%	0.144	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.7	171.8	-49	-177.2	0	0	0	107.6	I46 T48 P143 A147 L162 L197 I200	I46-I165 HydrophobicContact CB-CB 4.35Å; I46-I165 HydrophobicContact CB-CG1 4.07Å; I46-I165 HydrophobicContact CB-CG2 3.98Å; I46-I165 HydrophobicContact CD1-CD1 4.12Å; I46-I165 HydrophobicContact CD1-CG1 4.16Å; I46-I165 HydrophobicContact CG1-CG1 4.44Å; I46-I165 HydrophobicContact CG2-CG2 4.07Å; I46-I165 CarbonylContact O-C 3.54Å; I46-I165 VanDerWaalsContact O-CA 3.31Å; I46-I165 WeakPolarHBondContact O-CA 3.13Å; T48-I165 HydrophobicContact CG2-CG2 3.99Å; P143-I165 HydrophobicContact CB-CD1 4.4Å; P143-I165 HydrophobicContact CB-CG2 3.88Å; A147-I165 HydrophobicContact CB-CD1 3.83Å; L162-I165 HydrophobicContact CD1-CG1 4.38Å; L162-I165 HydrophobicContact CD2-CD1 4.34Å; L162-I165 HydrophobicContact CD2-CG1 4.37Å; I165-L197 HydrophobicContact CB-CD2 3.6Å; I165-L197 HydrophobicContact CG2-CD2 3.34Å; I165-I200 HydrophobicContact CD1-CB 4.28Å; I165-I200 HydrophobicContact CD1-CD1 3.18Å; I165-I200 HydrophobicContact CD1-CG1 3.96Å; I165-I200 HydrophobicContact CD1-CG2 3.82Å
166	I	80.6	Confident	73.7	Confident	85 Å²	85	63.4 Å²	63.4	44%	0.436	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	117.9	-177.4	-60.6	178.2	0	0	0	107.3	T45 I46 I47 T48	T45-I166 HydrophobicContact CG2-CD1 3.67Å; T45-I166 HydrophobicContact CG2-CG1 3.84Å; I46-I166 PolarHBondContact O-N 2.8Å; I47-I166 WeakPolarHBondContact CA-O 3.49Å; T48-I166 PolarHBondContact N-O 3.36Å
167	T	79.9	Confident	73.8	Confident	30 Å²	30	65.5 Å²	65.5	18%	0.184	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.6	169.2	-67.4	0	0	0	0	110.3	T48 V169 I194 L197	T48-T167 HydrophobicContact CG2-CG2 4.42Å; T48-T167 WeakPolarHBondContact CG2-OG1 2.85Å; T48-T167 CarbonylContact O-C 3.48Å; T48-T167 VanDerWaalsContact O-CA 3.32Å; T48-T167 WeakPolarHBondContact O-CA 3.27Å; T167-V169 HydrophobicContact CG2-CG2 3.94Å; T167-I194 HydrophobicContact CG2-CG1 4.04Å; T167-L197 HydrophobicContact CG2-CD1 4.39Å; T167-L197 WeakPolarHBondContact OG1-CD1 3.4Å; T167-L197 WeakPolarHBondContact OG1-CG 3.35Å
168	I	76.4	Confident	74.2	Confident	28 Å²	28	67 Å²	67	14%	0.144	35%	0.351	C	S	.	.			trans	-91.8	131.9	172	-46.8	-171.8	0	0	0	108.7	I47 T48 G49 A53 K55 L58	I47-I168 HydrophobicContact CG2-CD1 3.8Å; I47-I168 HydrophobicContact CG2-CG1 4.07Å; T48-I168 PolarHBondContact O-N 3.32Å; G49-I168 WeakPolarHBondContact CA-O 3.21Å; A53-I168 HydrophobicContact CB-CB 4.35Å; A53-I168 HydrophobicContact CB-CG2 4.31Å; A53-I168 WeakPolarHBondContact CB-O 3.21Å; A53-I168 WeakPolarHBondContact O-CG2 3.34Å; K55-I168 HydrophobicContact CB-CD1 4.24Å; K55-I168 HydrophobicContact CG-CB 4.37Å; K55-I168 HydrophobicContact CG-CD1 3.96Å; K55-I168 HydrophobicContact CG-CG1 4.34Å; L58-I168 HydrophobicContact CB-CD1 3.93Å; L58-I168 HydrophobicContact CD2-CD1 3.46Å; L58-I168 VanDerWaalsContact CD2-CD1 3.46Å; L58-I168 HydrophobicContact CD2-CG1 4.31Å; L58-I168 HydrophobicContact CG-CD1 4.33Å
169	V	76	Confident	74.2	Confident	68 Å²	68	68.3 Å²	68.3	41%	0.412	36%	0.356	S	S	.	.			trans	-128.6	125	177.9	-178.2	0	0	0	0	106.7	Y50 T167 S171 I194	Y50-V169 HydrophobicContact CE1-CG1 4.13Å; T167-V169 HydrophobicContact CG2-CG2 3.94Å; V169-S171 PolarHBondContact O-N 2.93Å; V169-I194 HydrophobicContact CG2-CD1 4.08Å
170	D	74.9	Confident	73.8	Confident	42 Å²	42	68.8 Å²	68.8	23%	0.225	36%	0.357	C	S	.	.			trans	-72.4	126.4	170.7	160.4	-31.1	0	0	0	108.4	Y50 K172 Y173 G174	Y50-D170 WeakPolarHBondContact OH-CA 3.39Å; Y50-D170 WeakPolarHBondContact OH-CB 3.33Å; Y50-D170 PolarHBondContact OH-N 3.32Å; Y50-D170 PolarHBondContact OH-O 2.85Å; D170-K172 VanDerWaalsContact C-N 3.31Å; D170-K172 PolarHBondContact O-N 3.32Å; D170-K172 WeakPolarHBondContact OD1-CA 3.38Å; D170-K172 WeakPolarHBondContact OD1-CB 3.45Å; D170-K172 PolarHBondContact OD1-N 3.09Å; D170-Y173 PolarHBondContact OD1-N 3.04Å; D170-Y173 WeakPolarHBondContact OD2-CD2 3.21Å; D170-G174 WeakPolarHBondContact O-CA 3.14Å; D170-G174 PolarHBondContact O-N 3.37Å
171	S	69.6	Low	73.1	Confident	127 Å²	127	77.7 Å²	77.7	89%	0.888	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-24.3	-173.5	53	0	0	0	0	113.8	V169	V169-S171 PolarHBondContact O-N 2.93Å
172	K	72.8	Confident	72.4	Confident	125 Å²	125	75.9 Å²	75.9	54%	0.543	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-42	-178.2	-171.4	168.6	-170.8	156.4	0	111.1	E17 D170	E17-K172 IonicContact OE2-NZ 3.76Å; E17-K172 PolarHBondContact OE2-NZ 2.99Å; D170-K172 VanDerWaalsContact C-N 3.31Å; D170-K172 PolarHBondContact O-N 3.32Å; D170-K172 WeakPolarHBondContact OD1-CA 3.38Å; D170-K172 WeakPolarHBondContact OD1-CB 3.45Å; D170-K172 PolarHBondContact OD1-N 3.09Å
173	Y	68.8	Low	71	Confident	107 Å²	107	78.9 Å²	78.9	42%	0.42	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-7.6	-174.5	-57.1	-66.3	0	0	0	114.3	D170 L175 K176 H177	D170-Y173 PolarHBondContact OD1-N 3.04Å; D170-Y173 WeakPolarHBondContact OD2-CD2 3.21Å; Y173-L175 PolarHBondContact O-N 3.02Å; Y173-K176 WeakPolarHBondContact O-CB 3.38Å; Y173-K176 PolarHBondContact O-N 3.07Å; Y173-H177 PolarHBondContact O-CD2 3.48Å; Y173-H177 PolarHBondContact O-N 2.85Å
174	G	68.4	Low	69.6	Low	2 Å²	2	82.9 Å²	82.9	2%	0.021	44%	0.435	C	S	.	.	H	α-helix	trans	-58.4	-43	-173.7	0	0	0	0	0	114	Y50 D170 K176 H177 L178	Y50-G174 WeakPolarHBondContact OH-CA 3.4Å; Y50-G174 PolarHBondContact OH-N 3.35Å; D170-G174 WeakPolarHBondContact O-CA 3.14Å; D170-G174 PolarHBondContact O-N 3.37Å; G174-K176 VanDerWaalsContact C-N 3.34Å; G174-K176 PolarHBondContact O-N 3.35Å; G174-H177 PolarHBondContact O-N 3.18Å; G174-L178 VanDerWaalsContact O-CB 3.32Å; G174-L178 WeakPolarHBondContact O-CB 3.29Å; G174-L178 WeakPolarHBondContact O-CG 3.39Å; G174-L178 PolarHBondContact O-N 3.39Å
175	L	69.6	Low	68.6	Low	133 Å²	133	85.2 Å²	85.2	70%	0.696	46%	0.46	S	S	*	.	H	α-helix	trans	-64.8	-41.5	176.4	-172.4	63.9	0	0	0	111.4	Y173 H177 L178 T179	Y173-L175 PolarHBondContact O-N 3.02Å; L175-H177 PolarHBondContact O-N 3.3Å; L175-L178 PolarHBondContact O-N 3.35Å; L175-T179 HydrophobicContact CD1-CG2 4.29Å; L175-T179 WeakPolarHBondContact O-CG2 3.45Å; L175-T179 PolarHBondContact O-N 3.02Å; L175-T179 PolarHBondContact O-OG1 3.36Å
176	K	70.6	Confident	67.1	Low	144 Å²	144	89.7 Å²	89.7	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-60.6	-46.5	178.2	-177.4	-176.3	176.4	-175.2	0	111.1	Y173 G174 T179 E180	Y173-K176 WeakPolarHBondContact O-CB 3.38Å; Y173-K176 PolarHBondContact O-N 3.07Å; G174-K176 VanDerWaalsContact C-N 3.34Å; G174-K176 PolarHBondContact O-N 3.35Å; K176-T179 PolarHBondContact O-N 3.3Å; K176-T179 PolarHBondContact O-OG1 3Å; K176-E180 PolarHBondContact O-N 3.12Å
177	H	66.8	Low	65.9	Low	57 Å²	57	90.9 Å²	90.9	26%	0.264	49%	0.489	S	S	.	.	H	α-helix	trans	-67.8	-34.5	178	-73.6	-65.2	0	0	0	113	Y50 Y173 G174 L175 E180 N188 A190	Y50-H177 HydrophobicContact CD2-CB 4.32Å; Y50-H177 AromaticContact CD2-CD2 3.92Å; Y50-H177 HydrophobicContact CE2-CB 4.27Å; Y50-H177 AromaticContact CE2-CD2 3.36Å; Y50-H177 WeakPolarHBondContact CE2-CD2 3.22Å; Y50-H177 AromaticContact CE2-CG 3.9Å; Y50-H177 AromaticContact CE2-NE2 3.99Å; Y50-H177 AromaticContact CZ-CD2 3.95Å; Y173-H177 PolarHBondContact O-CD2 3.48Å; Y173-H177 PolarHBondContact O-N 2.85Å; G174-H177 PolarHBondContact O-N 3.18Å; L175-H177 PolarHBondContact O-N 3.3Å; H177-E180 IonicContact ND1-OE2 3.55Å; H177-E180 PolarHBondContact O-N 3.49Å; H177-N188 PolarHBondContact O-ND2 3.12Å; H177-N188 PolarHBondContact O-OD1 3.4Å; H177-A190 HydrophobicContact CB-CB 3.85Å
178	L	67.6	Low	65.1	Low	56 Å²	56	90.2 Å²	90.2	29%	0.293	49%	0.485	S	S	.	.	H	α-helix	trans	-67.2	-34.7	174.6	-85.9	170.8	0	0	0	113.4	G174 L175 N188 A190 T191 I194	G174-L178 VanDerWaalsContact O-CB 3.32Å; G174-L178 WeakPolarHBondContact O-CB 3.29Å; G174-L178 WeakPolarHBondContact O-CG 3.39Å; G174-L178 PolarHBondContact O-N 3.39Å; L175-L178 PolarHBondContact O-N 3.35Å; L178-N188 PolarHBondContact O-ND2 2.77Å; L178-A190 HydrophobicContact CD2-CB 4.15Å; L178-A190 HydrophobicContact CG-CB 4.2Å; L178-T191 PolarHBondContact O-OG1 3Å; L178-I194 HydrophobicContact CD1-CD1 3.88Å; L178-I194 HydrophobicContact CD2-CD1 3.54Å; L178-I194 HydrophobicContact CG-CD1 3.99Å
179	T	70.6	Confident	64.3	Low	96 Å²	96	91.3 Å²	91.3	59%	0.589	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.4	179.6	58.4	0	0	0	0	113.4	L175 K176 E181	L175-T179 HydrophobicContact CD1-CG2 4.29Å; L175-T179 WeakPolarHBondContact O-CG2 3.45Å; L175-T179 PolarHBondContact O-N 3.02Å; L175-T179 PolarHBondContact O-OG1 3.36Å; K176-T179 PolarHBondContact O-N 3.3Å; K176-T179 PolarHBondContact O-OG1 3Å; T179-E181 PolarHBondContact O-N 2.87Å
180	E	68.8	Low	63.5	Low	72 Å²	72	88.1 Å²	88.1	34%	0.336	47%	0.47	S	S	.	.			trans	-66.4	119.5	178.9	-170.7	-176.4	164.6	0	0	109.4	K176 H177 K182 N188	K176-E180 PolarHBondContact O-N 3.12Å; H177-E180 IonicContact ND1-OE2 3.55Å; H177-E180 PolarHBondContact O-N 3.49Å; E180-K182 WeakPolarHBondContact OE1-CE 3.48Å; E180-K182 IonicContact OE1-NZ 2.73Å; E180-K182 PolarHBondContact OE1-NZ 3.23Å; E180-K182 IonicContact OE2-NZ 2.78Å; E180-N188 WeakPolarHBondContact O-CB 3.32Å; E180-N188 PolarHBondContact O-ND2 2.96Å
181	E	66.7	Low	62.9	Low	188 Å²	188	87.6 Å²	87.6	88%	0.879	47%	0.468	S	S	*	.			trans	-88.6	113.6	170	-67.2	-175.7	172.5	0	0	108.4	T179	T179-E181 PolarHBondContact O-N 2.87Å
182	K	61.1	Low	62.4	Low	65 Å²	65	86.9 Å²	86.9	28%	0.283	45%	0.446	S	S	.	.			trans	-77.9	143.9	174.3	-65.4	-77.1	-174.7	-166.7	0	109.5	E180 L186 N188	E180-K182 WeakPolarHBondContact OE1-CE 3.48Å; E180-K182 IonicContact OE1-NZ 2.73Å; E180-K182 PolarHBondContact OE1-NZ 3.23Å; E180-K182 IonicContact OE2-NZ 2.78Å; K182-L186 HydrophobicContact CB-CB 3.97Å; K182-L186 WeakPolarHBondContact CB-O 3.34Å; K182-N188 HydrophobicContact CG-CB 4.21Å
183	P	47.6	Very low	61.7	Low	100 Å²	100	81 Å²	81	65%	0.649	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-54.8	154.4	169	-19.8	30.6	0	0	0	111.3	G185	P183-G185 VanDerWaalsContact C-N 3.25Å; P183-G185 PolarHBondContact O-N 3.38Å
184	D	51.6	Low	61.3	Low	164 Å²	164	78.5 Å²	78.5	88%	0.877	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	63.6	19	176.4	-55.7	-29.3	0	0	0	116.1	L186	D184-L186 PolarHBondContact O-N 3.46Å
185	G	54.3	Low	60.8	Low	72 Å²	72	82.6 Å²	82.6	74%	0.742	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	72.9	14.5	174.4	0	0	0	0	0	114.3	P183	P183-G185 VanDerWaalsContact C-N 3.25Å; P183-G185 PolarHBondContact O-N 3.38Å
186	L	46.7	Very low	59.9	Low	122 Å²	122	76.3 Å²	76.3	64%	0.639	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-63.9	136.1	174.1	-66.7	172	0	0	0	110.2	K182 D184 N188	K182-L186 HydrophobicContact CB-CB 3.97Å; K182-L186 WeakPolarHBondContact CB-O 3.34Å; D184-L186 PolarHBondContact O-N 3.46Å; L186-N188 PolarHBondContact O-N 2.93Å
187	I	56.3	Low	58.8	Low	110 Å²	110	70.8 Å²	70.8	56%	0.564	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-69.6	128.4	177.3	-57.1	173.3	0	0	0	108	T191 R192	I187-T191 HydrophobicContact CG2-CG2 4.33Å; I187-R192 HydrophobicContact CG2-CB 4.12Å
188	N	62.5	Low	57.9	Low	17 Å²	17	69.6 Å²	69.6	9%	0.091	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-65.3	148.7	176.9	80.4	46.3	0	0	0	110.8	H177 L178 E180 K182 L186 A190 T191 R192	H177-N188 PolarHBondContact O-ND2 3.12Å; H177-N188 PolarHBondContact O-OD1 3.4Å; L178-N188 PolarHBondContact O-ND2 2.77Å; E180-N188 WeakPolarHBondContact O-CB 3.32Å; E180-N188 PolarHBondContact O-ND2 2.96Å; K182-N188 HydrophobicContact CG-CB 4.21Å; L186-N188 PolarHBondContact O-N 2.93Å; N188-A190 VanDerWaalsContact C-N 3.32Å; N188-A190 PolarHBondContact O-N 3.43Å; N188-A190 PolarHBondContact OD1-N 3.44Å; N188-T191 VanDerWaalsContact CG-OG1 3.27Å; N188-T191 PolarHBondContact ND2-OG1 3.15Å; N188-T191 PolarHBondContact O-N 3.21Å; N188-T191 WeakPolarHBondContact OD1-CA 3.36Å; N188-T191 WeakPolarHBondContact OD1-CB 2.85Å; N188-T191 PolarHBondContact OD1-N 2.76Å; N188-T191 PolarHBondContact OD1-OG1 3.34Å; N188-R192 WeakPolarHBondContact O-CB 3.42Å; N188-R192 PolarHBondContact O-N 3.3Å
189	E	59.9	Low	56.6	Low	51 Å²	51	71 Å²	71	24%	0.238	39%	0.388	C	S	.	.	H	α-helix	trans	-67.5	-33.6	-168.9	-43.4	-174.4	-175.5	0	0	112.4	L140 R192 S193	L140-E189 HydrophobicContact CD2-CB 4.07Å; L140-E189 HydrophobicContact CD2-CG 3.37Å; L140-E189 WeakPolarHBondContact CD2-OE1 3.43Å; E189-R192 PolarHBondContact O-N 3.02Å; E189-S193 WeakPolarHBondContact O-CB 3.13Å; E189-S193 PolarHBondContact O-N 2.94Å; E189-S193 PolarHBondContact O-OG 3.29Å
190	A	57.9	Low	55.1	Low	1 Å²	1	67.3 Å²	67.3	1%	0.008	37%	0.365	C	S	.	.	H	α-helix	trans	-69.3	-45.5	178	0	0	0	0	0	111.8	Y50 H177 L178 N188 R192 S193 I194	Y50-A190 HydrophobicContact CD1-CB 3.64Å; Y50-A190 HydrophobicContact CE1-CB 4.35Å; Y50-A190 HydrophobicContact CG-CB 3.93Å; H177-A190 HydrophobicContact CB-CB 3.85Å; L178-A190 HydrophobicContact CD2-CB 4.15Å; L178-A190 HydrophobicContact CG-CB 4.2Å; N188-A190 VanDerWaalsContact C-N 3.32Å; N188-A190 PolarHBondContact O-N 3.43Å; N188-A190 PolarHBondContact OD1-N 3.44Å; A190-R192 VanDerWaalsContact C-N 3.34Å; A190-S193 PolarHBondContact O-N 2.92Å; A190-I194 WeakPolarHBondContact O-CB 3.37Å; A190-I194 WeakPolarHBondContact O-CG1 3.02Å; A190-I194 PolarHBondContact O-N 3.48Å
191	T	62.8	Low	53.5	Low	31 Å²	31	69 Å²	69	19%	0.19	38%	0.375	C	S	.	.	H	α-helix	trans	-64.7	-39.1	173.4	-65.1	0	0	0	0	110.2	L178 I187 N188 N195	L178-T191 PolarHBondContact O-OG1 3Å; I187-T191 HydrophobicContact CG2-CG2 4.33Å; N188-T191 VanDerWaalsContact CG-OG1 3.27Å; N188-T191 PolarHBondContact ND2-OG1 3.15Å; N188-T191 PolarHBondContact O-N 3.21Å; N188-T191 WeakPolarHBondContact OD1-CA 3.36Å; N188-T191 WeakPolarHBondContact OD1-CB 2.85Å; N188-T191 PolarHBondContact OD1-N 2.76Å; N188-T191 PolarHBondContact OD1-OG1 3.34Å; T191-N195 WeakPolarHBondContact CG2-ND2 3.43Å; T191-N195 WeakPolarHBondContact O-CA 3.38Å; T191-N195 WeakPolarHBondContact O-CB 3.45Å; T191-N195 PolarHBondContact O-N 2.96Å; T191-N195 PolarHBondContact O-ND2 2.95Å; T191-N195 PolarHBondContact O-OD1 3.29Å
192	R	59.7	Low	52.2	Low	112 Å²	112	63.9 Å²	63.9	42%	0.423	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-48.9	174	-176.7	-177.8	-102.2	-151	-5.7	111.8	L140 I187 N188 E189 A190 I194 N195 G196	L140-R192 WeakPolarHBondContact O-CD 3.47Å; L140-R192 PolarHBondContact O-NH1 2.83Å; I187-R192 HydrophobicContact CG2-CB 4.12Å; N188-R192 WeakPolarHBondContact O-CB 3.42Å; N188-R192 PolarHBondContact O-N 3.3Å; E189-R192 PolarHBondContact O-N 3.02Å; A190-R192 VanDerWaalsContact C-N 3.34Å; R192-I194 PolarHBondContact O-N 3.49Å; R192-N195 PolarHBondContact O-N 3.06Å; R192-G196 PolarHBondContact O-N 3.2Å
193	S	58.3	Low	51.1	Low	1 Å²	1	62.7 Å²	62.7	1%	0.007	35%	0.349	C	S	.	.	H	α-helix	trans	-60.2	-44.5	179	-61.1	0	0	0	0	111.9	G139 E189 A190 L197	G139-S193 PolarHBondContact O-OG 2.98Å; E189-S193 WeakPolarHBondContact O-CB 3.13Å; E189-S193 PolarHBondContact O-N 2.94Å; E189-S193 PolarHBondContact O-OG 3.29Å; A190-S193 PolarHBondContact O-N 2.92Å; S193-L197 PolarHBondContact O-N 3.35Å
194	I	60.2	Low	50.4	Low	54 Å²	54	62.9 Å²	62.9	28%	0.277	34%	0.342	S	S	.	.	H	α-helix	trans	-75.8	-38.2	-178.8	-71.1	165.1	0	0	0	112	T167 V169 L178 A190 R192 G196 L197 G198	T167-I194 HydrophobicContact CG2-CG1 4.04Å; V169-I194 HydrophobicContact CG2-CD1 4.08Å; L178-I194 HydrophobicContact CD1-CD1 3.88Å; L178-I194 HydrophobicContact CD2-CD1 3.54Å; L178-I194 HydrophobicContact CG-CD1 3.99Å; A190-I194 WeakPolarHBondContact O-CB 3.37Å; A190-I194 WeakPolarHBondContact O-CG1 3.02Å; A190-I194 PolarHBondContact O-N 3.48Å; R192-I194 PolarHBondContact O-N 3.49Å; I194-G196 VanDerWaalsContact C-N 3.32Å; I194-G196 PolarHBondContact O-N 3.32Å; I194-L197 WeakPolarHBondContact O-CB 3.42Å; I194-L197 PolarHBondContact O-N 3.42Å; I194-G198 PolarHBondContact O-N 3.42Å
195	N	57	Low	49.7	Very low	89 Å²	89	61.3 Å²	61.3	48%	0.476	32%	0.324	S	S	.	.	H	α-helix	trans	-67.5	-35	175.8	-72.5	-9.3	0	0	0	111.7	T191 R192 L197 G198 Q199	T191-N195 WeakPolarHBondContact CG2-ND2 3.43Å; T191-N195 WeakPolarHBondContact O-CA 3.38Å; T191-N195 WeakPolarHBondContact O-CB 3.45Å; T191-N195 PolarHBondContact O-N 2.96Å; T191-N195 PolarHBondContact O-ND2 2.95Å; T191-N195 PolarHBondContact O-OD1 3.29Å; R192-N195 PolarHBondContact O-N 3.06Å; N195-L197 VanDerWaalsContact C-N 3.3Å; N195-L197 PolarHBondContact O-N 3.35Å; N195-G198 PolarHBondContact O-N 2.77Å; N195-G198 VanDerWaalsContact O-N 3.12Å; N195-Q199 WeakPolarHBondContact O-CG 3.49Å; N195-Q199 PolarHBondContact O-N 2.67Å; N195-Q199 VanDerWaalsContact O-N 3.07Å
196	G	50.4	Low	48.9	Very low	1 Å²	1	62.5 Å²	62.5	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-57.9	-42.3	171.5	0	0	0	0	0	111.9	R192 I194 Q199 I200	R192-G196 PolarHBondContact O-N 3.2Å; I194-G196 VanDerWaalsContact C-N 3.32Å; I194-G196 PolarHBondContact O-N 3.32Å; G196-Q199 WeakPolarHBondContact O-CB 3.31Å; G196-Q199 PolarHBondContact O-N 3.08Å; G196-I200 WeakPolarHBondContact O-CD1 3.25Å; G196-I200 WeakPolarHBondContact O-CG1 3.39Å; G196-I200 PolarHBondContact O-N 3.3Å
197	L	47.3	Very low	48.2	Very low	28 Å²	28	60.7 Å²	60.7	15%	0.147	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-40.3	170.8	-81	-166.8	0	0	0	113.5	I165 T167 S193 I194 N195 Q199 I200 L201	I165-L197 HydrophobicContact CB-CD2 3.6Å; I165-L197 HydrophobicContact CG2-CD2 3.34Å; T167-L197 HydrophobicContact CG2-CD1 4.39Å; T167-L197 WeakPolarHBondContact OG1-CD1 3.4Å; T167-L197 WeakPolarHBondContact OG1-CG 3.35Å; S193-L197 PolarHBondContact O-N 3.35Å; I194-L197 WeakPolarHBondContact O-CB 3.42Å; I194-L197 PolarHBondContact O-N 3.42Å; N195-L197 VanDerWaalsContact C-N 3.3Å; N195-L197 PolarHBondContact O-N 3.35Å; L197-Q199 PolarHBondContact O-N 2.74Å; L197-I200 CarbonylContact O-C 3.56Å; L197-I200 PolarHBondContact O-N 2.93Å; L197-L201 HydrophobicContact CB-CD1 4.48Å; L197-L201 WeakPolarHBondContact O-CB 3.46Å; L197-L201 PolarHBondContact O-N 2.96Å
198	G	47.9	Very low	47.1	Very low	31 Å²	31	59.4 Å²	59.4	32%	0.32	31%	0.312	S	S	.	.	H	α-helix	trans	-53.5	-45.3	175.4	0	0	0	0	0	111.4	I194 N195 I200 L201 E202	I194-G198 PolarHBondContact O-N 3.42Å; N195-G198 PolarHBondContact O-N 2.77Å; N195-G198 VanDerWaalsContact O-N 3.12Å; G198-I200 VanDerWaalsContact C-N 3.27Å; G198-I200 PolarHBondContact O-N 3.02Å; G198-L201 PolarHBondContact O-N 3.33Å; G198-E202 WeakPolarHBondContact O-CB 3.2Å; G198-E202 PolarHBondContact O-N 2.76Å
199	Q	41.8	Very low	45.7	Very low	86 Å²	86	64.9 Å²	64.9	40%	0.402	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-32.7	176.2	-64.1	179.9	45.6	0	0	113.2	N195 G196 L197 T203	N195-Q199 WeakPolarHBondContact O-CG 3.49Å; N195-Q199 PolarHBondContact O-N 2.67Å; N195-Q199 VanDerWaalsContact O-N 3.07Å; G196-Q199 WeakPolarHBondContact O-CB 3.31Å; G196-Q199 PolarHBondContact O-N 3.08Å; L197-Q199 PolarHBondContact O-N 2.74Å; Q199-T203 PolarHBondContact O-OG1 2.83Å
200	I	38.6	Very low	44.7	Very low	19 Å²	19	71.4 Å²	71.4	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-84.9	-40.9	-178.5	-65.8	146.2	0	0	0	111.9	P143 G144 A147 I165 G196 L197 G198 E202 T203 Q204	P143-I200 HydrophobicContact CB-CD1 4.22Å; P143-I200 HydrophobicContact CG-CD1 4.39Å; G144-I200 VanDerWaalsContact CA-CD1 3.49Å; A147-I200 HydrophobicContact CB-CD1 4.27Å; I165-I200 HydrophobicContact CD1-CB 4.28Å; I165-I200 HydrophobicContact CD1-CD1 3.18Å; I165-I200 HydrophobicContact CD1-CG1 3.96Å; I165-I200 HydrophobicContact CD1-CG2 3.82Å; G196-I200 WeakPolarHBondContact O-CD1 3.25Å; G196-I200 WeakPolarHBondContact O-CG1 3.39Å; G196-I200 PolarHBondContact O-N 3.3Å; L197-I200 CarbonylContact O-C 3.56Å; L197-I200 PolarHBondContact O-N 2.93Å; G198-I200 VanDerWaalsContact C-N 3.27Å; G198-I200 PolarHBondContact O-N 3.02Å; I200-E202 VanDerWaalsContact C-N 3.33Å; I200-E202 PolarHBondContact O-N 3.2Å; I200-T203 WeakPolarHBondContact O-CA 2.97Å; I200-T203 WeakPolarHBondContact O-CB 3.3Å; I200-T203 PolarHBondContact O-N 2.85Å; I200-Q204 PolarHBondContact O-N 2.79Å
201	L	34.6	Very low	43.6	Very low	108 Å²	108	80 Å²	80	57%	0.565	40%	0.401	S	S	*	.	H	α-helix	trans	-65	-35.7	175	-75.4	165.9	0	0	0	111.8	L197 G198 T203 Q204 R205	L197-L201 HydrophobicContact CB-CD1 4.48Å; L197-L201 WeakPolarHBondContact O-CB 3.46Å; L197-L201 PolarHBondContact O-N 2.96Å; G198-L201 PolarHBondContact O-N 3.33Å; L201-T203 PolarHBondContact O-N 3.2Å; L201-Q204 PolarHBondContact O-N 2.79Å; L201-R205 PolarHBondContact O-N 2.88Å; L201-R205 VanDerWaalsContact O-N 3.13Å
202	E	39.1	Very low	42.2	Very low	79 Å²	79	84.3 Å²	84.3	37%	0.369	42%	0.423	S	S	.	.	H	α-helix	trans	-64.1	-29.6	171.6	-142	96.9	-124.2	0	0	111.8	G198 I200 R205	G198-E202 WeakPolarHBondContact O-CB 3.2Å; G198-E202 PolarHBondContact O-N 2.76Å; I200-E202 VanDerWaalsContact C-N 3.33Å; I200-E202 PolarHBondContact O-N 3.2Å; E202-R205 WeakPolarHBondContact O-CB 3.34Å; E202-R205 IonicContact OE1-CZ 3.61Å; E202-R205 IonicContact OE1-NH1 3.83Å; E202-R205 PolarHBondContact OE1-NH1 3.06Å
203	T	38	Very low	40.9	Very low	40 Å²	40	86.9 Å²	86.9	25%	0.245	44%	0.44	C	S	.	.	H	α-helix	trans	-72.8	-32.9	177.9	-57.2	0	0	0	0	112.7	Q199 I200 L201 R267	Q199-T203 PolarHBondContact O-OG1 2.83Å; I200-T203 WeakPolarHBondContact O-CA 2.97Å; I200-T203 WeakPolarHBondContact O-CB 3.3Å; I200-T203 PolarHBondContact O-N 2.85Å; L201-T203 PolarHBondContact O-N 3.2Å; T203-R267 VanDerWaalsContact CG2-NH2 3.26Å; T203-R267 VanDerWaalsContact OG1-CZ 3.23Å; T203-R267 PolarHBondContact OG1-NH1 2.84Å; T203-R267 PolarHBondContact OG1-NH2 2.97Å
204	Q	34	Very low	39.9	Very low	104 Å²	104	95 Å²	95	49%	0.486	48%	0.477	S	S	.	.	H	α-helix	trans	-91.1	-8	178.8	-71.3	-81.1	-7.6	0	0	113.7	I200 L201 S206 S207 L208	I200-Q204 PolarHBondContact O-N 2.79Å; L201-Q204 PolarHBondContact O-N 2.79Å; Q204-S206 PolarHBondContact O-N 2.9Å; Q204-S206 VanDerWaalsContact O-N 3.11Å; Q204-S207 PolarHBondContact O-N 2.82Å; Q204-L208 PolarHBondContact O-N 3.02Å
205	R	36.1	Very low	38.5	Very low	132 Å²	132	98.2 Å²	98.2	50%	0.498	50%	0.499	S	S	.	.	H	α-helix	trans	-56.5	-28.7	-176.4	-164.9	175.5	-169	148.7	5.5	114	L201 E202 S207 L208 Q209	L201-R205 PolarHBondContact O-N 2.88Å; L201-R205 VanDerWaalsContact O-N 3.13Å; E202-R205 WeakPolarHBondContact O-CB 3.34Å; E202-R205 IonicContact OE1-CZ 3.61Å; E202-R205 IonicContact OE1-NH1 3.83Å; E202-R205 PolarHBondContact OE1-NH1 3.06Å; R205-S207 VanDerWaalsContact C-N 3.29Å; R205-S207 PolarHBondContact O-N 2.82Å; R205-L208 PolarHBondContact O-N 2.83Å; R205-Q209 PolarHBondContact O-N 3.14Å; R205-Q209 VanDerWaalsContact O-N 3.08Å
206	S	37.3	Very low	37.3	Very low	96 Å²	96	100 Å²	100	67%	0.671	52%	0.515	S	S	*	.	H	α-helix	trans	-63.7	-31.3	175.9	54.9	0	0	0	0	113.1	Q204	Q204-S206 PolarHBondContact O-N 2.9Å; Q204-S206 VanDerWaalsContact O-N 3.11Å
207	S	33.4	Very low	36.6	Very low	85 Å²	85	103.6 Å²	103.6	59%	0.594	55%	0.552	S	S	*	*	H	α-helix	trans	-84.1	-35.7	175.7	-102.4	0	0	0	0	112.6	Q204 R205	Q204-S207 PolarHBondContact O-N 2.82Å; R205-S207 VanDerWaalsContact C-N 3.29Å; R205-S207 PolarHBondContact O-N 2.82Å
208	L	31.7	Very low	35.8	Very low	82 Å²	82	108.9 Å²	108.9	43%	0.429	59%	0.586	S	S	.	*	H	α-helix	trans	-77.7	-24.1	-177	-82.8	158.8	0	0	0	114.2	Q204 R205 K210 K211 L212	Q204-L208 PolarHBondContact O-N 3.02Å; R205-L208 PolarHBondContact O-N 2.83Å; L208-K210 PolarHBondContact O-N 2.86Å; L208-K210 VanDerWaalsContact O-N 3.13Å; L208-K211 PolarHBondContact O-N 2.73Å; L208-L212 PolarHBondContact O-N 3.08Å
209	Q	34.7	Very low	35.1	Very low	132 Å²	132	116.2 Å²	116.2	62%	0.617	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-26.8	175.3	-95.3	-177.4	-24.4	0	0	113.5	R205	R205-Q209 PolarHBondContact O-N 3.14Å; R205-Q209 VanDerWaalsContact O-N 3.08Å
210	K	37.4	Very low	34.8	Very low	188 Å²	188	116.9 Å²	116.9	82%	0.817	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-23.1	174.6	-84.3	-178.3	176.7	175.7	0	113.9	L208	L208-K210 PolarHBondContact O-N 2.86Å; L208-K210 VanDerWaalsContact O-N 3.13Å
211	K	34.6	Very low	34.9	Very low	181 Å²	181	124.9 Å²	124.9	79%	0.787	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-15.9	-179	-75	-176.4	176.3	-179.1	0	113.7	L208 Q213	L208-K211 PolarHBondContact O-N 2.73Å; K211-Q213 PolarHBondContact O-N 2.78Å
212	L	33.5	Very low	35.1	Very low	123 Å²	123	124.9 Å²	124.9	64%	0.644	66%	0.661	S	S	*	*			trans	-86.9	11.6	-170.6	-133.1	84.1	0	0	0	116	L208 H214	L208-L212 PolarHBondContact O-N 3.08Å; L212-H214 PolarHBondContact O-N 2.85Å
213	Q	34.2	Very low	35.3	Very low	165 Å²	165	124.7 Å²	124.7	77%	0.771	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	1.2	-176.7	-73.1	-173.7	-9.8	0	0	115.3	K211	K211-Q213 PolarHBondContact O-N 2.78Å
214	H	35.8	Very low	35.6	Very low	172 Å²	172	131.7 Å²	131.7	80%	0.796	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	17	-170.1	-80.2	78.1	0	0	0	116.7	L212	L212-H214 PolarHBondContact O-N 2.85Å
215	V	30.9	Very low	36.5	Very low	122 Å²	122	129 Å²	129	74%	0.739	69%	0.685	S	S	*	*			trans	-129.4	119.1	176.1	-172.5	0	0	0	0	111.4
216	P	31.7	Very low	37.6	Very low	125 Å²	125	125.6 Å²	125.6	81%	0.812	68%	0.676	S	S	*	*			trans	-82.3	119.8	177.6	30.7	-29.4	0	0	0	111.7
217	G	35.4	Very low	39.3	Very low	77 Å²	77	123.7 Å²	123.7	79%	0.794	66%	0.66	S	S	*	*			trans	63.4	90	136.8	0	0	0	0	0	119.4
218	T	31.3	Very low	41.1	Very low	139 Å²	139	124 Å²	124	85%	0.853	66%	0.658	S	S	*	*			trans	-120.5	130.4	148.3	31.5	0	0	0	0	109.2
219	Q	33.5	Very low	43.3	Very low	186 Å²	186	120.8 Å²	120.8	87%	0.869	64%	0.641	S	S	*	*			trans	-67.6	131.5	-178.4	-79.1	-179	-25.9	0	0	110.5
220	P	35.6	Very low	45.5	Very low	99 Å²	99	117.5 Å²	117.5	64%	0.643	63%	0.63	S	S	*	*			trans	-77.6	128.7	-178	29.4	-32.7	0	0	0	111.5	L222	P220-L222 HydrophobicContact CB-CD1 3.81Å; P220-L222 HydrophobicContact CB-CG 3.99Å; P220-L222 HydrophobicContact CG-CD1 3.91Å; P220-L222 PolarHBondContact O-N 2.81Å; P220-L222 VanDerWaalsContact O-N 3.12Å
221	H	39.6	Very low	47.8	Very low	188 Å²	188	108.8 Å²	108.8	87%	0.87	59%	0.592	S	S	*	*			trans	-82.9	60.4	163.9	37.4	-86	0	0	0	108.9
222	L	40	Very low	50.4	Low	108 Å²	108	104.4 Å²	104.4	57%	0.565	58%	0.575	S	S	*	*			trans	-69.1	138.8	168.2	-76.4	153	0	0	0	108.2	P220 Q224	P220-L222 HydrophobicContact CB-CD1 3.81Å; P220-L222 HydrophobicContact CB-CG 3.99Å; P220-L222 HydrophobicContact CG-CD1 3.91Å; P220-L222 PolarHBondContact O-N 2.81Å; P220-L222 VanDerWaalsContact O-N 3.12Å; L222-Q224 PolarHBondContact O-N 2.66Å
223	D	42.3	Very low	53.1	Low	74 Å²	74	98.8 Å²	98.8	40%	0.396	55%	0.545	S	S	.	.			trans	-52.1	105.2	162	179	-4.5	0	0	0	107.4	S225 I226 R314	D223-S225 PolarHBondContact O-N 2.87Å; D223-S225 VanDerWaalsContact OD1-CB 3.28Å; D223-S225 WeakPolarHBondContact OD1-CB 3.16Å; D223-S225 PolarHBondContact OD1-N 2.86Å; D223-S225 VanDerWaalsContact OD1-N 3.09Å; D223-S225 PolarHBondContact OD1-OG 2.88Å; D223-S225 PolarHBondContact OD2-OG 3.26Å; D223-S225 VanDerWaalsContact OD2-OG 3.12Å; D223-I226 HydrophobicContact CB-CD1 4.17Å; D223-I226 HydrophobicContact CB-CG1 4.28Å; D223-I226 PolarHBondContact O-N 3.47Å; D223-R314 IonicContact OD2-CZ 3.57Å; D223-R314 IonicContact OD2-NE 2.77Å; D223-R314 IonicContact OD2-NH2 3.03Å; D223-R314 PolarHBondContact OD2-NH2 2.77Å
224	Q	45.3	Very low	55.7	Low	187 Å²	187	95.5 Å²	95.5	87%	0.874	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-10.5	-174.4	-66.5	-175.4	-7	0	0	112.4	L222	L222-Q224 PolarHBondContact O-N 2.66Å
225	S	52.1	Low	58.2	Low	48 Å²	48	88.6 Å²	88.6	34%	0.336	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-20	175.5	75.3	0	0	0	0	113.6	D223 R314	D223-S225 PolarHBondContact O-N 2.87Å; D223-S225 VanDerWaalsContact OD1-CB 3.28Å; D223-S225 WeakPolarHBondContact OD1-CB 3.16Å; D223-S225 PolarHBondContact OD1-N 2.86Å; D223-S225 VanDerWaalsContact OD1-N 3.09Å; D223-S225 PolarHBondContact OD1-OG 2.88Å; D223-S225 PolarHBondContact OD2-OG 3.26Å; D223-S225 VanDerWaalsContact OD2-OG 3.12Å; S225-R314 PolarHBondContact OG-NE 3.39Å
226	I	59.8	Low	61	Low	61 Å²	61	85.4 Å²	85.4	31%	0.313	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	117.3	-179.9	-58.8	177.9	0	0	0	109.1	D223 I266 L312 G313 R314	D223-I226 HydrophobicContact CB-CD1 4.17Å; D223-I226 HydrophobicContact CB-CG1 4.28Å; D223-I226 PolarHBondContact O-N 3.47Å; I226-I266 HydrophobicContact CD1-CD1 3.99Å; I226-I266 HydrophobicContact CG1-CD1 4.27Å; I226-I266 HydrophobicContact CG2-CD1 4.5Å; I226-L312 HydrophobicContact CG2-CD1 3.64Å; I226-L312 HydrophobicContact CG2-CD2 4.3Å; I226-L312 HydrophobicContact CG2-CG 3.73Å; I226-G313 WeakPolarHBondContact CA-O 3.22Å; I226-R314 HydrophobicContact CG1-CG 3.91Å
227	V	72.5	Confident	63.6	Low	56 Å²	56	79.4 Å²	79.4	34%	0.339	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	147.1	-178.8	-64.8	0	0	0	0	110.6	I229 G313 L316	V227-I229 HydrophobicContact CG2-CG1 4.47Å; V227-G313 WeakPolarHBondContact CG2-O 3.3Å; V227-G313 PolarHBondContact N-O 3.31Å; V227-G313 PolarHBondContact O-N 3.14Å; V227-G313 VanDerWaalsContact O-N 3.11Å; V227-L316 HydrophobicContact CG2-CB 3.8Å; V227-L316 HydrophobicContact CG2-CD1 4.38Å; V227-L316 HydrophobicContact CG2-CG 4.08Å
228	T	71.1	Confident	66.2	Low	90 Å²	90	78.9 Å²	78.9	55%	0.552	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	126	169.6	-58.1	0	0	0	0	109.3	V310 L311 L312	T228-V310 HydrophobicContact CG2-CG1 3.84Å; T228-L311 CarbonylContact C-O 3.54Å; T228-L311 WeakPolarHBondContact CA-O 3.45Å; T228-L312 VanDerWaalsContact OG1-CD1 3.23Å; T228-L312 WeakPolarHBondContact OG1-CD1 3.49Å
229	I	78.6	Confident	68.9	Low	16 Å²	16	76 Å²	76	8%	0.082	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.1	176.5	-61.4	-164	0	0	0	109.2	V227 F231 V310 L311 L316 K318 L321	V227-I229 HydrophobicContact CG2-CG1 4.47Å; I229-F231 HydrophobicContact CG2-CD1 4.13Å; I229-V310 WeakPolarHBondContact O-CA 3.33Å; I229-L311 PolarHBondContact N-O 2.78Å; I229-L311 PolarHBondContact O-N 3.21Å; I229-L316 HydrophobicContact CD1-CB 3.34Å; I229-L316 HydrophobicContact CD1-CD1 4.48Å; I229-L316 WeakPolarHBondContact CD1-O 3.5Å; I229-L316 HydrophobicContact CG1-CB 3.97Å; I229-L316 HydrophobicContact CG1-CD1 4.3Å; I229-K318 HydrophobicContact CD1-CB 3.98Å; I229-K318 VanDerWaalsContact CD1-N 3.34Å; I229-K318 HydrophobicContact CG2-CB 3.65Å; I229-K318 HydrophobicContact CG2-CD 4.22Å; I229-K318 HydrophobicContact CG2-CG 3.7Å; I229-L321 HydrophobicContact CD1-CD1 4.44Å
230	T	81.6	Confident	71.4	Confident	62 Å²	62	74.1 Å²	74.1	38%	0.38	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133	172.6	-51.7	0	0	0	0	109.9	L309 V310 K318	T230-L309 VanDerWaalsContact CA-O 3.3Å; T230-L309 WeakPolarHBondContact CA-O 3.4Å; T230-V310 HydrophobicContact CG2-CG2 4Å; T230-K318 WeakPolarHBondContact O-CE 3.41Å; T230-K318 PolarHBondContact O-NZ 3.35Å; T230-K318 VanDerWaalsContact O-NZ 3.08Å
231	F	85.1	Confident	73.9	Confident	6 Å²	6	71.7 Å²	71.7	3%	0.026	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	154.2	172.3	60.8	-101.6	0	0	0	111.7	I229 V233 L309 L311 L321 K322 F325	I229-F231 HydrophobicContact CG2-CD1 4.13Å; F231-V233 HydrophobicContact CD2-CG2 3.99Å; F231-V233 HydrophobicContact CE2-CG2 4.35Å; F231-L309 HydrophobicContact CD2-CB 4.48Å; F231-L309 HydrophobicContact CD2-CD1 4.42Å; F231-L309 HydrophobicContact CE1-CB 4.45Å; F231-L309 HydrophobicContact CE2-CB 4Å; F231-L309 HydrophobicContact CE2-CD1 3.47Å; F231-L309 VanDerWaalsContact CE2-CD1 3.47Å; F231-L309 HydrophobicContact CE2-CG 4.38Å; F231-L309 HydrophobicContact CZ-CB 3.97Å; F231-L309 HydrophobicContact CZ-CD1 3.8Å; F231-L309 PolarHBondContact N-O 3.47Å; F231-L309 VanDerWaalsContact N-O 3.14Å; F231-L309 PolarHBondContact O-N 3.15Å; F231-L311 HydrophobicContact CD1-CD1 4.13Å; F231-L311 HydrophobicContact CE1-CD1 3.38Å; F231-L311 HydrophobicContact CZ-CD1 4Å; F231-L321 HydrophobicContact CE1-CB 3.82Å; F231-L321 HydrophobicContact CZ-CB 4.46Å; F231-K322 HydrophobicContact CB-CB 4.27Å; F231-K322 HydrophobicContact CB-CD 4.19Å; F231-K322 HydrophobicContact CB-CG 4.19Å; F231-K322 HydrophobicContact CD1-CB 4.36Å; F231-K322 HydrophobicContact CD2-CB 4.34Å; F231-K322 HydrophobicContact CD2-CG 4.23Å; F231-K322 HydrophobicContact CG-CB 4.09Å; F231-K322 HydrophobicContact CG-CG 4.26Å; F231-F325 HydrophobicContact CE2-CB 3.66Å; F231-F325 AromaticContact CE2-CD1 3.99Å; F231-F325 HydrophobicContact CE2-CD1 3.99Å; F231-F325 AromaticContact CE2-CG 3.79Å; F231-F325 HydrophobicContact CE2-CG 3.79Å; F231-F325 HydrophobicContact CZ-CB 3.92Å; F231-F325 HydrophobicContact CZ-CG 4.27Å
232	E	88.8	Confident	76.1	Confident	88 Å²	88	62.8 Å²	62.8	41%	0.411	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.5	175.8	-49.5	-163.9	-179.5	0	0	109.5	T306 N307 R308 K322	E232-T306 HydrophobicContact CB-CG2 4.05Å; E232-N307 CarbonylContact C-O 3.53Å; E232-N307 WeakPolarHBondContact CA-O 3.13Å; E232-R308 HydrophobicContact CB-CG 4.46Å; E232-R308 HydrophobicContact CG-CG 3.9Å; E232-R308 IonicContact OE1-CZ 2.8Å; E232-R308 IonicContact OE1-NE 2.79Å; E232-R308 PolarHBondContact OE1-NE 3.43Å; E232-R308 IonicContact OE1-NH2 3.28Å; E232-R308 IonicContact OE2-CZ 2.72Å; E232-R308 IonicContact OE2-NE 3.96Å; E232-R308 PolarHBondContact OE2-NE 3.12Å; E232-R308 IonicContact OE2-NH2 2.64Å; E232-R308 PolarHBondContact OE2-NH2 2.59Å; E232-K322 WeakPolarHBondContact O-CE 3.39Å
233	V	90.4	Very high	78.3	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.03	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	116.7	178.8	176.4	0	0	0	0	109.1	F231 N307 K322 F325 I326 V329	F231-V233 HydrophobicContact CD2-CG2 3.99Å; F231-V233 HydrophobicContact CE2-CG2 4.35Å; V233-N307 PolarHBondContact N-O 3Å; V233-N307 WeakPolarHBondContact O-CB 3.12Å; V233-N307 PolarHBondContact O-N 3.45Å; V233-N307 PolarHBondContact O-ND2 2.86Å; V233-K322 HydrophobicContact CG2-CG 4.04Å; V233-F325 HydrophobicContact CB-CD1 3.8Å; V233-F325 HydrophobicContact CB-CE1 4.1Å; V233-F325 HydrophobicContact CG1-CD1 4.13Å; V233-F325 HydrophobicContact CG1-CE1 4.44Å; V233-F325 HydrophobicContact CG2-CD1 3.84Å; V233-I326 HydrophobicContact CB-CG1 4.49Å; V233-I326 HydrophobicContact CG1-CG1 3.78Å; V233-I326 HydrophobicContact CG2-CG1 3.8Å; V233-V329 HydrophobicContact CG1-CB 4.37Å; V233-V329 HydrophobicContact CG1-CG2 4.04Å
234	P	89.5	Confident	80.2	Confident	97 Å²	97	59.5 Å²	59.5	63%	0.63	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	149.7	176.1	30.4	-34.1	0	0	0	111.1
235	G	88.4	Confident	82.2	Confident	26 Å²	26	51.1 Å²	51.1	27%	0.268	28%	0.278	S	S	.	.	S	Bend	trans	116	-177.9	176.3	0	0	0	0	0	114.2	R305 N307	G235-R305 PolarHBondContact N-O 3.49Å; G235-N307 PolarHBondContact O-ND2 3.06Å
236	N	88	Confident	83.7	Confident	55 Å²	55	48.8 Å²	48.8	29%	0.294	26%	0.262	S	S	.	.			trans	-113.5	122.2	-175.1	-61.4	-38.3	0	0	0	110.1	S273 K275 R305	N236-S273 PolarHBondContact OD1-OG 2.75Å; N236-K275 HydrophobicContact CB-CB 4.33Å; N236-R305 WeakPolarHBondContact OD1-CD 3.29Å
237	A	88.1	Confident	84.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-83.3	143.3	172.5	0	0	0	0	0	110.2	L242 S273 I274 K275 V329	A237-L242 HydrophobicContact CB-CB 4.41Å; A237-S273 PolarHBondContact N-O 2.89Å; A237-I274 CarbonylContact O-C 3.51Å; A237-I274 WeakPolarHBondContact O-CA 3.38Å; A237-K275 PolarHBondContact O-N 2.84Å; A237-V329 HydrophobicContact CB-CG2 4.26Å
238	K	89.1	Confident	84.9	Confident	66 Å²	66	47 Å²	47	29%	0.287	25%	0.249	S	C	.	.			trans	-73.7	140.1	162.3	-77.5	173.5	167.3	166.2	0	108.8	E240 H241 L242 K275 E331	K238-E240 VanDerWaalsContact C-N 3.29Å; K238-E240 PolarHBondContact O-N 2.95Å; K238-H241 HydrophobicContact CB-CB 4.4Å; K238-H241 PolarHBondContact O-N 3.04Å; K238-L242 WeakPolarHBondContact O-CB 3.4Å; K238-L242 PolarHBondContact O-N 3.14Å; K238-K275 HydrophobicContact CG-CD 4.04Å; K238-E331 HydrophobicContact CD-CG 4.43Å; K238-E331 WeakPolarHBondContact CD-OE1 3.24Å; K238-E331 WeakPolarHBondContact CE-OE1 3.16Å; K238-E331 IonicContact NZ-OE1 3.09Å; K238-E331 PolarHBondContact NZ-OE1 3.11Å; K238-E331 VanDerWaalsContact NZ-OE1 3.09Å; K238-E331 IonicContact NZ-OE2 2.77Å; K238-E331 PolarHBondContact NZ-OE2 3.45Å
239	E	87.5	Confident	85.4	Confident	78 Å²	78	43 Å²	43	36%	0.364	22%	0.224	S	C	.	.	H	α-helix	trans	-57.2	-43.2	-179.4	-167.7	167.8	151.1	0	0	111.8	H241 L242 N243 I274 K277	E239-H241 PolarHBondContact O-N 3.01Å; E239-L242 PolarHBondContact O-N 3.12Å; E239-N243 WeakPolarHBondContact O-CB 3.39Å; E239-N243 PolarHBondContact O-N 2.92Å; E239-I274 HydrophobicContact CB-CG2 3.93Å; E239-I274 HydrophobicContact CG-CD1 4.31Å; E239-K277 WeakPolarHBondContact OE2-CE 3.4Å; E239-K277 IonicContact OE2-NZ 3.7Å; E239-K277 PolarHBondContact OE2-NZ 3.12Å
240	E	86.6	Confident	85	Confident	147 Å²	147	42.5 Å²	42.5	69%	0.687	22%	0.222	S	C	*	.	H	α-helix	trans	-59	-47.7	177.5	-63.4	176	179.2	0	0	112.6	K238 L242 N243 M244	K238-E240 VanDerWaalsContact C-N 3.29Å; K238-E240 PolarHBondContact O-N 2.95Å; E240-L242 VanDerWaalsContact C-N 3.34Å; E240-L242 PolarHBondContact O-N 2.87Å; E240-N243 PolarHBondContact O-N 3.17Å; E240-M244 WeakPolarHBondContact O-CG 3.39Å; E240-M244 PolarHBondContact O-N 3.46Å
241	H	87.1	Confident	84.3	Confident	48 Å²	48	45.2 Å²	45.2	22%	0.222	23%	0.225	C	C	.	.	H	α-helix	trans	-69.3	-34.2	179.9	-62.3	174.6	0	0	0	112	K238 E239 F245 T328	K238-H241 HydrophobicContact CB-CB 4.4Å; K238-H241 PolarHBondContact O-N 3.04Å; E239-H241 PolarHBondContact O-N 3.01Å; H241-F245 WeakPolarHBondContact O-CB 3.38Å; H241-F245 PolarHBondContact O-N 3.48Å; H241-T328 HydrophobicContact CB-CG2 3.81Å; H241-T328 WeakPolarHBondContact O-CG2 3.08Å
242	L	87.1	Confident	83.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-46.5	175	177.6	65.9	0	0	0	110.6	A237 K238 E239 E240 M244 F245 I246 V272 I274 L292 F325	A237-L242 HydrophobicContact CB-CB 4.41Å; K238-L242 WeakPolarHBondContact O-CB 3.4Å; K238-L242 PolarHBondContact O-N 3.14Å; E239-L242 PolarHBondContact O-N 3.12Å; E240-L242 VanDerWaalsContact C-N 3.34Å; E240-L242 PolarHBondContact O-N 2.87Å; L242-M244 PolarHBondContact O-N 2.67Å; L242-F245 WeakPolarHBondContact O-CB 3.49Å; L242-F245 PolarHBondContact O-N 3.33Å; L242-I246 HydrophobicContact CD1-CD1 3.99Å; L242-I246 HydrophobicContact CD1-CG1 4.37Å; L242-I246 HydrophobicContact CG-CD1 3.83Å; L242-I246 VanDerWaalsContact O-CG1 3.29Å; L242-I246 WeakPolarHBondContact O-CG1 3.04Å; L242-I246 PolarHBondContact O-N 2.87Å; L242-V272 HydrophobicContact CD1-CG1 4.41Å; L242-V272 HydrophobicContact CD2-CB 4.29Å; L242-V272 HydrophobicContact CD2-CG2 3.78Å; L242-I274 HydrophobicContact CD2-CD1 4.28Å; L242-I274 HydrophobicContact CD2-CG1 4.43Å; L242-L292 HydrophobicContact CD2-CD1 4.47Å; L242-L292 HydrophobicContact CD2-CD2 4Å; L242-F325 HydrophobicContact CD1-CE2 3.66Å; L242-F325 HydrophobicContact CD1-CZ 4.25Å
243	N	85.3	Confident	82	Confident	35 Å²	35	49.2 Å²	49.2	19%	0.187	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-46.6	177	-74.7	-13.7	0	0	0	111.2	E239 E240 F245 I246 Q247 Y290 L292	E239-N243 WeakPolarHBondContact O-CB 3.39Å; E239-N243 PolarHBondContact O-N 2.92Å; E240-N243 PolarHBondContact O-N 3.17Å; N243-F245 VanDerWaalsContact C-N 3.33Å; N243-F245 PolarHBondContact O-N 2.84Å; N243-I246 PolarHBondContact O-N 3.38Å; N243-Q247 WeakPolarHBondContact O-CB 3.23Å; N243-Q247 WeakPolarHBondContact O-CG 3.44Å; N243-Q247 PolarHBondContact O-N 2.9Å; N243-Y290 WeakPolarHBondContact CB-OH 3.42Å; N243-Y290 WeakPolarHBondContact OD1-CE2 3.24Å; N243-Y290 PolarHBondContact OD1-OH 3.47Å; N243-L292 VanDerWaalsContact OD1-CD1 3.23Å; N243-L292 WeakPolarHBondContact OD1-CD1 3.48Å
244	M	83.4	Confident	80.8	Confident	78 Å²	78	51.2 Å²	51.2	38%	0.384	25%	0.253	S	S	.	.	H	α-helix	trans	-60.2	-41.5	175.3	-71.3	176.9	63.6	0	0	112.5	E240 L242 N248 W336	E240-M244 WeakPolarHBondContact O-CG 3.39Å; E240-M244 PolarHBondContact O-N 3.46Å; L242-M244 PolarHBondContact O-N 2.67Å; M244-N248 WeakPolarHBondContact O-CB 3.22Å; M244-N248 VanDerWaalsContact O-CG 3.24Å; M244-N248 PolarHBondContact O-N 3.37Å; M244-N248 PolarHBondContact O-OD1 2.93Å; M244-W336 HydrophobicContact CB-CH2 4.36Å; M244-W336 HydrophobicContact CB-CZ2 4.32Å; M244-W336 HydrophobicContact CE-CH2 3.22Å; M244-W336 HydrophobicContact CE-CZ2 3.99Å; M244-W336 HydrophobicContact CE-CZ3 3.56Å
245	F	86.6	Confident	80	Confident	11 Å²	11	47.1 Å²	47.1	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-46.5	175.5	168.4	-95.2	0	0	0	111.9	H241 L242 N243 L249 L324 F325 T328	H241-F245 WeakPolarHBondContact O-CB 3.38Å; H241-F245 PolarHBondContact O-N 3.48Å; L242-F245 WeakPolarHBondContact O-CB 3.49Å; L242-F245 PolarHBondContact O-N 3.33Å; N243-F245 VanDerWaalsContact C-N 3.33Å; N243-F245 PolarHBondContact O-N 2.84Å; F245-L249 HydrophobicContact CE1-CD2 4.05Å; F245-L249 HydrophobicContact CZ-CD2 3.96Å; F245-L249 VanDerWaalsContact O-CB 3.26Å; F245-L249 WeakPolarHBondContact O-CB 3.43Å; F245-L249 PolarHBondContact O-N 3.45Å; F245-L249 VanDerWaalsContact O-N 3.12Å; F245-L324 HydrophobicContact CD2-CB 4.28Å; F245-L324 HydrophobicContact CE2-CB 3.81Å; F245-F325 AromaticContact CD1-CD2 3.85Å; F245-F325 HydrophobicContact CD1-CD2 3.85Å; F245-F325 HydrophobicContact CD1-CE2 4.3Å; F245-F325 AromaticContact CE1-CD2 3.65Å; F245-F325 HydrophobicContact CE1-CD2 3.65Å; F245-F325 HydrophobicContact CE1-CE2 4.34Å; F245-F325 HydrophobicContact CE2-CB 4.23Å; F245-F325 HydrophobicContact CE2-CD2 4.38Å; F245-F325 HydrophobicContact CG-CD2 4.31Å; F245-F325 HydrophobicContact CZ-CB 4.18Å; F245-F325 AromaticContact CZ-CD2 3.94Å; F245-F325 HydrophobicContact CZ-CD2 3.94Å; F245-T328 HydrophobicContact CB-CG2 4.25Å
246	I	83.9	Confident	79.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-45.4	-179.1	-62.2	161.2	0	0	0	110.4	L242 N243 N248 L249 L250 L268 V283 Y290	L242-I246 HydrophobicContact CD1-CD1 3.99Å; L242-I246 HydrophobicContact CD1-CG1 4.37Å; L242-I246 HydrophobicContact CG-CD1 3.83Å; L242-I246 VanDerWaalsContact O-CG1 3.29Å; L242-I246 WeakPolarHBondContact O-CG1 3.04Å; L242-I246 PolarHBondContact O-N 2.87Å; N243-I246 PolarHBondContact O-N 3.38Å; I246-N248 PolarHBondContact O-N 3.37Å; I246-L249 PolarHBondContact O-N 3.03Å; I246-L249 VanDerWaalsContact O-N 3.15Å; I246-L250 HydrophobicContact CG2-CD1 3.54Å; I246-L250 HydrophobicContact CG2-CG 3.96Å; I246-L250 WeakPolarHBondContact O-CB 3.45Å; I246-L250 WeakPolarHBondContact O-CG 3.3Å; I246-L250 PolarHBondContact O-N 2.93Å; I246-L268 HydrophobicContact CD1-CD2 4.49Å; I246-L268 HydrophobicContact CG1-CD2 3.97Å; I246-L268 HydrophobicContact CG2-CD2 3.96Å; I246-V283 HydrophobicContact CD1-CG2 3.54Å; I246-V283 HydrophobicContact CG1-CG2 4.49Å; I246-Y290 HydrophobicContact CB-CG 4.5Å; I246-Y290 HydrophobicContact CD1-CD2 4Å; I246-Y290 HydrophobicContact CD1-CE2 4.05Å; I246-Y290 HydrophobicContact CG2-CD1 3.63Å; I246-Y290 HydrophobicContact CG2-CD2 3.9Å; I246-Y290 HydrophobicContact CG2-CE1 4.1Å; I246-Y290 HydrophobicContact CG2-CE2 4.35Å; I246-Y290 HydrophobicContact CG2-CG 3.51Å
247	Q	80	Confident	79.1	Confident	61 Å²	61	47.2 Å²	47.2	29%	0.285	22%	0.216	S	C	.	.	H	α-helix	trans	-59.4	-44.8	178.1	-72.2	176.8	-14.3	0	0	111.7	N243 L249 L250 W251 E252 Y290	N243-Q247 WeakPolarHBondContact O-CB 3.23Å; N243-Q247 WeakPolarHBondContact O-CG 3.44Å; N243-Q247 PolarHBondContact O-N 2.9Å; Q247-L249 VanDerWaalsContact C-N 3.26Å; Q247-L249 PolarHBondContact O-N 2.83Å; Q247-L250 PolarHBondContact O-N 2.96Å; Q247-W251 HydrophobicContact CB-CD2 4.33Å; Q247-W251 HydrophobicContact CB-CE3 3.71Å; Q247-W251 HydrophobicContact CB-CZ3 4.02Å; Q247-W251 VanDerWaalsContact CD-CZ3 3.4Å; Q247-W251 HydrophobicContact CG-CD2 4.3Å; Q247-W251 HydrophobicContact CG-CE3 3.61Å; Q247-W251 HydrophobicContact CG-CH2 3.87Å; Q247-W251 HydrophobicContact CG-CZ2 4.5Å; Q247-W251 HydrophobicContact CG-CZ3 3.38Å; Q247-W251 WeakPolarHBondContact O-CA 3.47Å; Q247-W251 VanDerWaalsContact O-CB 3.27Å; Q247-W251 WeakPolarHBondContact O-CB 3.15Å; Q247-W251 PolarHBondContact O-N 3.03Å; Q247-E252 PolarHBondContact O-N 3.25Å; Q247-Y290 HydrophobicContact CG-CE1 3.8Å
248	N	77.9	Confident	78.7	Confident	17 Å²	17	53.4 Å²	53.4	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-32.3	178.3	-71.7	9.1	0	0	0	112.7	M244 I246 W336	M244-N248 WeakPolarHBondContact O-CB 3.22Å; M244-N248 VanDerWaalsContact O-CG 3.24Å; M244-N248 PolarHBondContact O-N 3.37Å; M244-N248 PolarHBondContact O-OD1 2.93Å; I246-N248 PolarHBondContact O-N 3.37Å; N248-W336 WeakPolarHBondContact ND2-CH2 3.1Å; N248-W336 WeakPolarHBondContact ND2-CZ2 3Å
249	L	80.5	Confident	78.2	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-76.9	-35.7	-179.9	-173	64.1	0	0	0	112.7	F245 I246 Q247 V255 V265 L311 L321	F245-L249 HydrophobicContact CE1-CD2 4.05Å; F245-L249 HydrophobicContact CZ-CD2 3.96Å; F245-L249 VanDerWaalsContact O-CB 3.26Å; F245-L249 WeakPolarHBondContact O-CB 3.43Å; F245-L249 PolarHBondContact O-N 3.45Å; F245-L249 VanDerWaalsContact O-N 3.12Å; I246-L249 PolarHBondContact O-N 3.03Å; I246-L249 VanDerWaalsContact O-N 3.15Å; Q247-L249 VanDerWaalsContact C-N 3.26Å; Q247-L249 PolarHBondContact O-N 2.83Å; L249-V255 HydrophobicContact CD1-CG2 4.33Å; L249-V265 HydrophobicContact CD1-CG2 3.71Å; L249-V265 HydrophobicContact CD2-CG2 3.95Å; L249-V265 HydrophobicContact CG-CB 4.32Å; L249-V265 HydrophobicContact CG-CG2 3.63Å; L249-L311 HydrophobicContact CD2-CD2 3.4Å; L249-L311 VanDerWaalsContact CD2-CD2 3.4Å; L249-L321 HydrophobicContact CD1-CD2 3.51Å; L249-L321 HydrophobicContact CD2-CD2 4.33Å
250	L	71.1	Confident	77.7	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-94	-41.8	-176.3	-61.4	-172.8	0	0	0	113.1	I246 Q247 V265 H287 Y290	I246-L250 HydrophobicContact CG2-CD1 3.54Å; I246-L250 HydrophobicContact CG2-CG 3.96Å; I246-L250 WeakPolarHBondContact O-CB 3.45Å; I246-L250 WeakPolarHBondContact O-CG 3.3Å; I246-L250 PolarHBondContact O-N 2.93Å; Q247-L250 PolarHBondContact O-N 2.96Å; L250-V265 HydrophobicContact CD2-CB 3.85Å; L250-V265 HydrophobicContact CD2-CG1 3.61Å; L250-H287 WeakPolarHBondContact CB-O 3.19Å; L250-H287 WeakPolarHBondContact CD2-O 3.36Å; L250-Y290 HydrophobicContact CD1-CD1 4.44Å
251	W	66.8	Low	77.3	Confident	118 Å²	118	55 Å²	55	45%	0.447	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-50.3	-174.2	-61.5	-23.3	0	0	0	113.3	Q247 K253 E288 Y290	Q247-W251 HydrophobicContact CB-CD2 4.33Å; Q247-W251 HydrophobicContact CB-CE3 3.71Å; Q247-W251 HydrophobicContact CB-CZ3 4.02Å; Q247-W251 VanDerWaalsContact CD-CZ3 3.4Å; Q247-W251 HydrophobicContact CG-CD2 4.3Å; Q247-W251 HydrophobicContact CG-CE3 3.61Å; Q247-W251 HydrophobicContact CG-CH2 3.87Å; Q247-W251 HydrophobicContact CG-CZ2 4.5Å; Q247-W251 HydrophobicContact CG-CZ3 3.38Å; Q247-W251 WeakPolarHBondContact O-CA 3.47Å; Q247-W251 VanDerWaalsContact O-CB 3.27Å; Q247-W251 WeakPolarHBondContact O-CB 3.15Å; Q247-W251 PolarHBondContact O-N 3.03Å; W251-K253 VanDerWaalsContact C-N 3.25Å; W251-K253 PolarHBondContact O-N 3.41Å; W251-E288 PolarHBondContact NE1-O 3.04Å; W251-Y290 HydrophobicContact CZ2-CE1 4.5Å
252	E	62.2	Low	76.8	Confident	93 Å²	93	54.8 Å²	54.8	44%	0.435	26%	0.262	S	S	.	.	S	Bend	trans	-74.7	-17.7	-166.9	-68.6	-152.6	170.3	0	0	113.2	Q247 N254	Q247-E252 PolarHBondContact O-N 3.25Å; E252-N254 HydrophobicContact CB-CB 4.24Å; E252-N254 PolarHBondContact O-N 3.48Å; E252-N254 PolarHBondContact O-ND2 3.46Å; E252-N254 PolarHBondContact O-OD1 2.69Å; E252-N254 VanDerWaalsContact O-OD1 3.05Å; E252-N254 PolarHBondContact OE2-ND2 3.39Å
253	K	63.7	Low	76.5	Confident	86 Å²	86	55 Å²	55	37%	0.374	26%	0.263	S	S	.	.			trans	49.6	21.1	-179.5	-61	179.6	-173.9	174	0	113.8	W251 E288 C346	W251-K253 VanDerWaalsContact C-N 3.25Å; W251-K253 PolarHBondContact O-N 3.41Å; K253-E288 IonicContact NZ-OE1 3.82Å; K253-C346 PolarHBondContact O-SG 2.67Å; K253-C346 VanDerWaalsContact O-SG 3.32Å
254	N	64.6	Low	76.2	Confident	47 Å²	47	56.4 Å²	56.4	25%	0.251	27%	0.269	S	S	.	.			trans	-89.5	-2.2	-171.3	-76.6	-25.6	0	0	0	113.2	E252 F340	E252-N254 HydrophobicContact CB-CB 4.24Å; E252-N254 PolarHBondContact O-N 3.48Å; E252-N254 PolarHBondContact O-ND2 3.46Å; E252-N254 PolarHBondContact O-OD1 2.69Å; E252-N254 VanDerWaalsContact O-OD1 3.05Å; E252-N254 PolarHBondContact OE2-ND2 3.39Å; N254-F340 HydrophobicContact CB-CD1 4.3Å; N254-F340 HydrophobicContact CB-CE1 4.43Å
255	V	71.9	Confident	75.9	Confident	11 Å²	11	53 Å²	53	7%	0.067	25%	0.252	C	S	.	.			trans	-89.2	118.8	-178	-174.6	0	0	0	0	109.5	L249 M263 I320 L324 F340	L249-V255 HydrophobicContact CD1-CG2 4.33Å; V255-M263 HydrophobicContact CG1-CE 4Å; V255-M263 HydrophobicContact CG1-CG 4.35Å; V255-M263 HydrophobicContact CG1-SD 3.82Å; V255-M263 WeakPolarHBondContact O-CB 3.23Å; V255-M263 WeakPolarHBondContact O-CG 3.41Å; V255-M263 PolarHBondContact O-N 2.89Å; V255-I320 HydrophobicContact CG1-CG2 4.34Å; V255-L324 HydrophobicContact CG1-CD1 3.78Å; V255-L324 HydrophobicContact CG2-CD1 4.32Å; V255-F340 HydrophobicContact CG2-CE1 4.37Å
256	R	77.4	Confident	75	Confident	62 Å²	62	54.1 Å²	54.1	23%	0.234	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-108.1	146.9	178.4	-60.9	-173.2	179.2	-159.9	1.6	112.3	N260 H261 M263 Q344	R256-N260 WeakPolarHBondContact CD-OD1 3.48Å; R256-N260 PolarHBondContact NH1-ND2 3.04Å; R256-N260 PolarHBondContact NH1-OD1 2.82Å; R256-H261 CarbonylContact C-O 3.53Å; R256-H261 VanDerWaalsContact CA-O 3.24Å; R256-H261 WeakPolarHBondContact CA-O 3.33Å; R256-M263 WeakPolarHBondContact O-CE 3.49Å; R256-Q344 VanDerWaalsContact NH1-OE1 3.16Å
257	N	79.9	Confident	74.3	Confident	20 Å²	20	56.1 Å²	56.1	11%	0.107	27%	0.266	C	S	.	.			trans	-78.7	177.5	175	73.6	9.5	0	0	0	112.6	D259 N260 H261 M263 N315 D317	N257-D259 PolarHBondContact O-N 2.65Å; N257-D259 VanDerWaalsContact O-N 3.16Å; N257-D259 VanDerWaalsContact OD1-C 3.32Å; N257-D259 WeakPolarHBondContact OD1-CA 2.95Å; N257-D259 PolarHBondContact OD1-N 2.83Å; N257-N260 PolarHBondContact O-N 3.26Å; N257-N260 PolarHBondContact OD1-N 3.38Å; N257-N260 VanDerWaalsContact OD1-N 3.13Å; N257-H261 PolarHBondContact N-O 3.19Å; N257-H261 PolarHBondContact OD1-N 3.17Å; N257-H261 PolarHBondContact OD1-O 3.23Å; N257-M263 VanDerWaalsContact CA-CE 3.44Å; N257-M263 HydrophobicContact CB-CE 3.72Å; N257-M263 HydrophobicContact CB-CG 4.28Å; N257-N315 WeakPolarHBondContact CB-O 3.23Å; N257-N315 PolarHBondContact ND2-O 3.09Å; N257-N315 VanDerWaalsContact ND2-O 3.09Å; N257-D317 HydrophobicContact CB-CB 3.98Å
258	K	79.9	Confident	74.3	Confident	131 Å²	131	53.2 Å²	53.2	57%	0.57	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.1	179.2	-72.2	169.8	-167.1	163	0	113.2	N260 D317 D319 I320	K258-N260 VanDerWaalsContact C-N 3.29Å; K258-D317 WeakPolarHBondContact CD-OD2 3.5Å; K258-D317 VanDerWaalsContact CE-OD2 3.22Å; K258-D317 WeakPolarHBondContact CE-OD2 3.38Å; K258-D317 VanDerWaalsContact CG-OD2 3.23Å; K258-D317 WeakPolarHBondContact CG-OD2 3.36Å; K258-D317 IonicContact NZ-OD1 3.72Å; K258-D317 IonicContact NZ-OD2 2.67Å; K258-D319 IonicContact NZ-OD2 3.94Å; K258-D319 PolarHBondContact NZ-OD2 3.23Å; K258-I320 HydrophobicContact CG-CD1 3.97Å
259	D	79	Confident	74	Confident	122 Å²	122	56.4 Å²	56.4	65%	0.652	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	10.8	178.4	-54.7	-49.5	0	0	0	112.8	N257 H261	N257-D259 PolarHBondContact O-N 2.65Å; N257-D259 VanDerWaalsContact O-N 3.16Å; N257-D259 VanDerWaalsContact OD1-C 3.32Å; N257-D259 WeakPolarHBondContact OD1-CA 2.95Å; N257-D259 PolarHBondContact OD1-N 2.83Å; D259-H261 VanDerWaalsContact C-N 3.26Å; D259-H261 PolarHBondContact O-N 2.87Å
260	N	76.8	Confident	74	Confident	101 Å²	101	56.7 Å²	56.7	54%	0.54	27%	0.269	S	S	.	.	S	Bend	trans	65.6	18.5	178.8	-156.2	36.4	0	0	0	115.2	R256 N257 K258	R256-N260 WeakPolarHBondContact CD-OD1 3.48Å; R256-N260 PolarHBondContact NH1-ND2 3.04Å; R256-N260 PolarHBondContact NH1-OD1 2.82Å; N257-N260 PolarHBondContact O-N 3.26Å; N257-N260 PolarHBondContact OD1-N 3.38Å; N257-N260 VanDerWaalsContact OD1-N 3.13Å; K258-N260 VanDerWaalsContact C-N 3.29Å
261	H	78.2	Confident	74.8	Confident	101 Å²	101	58.4 Å²	58.4	47%	0.468	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-85.1	141.6	170.8	-60.1	111	0	0	0	110.8	R256 N257 D259 M263 N315	R256-H261 CarbonylContact C-O 3.53Å; R256-H261 VanDerWaalsContact CA-O 3.24Å; R256-H261 WeakPolarHBondContact CA-O 3.33Å; N257-H261 PolarHBondContact N-O 3.19Å; N257-H261 PolarHBondContact OD1-N 3.17Å; N257-H261 PolarHBondContact OD1-O 3.23Å; D259-H261 VanDerWaalsContact C-N 3.26Å; D259-H261 PolarHBondContact O-N 2.87Å; H261-M263 PolarHBondContact O-N 2.79Å; H261-N315 HydrophobicContact CB-CB 4.18Å
262	C	77.6	Confident	76	Confident	43 Å²	43	52.8 Å²	52.8	29%	0.291	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-67.2	129.3	176	-46	0	0	0	0	109.5	C346	C262-C346 HydrophobicContact CB-CB 3.99Å; C262-C346 WeakPolarHBondContact CB-SG 3.21Å; C262-C346 WeakPolarHBondContact SG-CB 3.36Å; C262-C346 CovalentContact SG-SG 2.04Å; C262-C346 PolarHBondContact SG-SG 3.19Å
263	M	80.7	Confident	77.4	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.02	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-78.2	130.1	174.4	-63.9	-167.3	-159.3	0	0	108.8	V255 R256 N257 H261 L316 D317 I320 L321	V255-M263 HydrophobicContact CG1-CE 4Å; V255-M263 HydrophobicContact CG1-CG 4.35Å; V255-M263 HydrophobicContact CG1-SD 3.82Å; V255-M263 WeakPolarHBondContact O-CB 3.23Å; V255-M263 WeakPolarHBondContact O-CG 3.41Å; V255-M263 PolarHBondContact O-N 2.89Å; R256-M263 WeakPolarHBondContact O-CE 3.49Å; N257-M263 VanDerWaalsContact CA-CE 3.44Å; N257-M263 HydrophobicContact CB-CE 3.72Å; N257-M263 HydrophobicContact CB-CG 4.28Å; H261-M263 PolarHBondContact O-N 2.79Å; M263-L316 HydrophobicContact CB-CD2 4.06Å; M263-D317 HydrophobicContact CE-CB 3.41Å; M263-D317 VanDerWaalsContact CE-CB 3.41Å; M263-D317 HydrophobicContact SD-CB 4.44Å; M263-I320 HydrophobicContact CE-CB 3.93Å; M263-I320 HydrophobicContact CE-CD1 4.01Å; M263-I320 HydrophobicContact CE-CG2 3.88Å; M263-L321 HydrophobicContact SD-CD1 4.21Å; M263-L321 HydrophobicContact SD-CD2 3.99Å; M263-L321 HydrophobicContact SD-CG 3.93Å
264	E	78.3	Confident	78.6	Confident	66 Å²	66	44.3 Å²	44.3	31%	0.308	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	112.9	176.7	-176.9	-174.5	-169.7	0	0	108.2	G313 R314	E264-G313 CarbonylContact O-C 3.39Å; E264-G313 WeakPolarHBondContact O-CA 3.26Å; E264-R314 HydrophobicContact CB-CB 4.4Å; E264-R314 PolarHBondContact N-O 3.31Å; E264-R314 VanDerWaalsContact N-O 3.14Å; E264-R314 PolarHBondContact O-N 3.25Å; E264-R314 IonicContact OE2-NH1 3.01Å
265	V	76.3	Confident	79.6	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.042	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.5	173.5	176.7	0	0	0	0	109	L249 L250 L268 L311 L316	L249-V265 HydrophobicContact CD1-CG2 3.71Å; L249-V265 HydrophobicContact CD2-CG2 3.95Å; L249-V265 HydrophobicContact CG-CB 4.32Å; L249-V265 HydrophobicContact CG-CG2 3.63Å; L250-V265 HydrophobicContact CD2-CB 3.85Å; L250-V265 HydrophobicContact CD2-CG1 3.61Å; V265-L268 HydrophobicContact CG1-CB 4.46Å; V265-L311 HydrophobicContact CG1-CD2 4.33Å; V265-L311 HydrophobicContact CG2-CD2 4.09Å; V265-L316 HydrophobicContact CG2-CD2 3.76Å
266	I	68	Low	80.2	Confident	33 Å²	33	53.2 Å²	53.2	17%	0.169	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-38.6	177.3	-61.7	169.1	0	0	0	109.6	I226 H287 L312	I226-I266 HydrophobicContact CD1-CD1 3.99Å; I226-I266 HydrophobicContact CG1-CD1 4.27Å; I226-I266 HydrophobicContact CG2-CD1 4.5Å; I266-H287 PolarHBondContact O-N 2.84Å; I266-L312 PolarHBondContact N-O 3Å
267	R	70.3	Confident	80.6	Confident	43 Å²	43	52.5 Å²	52.5	16%	0.162	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	139.1	-179.3	-161.9	179.4	-169.2	158.8	12	111.8	T203 G285 L311 L312	T203-R267 VanDerWaalsContact CG2-NH2 3.26Å; T203-R267 VanDerWaalsContact OG1-CZ 3.23Å; T203-R267 PolarHBondContact OG1-NH1 2.84Å; T203-R267 PolarHBondContact OG1-NH2 2.97Å; R267-G285 WeakPolarHBondContact CA-O 3.46Å; R267-G285 WeakPolarHBondContact CG-O 3.2Å; R267-L311 CarbonylContact O-C 3.6Å; R267-L311 WeakPolarHBondContact O-CA 3.41Å; R267-L312 HydrophobicContact CB-CB 4.04Å; R267-L312 HydrophobicContact CB-CD2 4.43Å; R267-L312 PolarHBondContact N-O 3.09Å; R267-L312 PolarHBondContact O-N 3.42Å
268	L	78.6	Confident	80.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.2	173	176.9	64	0	0	0	108.6	I246 V265 V283 Q284 G285 L309 L311	I246-L268 HydrophobicContact CD1-CD2 4.49Å; I246-L268 HydrophobicContact CG1-CD2 3.97Å; I246-L268 HydrophobicContact CG2-CD2 3.96Å; V265-L268 HydrophobicContact CG1-CB 4.46Å; L268-V283 HydrophobicContact CD2-CG2 4.01Å; L268-Q284 CarbonylContact O-C 3.57Å; L268-Q284 WeakPolarHBondContact O-CA 3.32Å; L268-G285 PolarHBondContact N-O 3.39Å; L268-G285 PolarHBondContact O-N 2.84Å; L268-L309 HydrophobicContact CD1-CD2 3.74Å; L268-L311 HydrophobicContact CD1-CD1 4.41Å; L268-L311 HydrophobicContact CD1-CD2 3.69Å; L268-L311 HydrophobicContact CD1-CG 3.61Å
269	K	72.4	Confident	81.1	Confident	84 Å²	84	50.5 Å²	50.5	37%	0.365	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.9	162.2	-73.5	-166.5	174.1	-170.1	0	109	V283 Q284 V310	K269-V283 CarbonylContact C-O 3.59Å; K269-V283 VanDerWaalsContact CA-O 3.3Å; K269-V283 WeakPolarHBondContact CA-O 3.47Å; K269-Q284 HydrophobicContact CG-CB 4.48Å; K269-V310 PolarHBondContact N-O 2.88Å; K269-V310 WeakPolarHBondContact O-CA 3.26Å; K269-V310 PolarHBondContact O-N 2.73Å; K269-V310 VanDerWaalsContact O-O 3.11Å
270	G	80.8	Confident	81.5	Confident	11 Å²	11	46.6 Å²	46.6	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	156.5	176.2	0	0	0	0	0	113	I282 V283 R308	G270-I282 CarbonylContact O-C 3.57Å; G270-I282 WeakPolarHBondContact O-CA 3.28Å; G270-V283 PolarHBondContact N-O 3.05Å; G270-V283 PolarHBondContact O-N 3.09Å; G270-R308 CarbonylContact C-O 3.6Å; G270-R308 WeakPolarHBondContact CA-O 3.35Å
271	L	88	Confident	82	Confident	43 Å²	43	41.8 Å²	41.8	23%	0.225	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.4	164.5	-168.5	75.4	0	0	0	106.4	Q280 V281 I282 W299 N307 R308	L271-Q280 HydrophobicContact CD1-CB 3.69Å; L271-Q280 HydrophobicContact CD2-CB 4.49Å; L271-Q280 HydrophobicContact CG-CB 4.2Å; L271-V281 CarbonylContact C-O 3.54Å; L271-V281 WeakPolarHBondContact CA-O 3.47Å; L271-I282 HydrophobicContact CD1-CG1 4.06Å; L271-W299 HydrophobicContact CD2-CH2 4.14Å; L271-N307 CarbonylContact O-C 3.5Å; L271-N307 WeakPolarHBondContact O-CA 3.03Å; L271-R308 PolarHBondContact N-O 3.15Å; L271-R308 PolarHBondContact O-N 2.83Å
272	V	91.8	Very high	82.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148.2	-175.6	-65	0	0	0	0	110.5	L242 I274 V281 V283 L292 N307 L309 F325	L242-V272 HydrophobicContact CD1-CG1 4.41Å; L242-V272 HydrophobicContact CD2-CB 4.29Å; L242-V272 HydrophobicContact CD2-CG2 3.78Å; V272-I274 HydrophobicContact CG2-CG1 4.3Å; V272-V281 HydrophobicContact CG2-CB 3.97Å; V272-V281 HydrophobicContact CG2-CG1 4.2Å; V272-V281 WeakPolarHBondContact CG2-O 3Å; V272-V281 PolarHBondContact N-O 2.88Å; V272-V281 PolarHBondContact O-N 3.11Å; V272-V283 HydrophobicContact CG1-CG1 3.85Å; V272-V283 HydrophobicContact CG2-CG1 4.47Å; V272-L292 HydrophobicContact CG2-CD2 4.42Å; V272-N307 WeakPolarHBondContact CA-OD1 3.42Å; V272-L309 HydrophobicContact CG1-CD2 4.26Å; V272-F325 HydrophobicContact CG1-CZ 4.37Å
273	S	91.4	Very high	82.5	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.			trans	-100.9	113.9	172.6	-176.8	0	0	0	0	108.8	N236 A237 R305 N307	N236-S273 PolarHBondContact OD1-OG 2.75Å; A237-S273 PolarHBondContact N-O 2.89Å; S273-R305 WeakPolarHBondContact OG-CD 3.35Å; S273-R305 PolarHBondContact OG-NH1 3.18Å; S273-N307 PolarHBondContact N-OD1 3.4Å
274	I	89.1	Confident	81.9	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-95.6	134.7	177.6	-56.7	-171.6	0	0	0	109.2	A237 E239 L242 V272 K277 V281	A237-I274 CarbonylContact O-C 3.51Å; A237-I274 WeakPolarHBondContact O-CA 3.38Å; E239-I274 HydrophobicContact CB-CG2 3.93Å; E239-I274 HydrophobicContact CG-CD1 4.31Å; L242-I274 HydrophobicContact CD2-CD1 4.28Å; L242-I274 HydrophobicContact CD2-CG1 4.43Å; V272-I274 HydrophobicContact CG2-CG1 4.3Å; I274-K277 HydrophobicContact CB-CB 4.27Å; I274-K277 HydrophobicContact CB-CD 4.07Å; I274-K277 HydrophobicContact CB-CG 4.18Å; I274-K277 HydrophobicContact CD1-CD 4.38Å; I274-K277 HydrophobicContact CG2-CD 4.12Å; I274-K277 HydrophobicContact CG2-CG 4.13Å; I274-K277 PolarHBondContact O-N 3.11Å; I274-V281 HydrophobicContact CD1-CB 4.06Å; I274-V281 HydrophobicContact CD1-CG1 3.94Å; I274-V281 HydrophobicContact CD1-CG2 3.86Å; I274-V281 HydrophobicContact CG1-CB 4.29Å; I274-V281 HydrophobicContact CG1-CG2 4.05Å
275	K	85.6	Confident	81.2	Confident	86 Å²	86	37.8 Å²	37.8	37%	0.374	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	138.5	173.4	-165.3	177.2	-174	173.8	0	109.3	N236 A237 K238 K277 E331	N236-K275 HydrophobicContact CB-CB 4.33Å; A237-K275 PolarHBondContact O-N 2.84Å; K238-K275 HydrophobicContact CG-CD 4.04Å; K275-K277 PolarHBondContact O-N 2.59Å; K275-K277 VanDerWaalsContact O-N 3.17Å; K275-E331 IonicContact NZ-OE1 3.11Å
276	D	83.9	Confident	80.4	Confident	159 Å²	159	41 Å²	41	85%	0.85	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.2	1.1	-178.6	-46.9	-45	0	0	0	115.9
277	K	85.2	Confident	80.1	Confident	47 Å²	47	43.7 Å²	43.7	20%	0.204	22%	0.223	C	C	.	.			trans	-103.9	132.9	168.6	-60.5	-166	-176.9	-169.8	0	111	E239 I274 K275 V281 E294 R305	E239-K277 WeakPolarHBondContact OE2-CE 3.4Å; E239-K277 IonicContact OE2-NZ 3.7Å; E239-K277 PolarHBondContact OE2-NZ 3.12Å; I274-K277 HydrophobicContact CB-CB 4.27Å; I274-K277 HydrophobicContact CB-CD 4.07Å; I274-K277 HydrophobicContact CB-CG 4.18Å; I274-K277 HydrophobicContact CD1-CD 4.38Å; I274-K277 HydrophobicContact CG2-CD 4.12Å; I274-K277 HydrophobicContact CG2-CG 4.13Å; I274-K277 PolarHBondContact O-N 3.11Å; K275-K277 PolarHBondContact O-N 2.59Å; K275-K277 VanDerWaalsContact O-N 3.17Å; K277-V281 HydrophobicContact CD-CG2 4.11Å; K277-E294 WeakPolarHBondContact CD-OE1 3.32Å; K277-E294 VanDerWaalsContact CE-OE1 3.31Å; K277-E294 WeakPolarHBondContact CE-OE1 3.2Å; K277-E294 IonicContact NZ-OE1 3.77Å; K277-E294 PolarHBondContact NZ-OE1 3.27Å; K277-R305 PolarHBondContact O-NH1 2.92Å; K277-R305 PolarHBondContact O-NH2 3.4Å; K277-R305 VanDerWaalsContact O-NH2 3.08Å
278	S	84.4	Confident	79.8	Confident	69 Å²	69	45.4 Å²	45.4	48%	0.483	23%	0.233	S	C	.	.			trans	-86.4	-20.9	175.1	58.7	0	0	0	0	113	S298 W299	S278-S298 WeakPolarHBondContact O-CA 3.46Å; S278-W299 PolarHBondContact O-N 3.41Å
279	Q	85.8	Confident	78.8	Confident	40 Å²	40	51.6 Å²	51.6	19%	0.187	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	154.6	178	-55.8	-46.7	-57.3	0	0	112.1	T295 V297 S298 W299	Q279-T295 WeakPolarHBondContact CB-O 3.49Å; Q279-T295 PolarHBondContact OE1-O 3Å; Q279-V297 PolarHBondContact OE1-O 2.89Å; Q279-S298 PolarHBondContact NE2-OG 2.86Å; Q279-S298 VanDerWaalsContact OE1-N 3.1Å; Q279-S298 PolarHBondContact OE1-OG 3.32Å; Q279-W299 PolarHBondContact O-NE1 3.45Å
280	Q	87.6	Confident	79	Confident	40 Å²	40	50 Å²	50	19%	0.187	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.3	165.8	-52.8	178.2	-13.3	0	0	109	L271 T295 V297 W299	L271-Q280 HydrophobicContact CD1-CB 3.69Å; L271-Q280 HydrophobicContact CD2-CB 4.49Å; L271-Q280 HydrophobicContact CG-CB 4.2Å; Q280-T295 WeakPolarHBondContact CB-OG1 3.3Å; Q280-T295 WeakPolarHBondContact O-CB 3.38Å; Q280-T295 WeakPolarHBondContact O-CG2 3.46Å; Q280-T295 PolarHBondContact O-N 2.98Å; Q280-T295 PolarHBondContact O-OG1 3.48Å; Q280-V297 HydrophobicContact CG-CG1 4.41Å; Q280-V297 WeakPolarHBondContact CG-O 3.44Å; Q280-V297 PolarHBondContact N-O 3.23Å; Q280-W299 HydrophobicContact CB-CZ2 4.17Å; Q280-W299 HydrophobicContact CG-CD2 3.85Å; Q280-W299 HydrophobicContact CG-CE3 4.3Å; Q280-W299 HydrophobicContact CG-CG 4.3Å; Q280-W299 HydrophobicContact CG-CH2 4.19Å; Q280-W299 HydrophobicContact CG-CZ2 3.76Å; Q280-W299 HydrophobicContact CG-CZ3 4.45Å
281	V	88.8	Confident	78.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.2	178.7	-178.3	0	0	0	0	108.8	L271 V272 I274 K277 L292 E293 E294	L271-V281 CarbonylContact C-O 3.54Å; L271-V281 WeakPolarHBondContact CA-O 3.47Å; V272-V281 HydrophobicContact CG2-CB 3.97Å; V272-V281 HydrophobicContact CG2-CG1 4.2Å; V272-V281 WeakPolarHBondContact CG2-O 3Å; V272-V281 PolarHBondContact N-O 2.88Å; V272-V281 PolarHBondContact O-N 3.11Å; I274-V281 HydrophobicContact CD1-CB 4.06Å; I274-V281 HydrophobicContact CD1-CG1 3.94Å; I274-V281 HydrophobicContact CD1-CG2 3.86Å; I274-V281 HydrophobicContact CG1-CB 4.29Å; I274-V281 HydrophobicContact CG1-CG2 4.05Å; K277-V281 HydrophobicContact CD-CG2 4.11Å; V281-L292 HydrophobicContact CG1-CB 4.13Å; V281-L292 HydrophobicContact CG1-CD2 3.96Å; V281-E293 CarbonylContact C-O 3.44Å; V281-E293 WeakPolarHBondContact CA-O 3.46Å; V281-E294 HydrophobicContact CG2-CG 4.19Å
282	I	82.5	Confident	78.3	Confident	63 Å²	63	53.1 Å²	53.1	32%	0.323	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	123.3	171.6	-68.7	170.2	0	0	0	107.6	G270 L271 L292 E293 T295	G270-I282 CarbonylContact O-C 3.57Å; G270-I282 WeakPolarHBondContact O-CA 3.28Å; L271-I282 HydrophobicContact CD1-CG1 4.06Å; I282-L292 WeakPolarHBondContact O-CA 3.47Å; I282-E293 PolarHBondContact N-O 2.9Å; I282-E293 PolarHBondContact O-N 3.05Å; I282-T295 HydrophobicContact CB-CG2 4.46Å; I282-T295 HydrophobicContact CD1-CG2 3.45Å; I282-T295 VanDerWaalsContact CD1-CG2 3.45Å; I282-T295 HydrophobicContact CG1-CG2 3.52Å
283	V	82.3	Confident	77.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.9	164.2	60	0	0	0	0	108.5	I246 L268 K269 G270 V272 L292 L309	I246-V283 HydrophobicContact CD1-CG2 3.54Å; I246-V283 HydrophobicContact CG1-CG2 4.49Å; L268-V283 HydrophobicContact CD2-CG2 4.01Å; K269-V283 CarbonylContact C-O 3.59Å; K269-V283 VanDerWaalsContact CA-O 3.3Å; K269-V283 WeakPolarHBondContact CA-O 3.47Å; G270-V283 PolarHBondContact N-O 3.05Å; G270-V283 PolarHBondContact O-N 3.09Å; V272-V283 HydrophobicContact CG1-CG1 3.85Å; V272-V283 HydrophobicContact CG2-CG1 4.47Å; V283-L292 HydrophobicContact CB-CD2 3.6Å; V283-L292 HydrophobicContact CG2-CD2 3.85Å; V283-L309 HydrophobicContact CG1-CD2 3.83Å
284	Q	68.6	Low	77.4	Confident	63 Å²	63	63.1 Å²	63.1	29%	0.294	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.4	172.6	58.7	-174	-9.2	0	0	109.9	L268 K269 Y290 D291 E293	L268-Q284 CarbonylContact O-C 3.57Å; L268-Q284 WeakPolarHBondContact O-CA 3.32Å; K269-Q284 HydrophobicContact CG-CB 4.48Å; Q284-Y290 CarbonylContact O-C 3.41Å; Q284-Y290 WeakPolarHBondContact O-CA 3.42Å; Q284-D291 HydrophobicContact CG-CB 4.4Å; Q284-D291 PolarHBondContact N-O 3.45Å; Q284-D291 PolarHBondContact O-N 3.36Å; Q284-E293 PolarHBondContact NE2-OE1 3.37Å
285	G	64.5	Low	76.8	Confident	3 Å²	3	63.9 Å²	63.9	3%	0.031	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142.9	176.8	0	0	0	0	0	112	R267 L268 L289	R267-G285 WeakPolarHBondContact CA-O 3.46Å; R267-G285 WeakPolarHBondContact CG-O 3.2Å; L268-G285 PolarHBondContact N-O 3.39Å; L268-G285 PolarHBondContact O-N 2.84Å; G285-L289 CarbonylContact C-O 3.53Å; G285-L289 WeakPolarHBondContact CA-O 3.43Å
286	V	58.8	Low	76.2	Confident	75 Å²	75	65.9 Å²	65.9	46%	0.455	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	117.8	175.4	-179.1	0	0	0	0	107	E288 L289	V286-E288 PolarHBondContact O-N 2.78Å; V286-E288 VanDerWaalsContact O-N 3.11Å; V286-L289 PolarHBondContact N-O 2.86Å; V286-L289 PolarHBondContact O-N 3.09Å
287	H	62.4	Low	75.9	Confident	90 Å²	90	61.9 Å²	61.9	42%	0.417	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	-115.3	-174.9	-151	71	0	0	0	110.9	L250 I266	L250-H287 WeakPolarHBondContact CB-O 3.19Å; L250-H287 WeakPolarHBondContact CD2-O 3.36Å; I266-H287 PolarHBondContact O-N 2.84Å
288	E	64.3	Low	75.8	Confident	79 Å²	79	62.5 Å²	62.5	37%	0.369	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.5	-179.2	-66.7	-179.6	-176.6	0	0	112.9	W251 K253 V286	W251-E288 PolarHBondContact NE1-O 3.04Å; K253-E288 IonicContact NZ-OE1 3.82Å; V286-E288 PolarHBondContact O-N 2.78Å; V286-E288 VanDerWaalsContact O-N 3.11Å
289	L	56.2	Low	75.6	Confident	129 Å²	129	61.1 Å²	61.1	68%	0.675	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.2	-179.1	-61.4	177.4	0	0	0	110.4	G285 V286	G285-L289 CarbonylContact C-O 3.53Å; G285-L289 WeakPolarHBondContact CA-O 3.43Å; V286-L289 PolarHBondContact N-O 2.86Å; V286-L289 PolarHBondContact O-N 3.09Å
290	Y	76.3	Confident	74.9	Confident	52 Å²	52	69.4 Å²	69.4	20%	0.204	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.3	169.4	80.7	-83.8	0	0	0	112.1	N243 I246 Q247 L250 W251 Q284 L292	N243-Y290 WeakPolarHBondContact CB-OH 3.42Å; N243-Y290 WeakPolarHBondContact OD1-CE2 3.24Å; N243-Y290 PolarHBondContact OD1-OH 3.47Å; I246-Y290 HydrophobicContact CB-CG 4.5Å; I246-Y290 HydrophobicContact CD1-CD2 4Å; I246-Y290 HydrophobicContact CD1-CE2 4.05Å; I246-Y290 HydrophobicContact CG2-CD1 3.63Å; I246-Y290 HydrophobicContact CG2-CD2 3.9Å; I246-Y290 HydrophobicContact CG2-CE1 4.1Å; I246-Y290 HydrophobicContact CG2-CE2 4.35Å; I246-Y290 HydrophobicContact CG2-CG 3.51Å; Q247-Y290 HydrophobicContact CG-CE1 3.8Å; L250-Y290 HydrophobicContact CD1-CD1 4.44Å; W251-Y290 HydrophobicContact CZ2-CE1 4.5Å; Q284-Y290 CarbonylContact O-C 3.41Å; Q284-Y290 WeakPolarHBondContact O-CA 3.42Å; Y290-L292 HydrophobicContact CE2-CD1 4.36Å; Y290-L292 HydrophobicContact CE2-CG 4.42Å
291	D	70.8	Confident	74	Confident	82 Å²	82	71.5 Å²	71.5	44%	0.439	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	155	176.4	-167.8	21.6	0	0	0	111	Q284	Q284-D291 HydrophobicContact CG-CB 4.4Å; Q284-D291 PolarHBondContact N-O 3.45Å; Q284-D291 PolarHBondContact O-N 3.36Å
292	L	83.6	Confident	72.9	Confident	36 Å²	36	76.4 Å²	76.4	19%	0.188	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	106.9	179.5	-72.9	169.4	0	0	0	109.5	L242 N243 V272 V281 I282 V283 Y290	L242-L292 HydrophobicContact CD2-CD1 4.47Å; L242-L292 HydrophobicContact CD2-CD2 4Å; N243-L292 VanDerWaalsContact OD1-CD1 3.23Å; N243-L292 WeakPolarHBondContact OD1-CD1 3.48Å; V272-L292 HydrophobicContact CG2-CD2 4.42Å; V281-L292 HydrophobicContact CG1-CB 4.13Å; V281-L292 HydrophobicContact CG1-CD2 3.96Å; I282-L292 WeakPolarHBondContact O-CA 3.47Å; V283-L292 HydrophobicContact CB-CD2 3.6Å; V283-L292 HydrophobicContact CG2-CD2 3.85Å; Y290-L292 HydrophobicContact CE2-CD1 4.36Å; Y290-L292 HydrophobicContact CE2-CG 4.42Å
293	E	79.4	Confident	71.9	Confident	94 Å²	94	79 Å²	79	44%	0.439	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.3	180	-70	-176.9	179.5	0	0	111.4	V281 I282 Q284	V281-E293 CarbonylContact C-O 3.44Å; V281-E293 WeakPolarHBondContact CA-O 3.46Å; I282-E293 PolarHBondContact N-O 2.9Å; I282-E293 PolarHBondContact O-N 3.05Å; Q284-E293 PolarHBondContact NE2-OE1 3.37Å
294	E	85.4	Confident	71.3	Confident	116 Å²	116	86 Å²	86	54%	0.542	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	131.1	171.1	-62.4	-171.9	-167.6	0	0	110.5	K277 V281	K277-E294 WeakPolarHBondContact CD-OE1 3.32Å; K277-E294 VanDerWaalsContact CE-OE1 3.31Å; K277-E294 WeakPolarHBondContact CE-OE1 3.2Å; K277-E294 IonicContact NZ-OE1 3.77Å; K277-E294 PolarHBondContact NZ-OE1 3.27Å; V281-E294 HydrophobicContact CG2-CG 4.19Å
295	T	75.6	Confident	72	Confident	19 Å²	19	84 Å²	84	12%	0.117	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	157.4	176.8	71.7	0	0	0	0	110.9	Q279 Q280 I282 V297	Q279-T295 WeakPolarHBondContact CB-O 3.49Å; Q279-T295 PolarHBondContact OE1-O 3Å; Q280-T295 WeakPolarHBondContact CB-OG1 3.3Å; Q280-T295 WeakPolarHBondContact O-CB 3.38Å; Q280-T295 WeakPolarHBondContact O-CG2 3.46Å; Q280-T295 PolarHBondContact O-N 2.98Å; Q280-T295 PolarHBondContact O-OG1 3.48Å; I282-T295 HydrophobicContact CB-CG2 4.46Å; I282-T295 HydrophobicContact CD1-CG2 3.45Å; I282-T295 VanDerWaalsContact CD1-CG2 3.45Å; I282-T295 HydrophobicContact CG1-CG2 3.52Å; T295-V297 PolarHBondContact O-N 3.34Å; T295-V297 VanDerWaalsContact O-N 3.12Å; T295-V297 PolarHBondContact OG1-N 3.45Å; T295-V297 PolarHBondContact OG1-O 3.16Å
296	P	74.1	Confident	73.1	Confident	128 Å²	128	85.5 Å²	85.5	83%	0.831	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	0.4	170.9	30.8	-36.4	0	0	0	113.1
297	V	76.8	Confident	74.5	Confident	75 Å²	75	81.9 Å²	81.9	46%	0.455	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.9	-176.9	-176.7	0	0	0	0	109.2	Q279 Q280 T295	Q279-V297 PolarHBondContact OE1-O 2.89Å; Q280-V297 HydrophobicContact CG-CG1 4.41Å; Q280-V297 WeakPolarHBondContact CG-O 3.44Å; Q280-V297 PolarHBondContact N-O 3.23Å; T295-V297 PolarHBondContact O-N 3.34Å; T295-V297 VanDerWaalsContact O-N 3.12Å; T295-V297 PolarHBondContact OG1-N 3.45Å; T295-V297 PolarHBondContact OG1-O 3.16Å
298	S	83.1	Confident	75.7	Confident	59 Å²	59	83.8 Å²	83.8	41%	0.413	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	149.2	175.1	-44.7	0	0	0	0	111.7	S278 Q279 K300	S278-S298 WeakPolarHBondContact O-CA 3.46Å; Q279-S298 PolarHBondContact NE2-OG 2.86Å; Q279-S298 VanDerWaalsContact OE1-N 3.1Å; Q279-S298 PolarHBondContact OE1-OG 3.32Å; S298-K300 PolarHBondContact O-N 3.39Å
299	W	81.1	Confident	76.7	Confident	41 Å²	41	80 Å²	80	16%	0.155	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-62.5	135.3	166.5	-66	102.8	0	0	0	109.7	L271 S278 Q279 Q280 R305 T306	L271-W299 HydrophobicContact CD2-CH2 4.14Å; S278-W299 PolarHBondContact O-N 3.41Å; Q279-W299 PolarHBondContact O-NE1 3.45Å; Q280-W299 HydrophobicContact CB-CZ2 4.17Å; Q280-W299 HydrophobicContact CG-CD2 3.85Å; Q280-W299 HydrophobicContact CG-CE3 4.3Å; Q280-W299 HydrophobicContact CG-CG 4.3Å; Q280-W299 HydrophobicContact CG-CH2 4.19Å; Q280-W299 HydrophobicContact CG-CZ2 3.76Å; Q280-W299 HydrophobicContact CG-CZ3 4.45Å; W299-R305 HydrophobicContact CB-CG 4.16Å; W299-R305 HydrophobicContact CD2-CB 4.46Å; W299-R305 HydrophobicContact CD2-CG 3.86Å; W299-R305 HydrophobicContact CE3-CG 4.15Å; W299-R305 HydrophobicContact CG-CG 3.86Å; W299-T306 VanDerWaalsContact CH2-O 3.25Å; W299-T306 WeakPolarHBondContact CH2-O 3.2Å
300	K	71.6	Confident	77.8	Confident	213 Å²	213	76.9 Å²	76.9	93%	0.926	39%	0.394	S	S	*	.	S	Bend	trans	-74	-33.9	-179.7	-69.1	-176.6	178.6	178.9	0	112.5	S298	S298-K300 PolarHBondContact O-N 3.39Å
301	D	68.9	Low	77.9	Confident	84 Å²	84	74.4 Å²	74.4	45%	0.449	39%	0.385	S	S	.	.			trans	-148.2	142.9	178.8	-158.8	-23.9	0	0	0	109.8	T303	D301-T303 PolarHBondContact O-N 3.23Å; D301-T303 PolarHBondContact OD1-N 2.96Å; D301-T303 PolarHBondContact OD1-OG1 3.4Å; D301-T303 PolarHBondContact OD2-OG1 3.48Å
302	D	65.6	Low	78.1	Confident	104 Å²	104	72.4 Å²	72.4	56%	0.556	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-70.7	-21.7	178.7	-82	-5.3	0	0	0	112.3	R305	D302-R305 IonicContact OD1-CZ 3.79Å; D302-R305 IonicContact OD1-NE 3.33Å; D302-R305 PolarHBondContact OD1-NE 2.94Å; D302-R305 IonicContact OD1-NH2 3Å; D302-R305 PolarHBondContact OD1-NH2 2.97Å
303	T	61.7	Low	77.6	Confident	117 Å²	117	70.7 Å²	70.7	72%	0.718	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-81.8	-15.4	-178.9	56.6	0	0	0	0	114.5	D301	D301-T303 PolarHBondContact O-N 3.23Å; D301-T303 PolarHBondContact OD1-N 2.96Å; D301-T303 PolarHBondContact OD1-OG1 3.4Å; D301-T303 PolarHBondContact OD2-OG1 3.48Å
304	E	68.5	Low	77.6	Confident	148 Å²	148	70.6 Å²	70.6	69%	0.692	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-108.8	7.4	-177.5	-65	-166	156.7	0	0	114	T306	E304-T306 PolarHBondContact O-N 2.85Å; E304-T306 PolarHBondContact O-OG1 3.21Å
305	R	84.2	Confident	77.5	Confident	19 Å²	19	68.6 Å²	68.6	7%	0.072	35%	0.353	C	S	.	.			trans	-60.5	122.6	-177.7	-67.8	174.9	170.4	-131.9	13.3	111	G235 N236 S273 K277 W299 D302	G235-R305 PolarHBondContact N-O 3.49Å; N236-R305 WeakPolarHBondContact OD1-CD 3.29Å; S273-R305 WeakPolarHBondContact OG-CD 3.35Å; S273-R305 PolarHBondContact OG-NH1 3.18Å; K277-R305 PolarHBondContact O-NH1 2.92Å; K277-R305 PolarHBondContact O-NH2 3.4Å; K277-R305 VanDerWaalsContact O-NH2 3.08Å; W299-R305 HydrophobicContact CB-CG 4.16Å; W299-R305 HydrophobicContact CD2-CB 4.46Å; W299-R305 HydrophobicContact CD2-CG 3.86Å; W299-R305 HydrophobicContact CE3-CG 4.15Å; W299-R305 HydrophobicContact CG-CG 3.86Å; D302-R305 IonicContact OD1-CZ 3.79Å; D302-R305 IonicContact OD1-NE 3.33Å; D302-R305 PolarHBondContact OD1-NE 2.94Å; D302-R305 IonicContact OD1-NH2 3Å; D302-R305 PolarHBondContact OD1-NH2 2.97Å
306	T	86.9	Confident	77.8	Confident	35 Å²	35	68.5 Å²	68.5	22%	0.215	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.1	-173.8	-56.9	0	0	0	0	110.2	E232 W299 E304 R308	E232-T306 HydrophobicContact CB-CG2 4.05Å; W299-T306 VanDerWaalsContact CH2-O 3.25Å; W299-T306 WeakPolarHBondContact CH2-O 3.2Å; E304-T306 PolarHBondContact O-N 2.85Å; E304-T306 PolarHBondContact O-OG1 3.21Å; T306-R308 HydrophobicContact CG2-CG 4.48Å
307	N	88.8	Confident	78.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.5	174	-52.9	-85.6	0	0	0	109	E232 V233 G235 L271 V272 S273 F325	E232-N307 CarbonylContact C-O 3.53Å; E232-N307 WeakPolarHBondContact CA-O 3.13Å; V233-N307 PolarHBondContact N-O 3Å; V233-N307 WeakPolarHBondContact O-CB 3.12Å; V233-N307 PolarHBondContact O-N 3.45Å; V233-N307 PolarHBondContact O-ND2 2.86Å; G235-N307 PolarHBondContact O-ND2 3.06Å; L271-N307 CarbonylContact O-C 3.5Å; L271-N307 WeakPolarHBondContact O-CA 3.03Å; V272-N307 WeakPolarHBondContact CA-OD1 3.42Å; S273-N307 PolarHBondContact N-OD1 3.4Å; N307-F325 HydrophobicContact CB-CE1 3.5Å; N307-F325 VanDerWaalsContact CB-CE1 3.5Å; N307-F325 HydrophobicContact CB-CZ 3.89Å
308	R	86.2	Confident	78.9	Confident	129 Å²	129	64.8 Å²	64.8	49%	0.487	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.1	176.9	-61.8	-171.2	166.9	162	-4.3	108.8	E232 G270 L271 T306	E232-R308 HydrophobicContact CB-CG 4.46Å; E232-R308 HydrophobicContact CG-CG 3.9Å; E232-R308 IonicContact OE1-CZ 2.8Å; E232-R308 IonicContact OE1-NE 2.79Å; E232-R308 PolarHBondContact OE1-NE 3.43Å; E232-R308 IonicContact OE1-NH2 3.28Å; E232-R308 IonicContact OE2-CZ 2.72Å; E232-R308 IonicContact OE2-NE 3.96Å; E232-R308 PolarHBondContact OE2-NE 3.12Å; E232-R308 IonicContact OE2-NH2 2.64Å; E232-R308 PolarHBondContact OE2-NH2 2.59Å; G270-R308 CarbonylContact C-O 3.6Å; G270-R308 WeakPolarHBondContact CA-O 3.35Å; L271-R308 PolarHBondContact N-O 3.15Å; L271-R308 PolarHBondContact O-N 2.83Å; T306-R308 HydrophobicContact CG2-CG 4.48Å
309	L	85.6	Confident	79.1	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.1	-179.5	-70.5	141.5	0	0	0	110	T230 F231 L268 V272 V283 L311 F325	T230-L309 VanDerWaalsContact CA-O 3.3Å; T230-L309 WeakPolarHBondContact CA-O 3.4Å; F231-L309 HydrophobicContact CD2-CB 4.48Å; F231-L309 HydrophobicContact CD2-CD1 4.42Å; F231-L309 HydrophobicContact CE1-CB 4.45Å; F231-L309 HydrophobicContact CE2-CB 4Å; F231-L309 HydrophobicContact CE2-CD1 3.47Å; F231-L309 VanDerWaalsContact CE2-CD1 3.47Å; F231-L309 HydrophobicContact CE2-CG 4.38Å; F231-L309 HydrophobicContact CZ-CB 3.97Å; F231-L309 HydrophobicContact CZ-CD1 3.8Å; F231-L309 PolarHBondContact N-O 3.47Å; F231-L309 VanDerWaalsContact N-O 3.14Å; F231-L309 PolarHBondContact O-N 3.15Å; L268-L309 HydrophobicContact CD1-CD2 3.74Å; V272-L309 HydrophobicContact CG1-CD2 4.26Å; V283-L309 HydrophobicContact CG1-CD2 3.83Å; L309-L311 HydrophobicContact CB-CD1 4.1Å; L309-F325 HydrophobicContact CD1-CD1 3.86Å; L309-F325 HydrophobicContact CD1-CD2 3.46Å; L309-F325 VanDerWaalsContact CD1-CD2 3.46Å; L309-F325 HydrophobicContact CD1-CE1 3.74Å; L309-F325 HydrophobicContact CD1-CE2 3.33Å; L309-F325 HydrophobicContact CD1-CG 3.73Å; L309-F325 HydrophobicContact CD1-CZ 3.47Å; L309-F325 VanDerWaalsContact CD1-CZ 3.47Å
310	V	79.1	Confident	79.4	Confident	62 Å²	62	65.5 Å²	65.5	38%	0.376	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.3	174.6	-176.2	0	0	0	0	106.8	T228 I229 T230 K269	T228-V310 HydrophobicContact CG2-CG1 3.84Å; I229-V310 WeakPolarHBondContact O-CA 3.33Å; T230-V310 HydrophobicContact CG2-CG2 4Å; K269-V310 PolarHBondContact N-O 2.88Å; K269-V310 WeakPolarHBondContact O-CA 3.26Å; K269-V310 PolarHBondContact O-N 2.73Å; K269-V310 VanDerWaalsContact O-O 3.11Å
311	L	80.1	Confident	80.2	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.6	178.6	-56.3	100.3	0	0	0	109.1	T228 I229 F231 L249 V265 R267 L268 L309 L316 L321	T228-L311 CarbonylContact C-O 3.54Å; T228-L311 WeakPolarHBondContact CA-O 3.45Å; I229-L311 PolarHBondContact N-O 2.78Å; I229-L311 PolarHBondContact O-N 3.21Å; F231-L311 HydrophobicContact CD1-CD1 4.13Å; F231-L311 HydrophobicContact CE1-CD1 3.38Å; F231-L311 HydrophobicContact CZ-CD1 4Å; L249-L311 HydrophobicContact CD2-CD2 3.4Å; L249-L311 VanDerWaalsContact CD2-CD2 3.4Å; V265-L311 HydrophobicContact CG1-CD2 4.33Å; V265-L311 HydrophobicContact CG2-CD2 4.09Å; R267-L311 CarbonylContact O-C 3.6Å; R267-L311 WeakPolarHBondContact O-CA 3.41Å; L268-L311 HydrophobicContact CD1-CD1 4.41Å; L268-L311 HydrophobicContact CD1-CD2 3.69Å; L268-L311 HydrophobicContact CD1-CG 3.61Å; L309-L311 HydrophobicContact CB-CD1 4.1Å; L311-L316 HydrophobicContact CB-CD1 4.03Å; L311-L321 HydrophobicContact CD2-CD1 4.44Å
312	L	73.5	Confident	81.2	Confident	40 Å²	40	55 Å²	55	21%	0.209	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.4	172.3	-176.3	82.4	0	0	0	107.9	I226 T228 I266 R267	I226-L312 HydrophobicContact CG2-CD1 3.64Å; I226-L312 HydrophobicContact CG2-CD2 4.3Å; I226-L312 HydrophobicContact CG2-CG 3.73Å; T228-L312 VanDerWaalsContact OG1-CD1 3.23Å; T228-L312 WeakPolarHBondContact OG1-CD1 3.49Å; I266-L312 PolarHBondContact N-O 3Å; R267-L312 HydrophobicContact CB-CB 4.04Å; R267-L312 HydrophobicContact CB-CD2 4.43Å; R267-L312 PolarHBondContact N-O 3.09Å; R267-L312 PolarHBondContact O-N 3.42Å
313	G	72.8	Confident	82.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.9	-178.4	-176.4	0	0	0	0	0	113.7	I226 V227 E264	I226-G313 WeakPolarHBondContact CA-O 3.22Å; V227-G313 WeakPolarHBondContact CG2-O 3.3Å; V227-G313 PolarHBondContact N-O 3.31Å; V227-G313 PolarHBondContact O-N 3.14Å; V227-G313 VanDerWaalsContact O-N 3.11Å; E264-G313 CarbonylContact O-C 3.39Å; E264-G313 WeakPolarHBondContact O-CA 3.26Å
314	R	80.8	Confident	83.3	Confident	92 Å²	92	50.3 Å²	50.3	35%	0.347	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	147	178.5	-66.1	177.7	171.9	150.1	-5	110.6	D223 S225 I226 E264 L316	D223-R314 IonicContact OD2-CZ 3.57Å; D223-R314 IonicContact OD2-NE 2.77Å; D223-R314 IonicContact OD2-NH2 3.03Å; D223-R314 PolarHBondContact OD2-NH2 2.77Å; S225-R314 PolarHBondContact OG-NE 3.39Å; I226-R314 HydrophobicContact CG1-CG 3.91Å; E264-R314 HydrophobicContact CB-CB 4.4Å; E264-R314 PolarHBondContact N-O 3.31Å; E264-R314 VanDerWaalsContact N-O 3.14Å; E264-R314 PolarHBondContact O-N 3.25Å; E264-R314 IonicContact OE2-NH1 3.01Å; R314-L316 PolarHBondContact O-N 2.81Å
315	N	82.3	Confident	84.3	Confident	74 Å²	74	43.2 Å²	43.2	40%	0.396	20%	0.204	S	C	.	.	S	Bend	trans	56.9	18.2	176.3	-58.7	-39.5	0	0	0	114.9	N257 H261	N257-N315 WeakPolarHBondContact CB-O 3.23Å; N257-N315 PolarHBondContact ND2-O 3.09Å; N257-N315 VanDerWaalsContact ND2-O 3.09Å; H261-N315 HydrophobicContact CB-CB 4.18Å
316	L	83.1	Confident	84.5	Confident	17 Å²	17	44.5 Å²	44.5	9%	0.089	21%	0.212	C	C	.	.			trans	-65.5	140.1	-175.4	-55.1	-174.8	0	0	0	111.1	V227 I229 M263 V265 L311 R314 L321	V227-L316 HydrophobicContact CG2-CB 3.8Å; V227-L316 HydrophobicContact CG2-CD1 4.38Å; V227-L316 HydrophobicContact CG2-CG 4.08Å; I229-L316 HydrophobicContact CD1-CB 3.34Å; I229-L316 HydrophobicContact CD1-CD1 4.48Å; I229-L316 WeakPolarHBondContact CD1-O 3.5Å; I229-L316 HydrophobicContact CG1-CB 3.97Å; I229-L316 HydrophobicContact CG1-CD1 4.3Å; M263-L316 HydrophobicContact CB-CD2 4.06Å; V265-L316 HydrophobicContact CG2-CD2 3.76Å; L311-L316 HydrophobicContact CB-CD1 4.03Å; R314-L316 PolarHBondContact O-N 2.81Å; L316-L321 HydrophobicContact CB-CD1 4.17Å; L316-L321 HydrophobicContact CD2-CD1 4.47Å
317	D	87.6	Confident	84.5	Confident	21 Å²	21	43.5 Å²	43.5	11%	0.112	21%	0.207	C	C	.	.			trans	-117.5	117.6	173.4	-172.1	-50.9	0	0	0	110.6	N257 K258 M263 D319 I320 L321	N257-D317 HydrophobicContact CB-CB 3.98Å; K258-D317 WeakPolarHBondContact CD-OD2 3.5Å; K258-D317 VanDerWaalsContact CE-OD2 3.22Å; K258-D317 WeakPolarHBondContact CE-OD2 3.38Å; K258-D317 VanDerWaalsContact CG-OD2 3.23Å; K258-D317 WeakPolarHBondContact CG-OD2 3.36Å; K258-D317 IonicContact NZ-OD1 3.72Å; K258-D317 IonicContact NZ-OD2 2.67Å; M263-D317 HydrophobicContact CE-CB 3.41Å; M263-D317 VanDerWaalsContact CE-CB 3.41Å; M263-D317 HydrophobicContact SD-CB 4.44Å; D317-D319 VanDerWaalsContact C-N 3.34Å; D317-D319 PolarHBondContact O-N 3.2Å; D317-D319 WeakPolarHBondContact OD1-CB 3.37Å; D317-D319 PolarHBondContact OD1-N 3.12Å; D317-I320 HydrophobicContact CB-CB 4.15Å; D317-I320 HydrophobicContact CB-CD1 4Å; D317-I320 HydrophobicContact CB-CG1 4.23Å; D317-I320 PolarHBondContact O-N 2.98Å; D317-I320 PolarHBondContact OD1-N 3.01Å; D317-I320 VanDerWaalsContact OD1-N 3.15Å; D317-L321 WeakPolarHBondContact O-CB 3.41Å; D317-L321 VanDerWaalsContact O-CG 3.26Å; D317-L321 WeakPolarHBondContact O-CG 3.39Å; D317-L321 PolarHBondContact O-N 3.23Å
318	K	86.6	Confident	84.3	Confident	103 Å²	103	43.9 Å²	43.9	45%	0.448	21%	0.21	S	C	.	.	H	α-helix	trans	-62.2	-41.7	-176.1	-179.8	171.4	176.2	168.3	0	112.3	I229 T230 K322	I229-K318 HydrophobicContact CD1-CB 3.98Å; I229-K318 VanDerWaalsContact CD1-N 3.34Å; I229-K318 HydrophobicContact CG2-CB 3.65Å; I229-K318 HydrophobicContact CG2-CD 4.22Å; I229-K318 HydrophobicContact CG2-CG 3.7Å; T230-K318 WeakPolarHBondContact O-CE 3.41Å; T230-K318 PolarHBondContact O-NZ 3.35Å; T230-K318 VanDerWaalsContact O-NZ 3.08Å; K318-K322 WeakPolarHBondContact O-CB 3.44Å; K318-K322 PolarHBondContact O-N 3.48Å
319	D	87	Confident	84.3	Confident	91 Å²	91	38.6 Å²	38.6	49%	0.487	19%	0.191	S	C	.	.	H	α-helix	trans	-70.3	-42.9	-174.1	-62.7	-40.8	0	0	0	109.6	K258 D317 Q323	K258-D319 IonicContact NZ-OD2 3.94Å; K258-D319 PolarHBondContact NZ-OD2 3.23Å; D317-D319 VanDerWaalsContact C-N 3.34Å; D317-D319 PolarHBondContact O-N 3.2Å; D317-D319 WeakPolarHBondContact OD1-CB 3.37Å; D317-D319 PolarHBondContact OD1-N 3.12Å; D319-Q323 WeakPolarHBondContact O-CB 2.95Å; D319-Q323 WeakPolarHBondContact O-CG 3.42Å; D319-Q323 PolarHBondContact O-N 3.33Å
320	I	87.3	Confident	84.1	Confident	24 Å²	24	42.4 Å²	42.4	12%	0.123	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-50.1	178.1	-65.2	173	0	0	0	110.4	V255 K258 M263 D317 K322 Q323 L324	V255-I320 HydrophobicContact CG1-CG2 4.34Å; K258-I320 HydrophobicContact CG-CD1 3.97Å; M263-I320 HydrophobicContact CE-CB 3.93Å; M263-I320 HydrophobicContact CE-CD1 4.01Å; M263-I320 HydrophobicContact CE-CG2 3.88Å; D317-I320 HydrophobicContact CB-CB 4.15Å; D317-I320 HydrophobicContact CB-CD1 4Å; D317-I320 HydrophobicContact CB-CG1 4.23Å; D317-I320 PolarHBondContact O-N 2.98Å; D317-I320 PolarHBondContact OD1-N 3.01Å; D317-I320 VanDerWaalsContact OD1-N 3.15Å; I320-K322 VanDerWaalsContact C-N 3.33Å; I320-K322 PolarHBondContact O-N 3.24Å; I320-Q323 PolarHBondContact O-N 2.98Å; I320-L324 HydrophobicContact CG2-CD1 3.95Å; I320-L324 HydrophobicContact CG2-CG 4.35Å; I320-L324 WeakPolarHBondContact O-CG 3.33Å; I320-L324 PolarHBondContact O-N 2.88Å
321	L	88.3	Confident	83.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-41.3	179.8	-69.3	171.3	0	0	0	112.1	I229 F231 L249 M263 L311 L316 D317 L324 F325	I229-L321 HydrophobicContact CD1-CD1 4.44Å; F231-L321 HydrophobicContact CE1-CB 3.82Å; F231-L321 HydrophobicContact CZ-CB 4.46Å; L249-L321 HydrophobicContact CD1-CD2 3.51Å; L249-L321 HydrophobicContact CD2-CD2 4.33Å; M263-L321 HydrophobicContact SD-CD1 4.21Å; M263-L321 HydrophobicContact SD-CD2 3.99Å; M263-L321 HydrophobicContact SD-CG 3.93Å; L311-L321 HydrophobicContact CD2-CD1 4.44Å; L316-L321 HydrophobicContact CB-CD1 4.17Å; L316-L321 HydrophobicContact CD2-CD1 4.47Å; D317-L321 WeakPolarHBondContact O-CB 3.41Å; D317-L321 VanDerWaalsContact O-CG 3.26Å; D317-L321 WeakPolarHBondContact O-CG 3.39Å; D317-L321 PolarHBondContact O-N 3.23Å; L321-L324 PolarHBondContact O-N 3Å; L321-F325 WeakPolarHBondContact O-CB 3.27Å; L321-F325 PolarHBondContact O-N 3.41Å
322	K	88.9	Confident	82.6	Confident	76 Å²	76	46.4 Å²	46.4	33%	0.33	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-42.4	175.9	-173.6	179.3	-177.9	-179.1	0	111.4	F231 E232 V233 K318 I320 F325 I326	F231-K322 HydrophobicContact CB-CB 4.27Å; F231-K322 HydrophobicContact CB-CD 4.19Å; F231-K322 HydrophobicContact CB-CG 4.19Å; F231-K322 HydrophobicContact CD1-CB 4.36Å; F231-K322 HydrophobicContact CD2-CB 4.34Å; F231-K322 HydrophobicContact CD2-CG 4.23Å; F231-K322 HydrophobicContact CG-CB 4.09Å; F231-K322 HydrophobicContact CG-CG 4.26Å; E232-K322 WeakPolarHBondContact O-CE 3.39Å; V233-K322 HydrophobicContact CG2-CG 4.04Å; K318-K322 WeakPolarHBondContact O-CB 3.44Å; K318-K322 PolarHBondContact O-N 3.48Å; I320-K322 VanDerWaalsContact C-N 3.33Å; I320-K322 PolarHBondContact O-N 3.24Å; K322-F325 PolarHBondContact O-N 2.79Å; K322-I326 HydrophobicContact CG-CD1 3.97Å; K322-I326 HydrophobicContact CG-CG1 4.48Å; K322-I326 WeakPolarHBondContact O-CB 3.22Å; K322-I326 WeakPolarHBondContact O-CG1 3.39Å; K322-I326 PolarHBondContact O-N 3.05Å
323	Q	86.6	Confident	81.3	Confident	100 Å²	100	52.4 Å²	52.4	47%	0.467	26%	0.261	S	S	.	.	H	α-helix	trans	-66.4	-41.4	178	-71.7	-64.8	-28.5	0	0	112.2	D319 I320 F325 I326 A327	D319-Q323 WeakPolarHBondContact O-CB 2.95Å; D319-Q323 WeakPolarHBondContact O-CG 3.42Å; D319-Q323 PolarHBondContact O-N 3.33Å; I320-Q323 PolarHBondContact O-N 2.98Å; Q323-F325 VanDerWaalsContact C-N 3.33Å; Q323-F325 PolarHBondContact O-N 2.85Å; Q323-I326 PolarHBondContact O-N 3.48Å; Q323-A327 PolarHBondContact O-N 2.91Å
324	L	86.3	Confident	79.9	Confident	23 Å²	23	61.1 Å²	61.1	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-45.8	173.8	-71.8	171.9	0	0	0	110.9	F245 V255 I320 L321 A327 T328 F340	F245-L324 HydrophobicContact CD2-CB 4.28Å; F245-L324 HydrophobicContact CE2-CB 3.81Å; V255-L324 HydrophobicContact CG1-CD1 3.78Å; V255-L324 HydrophobicContact CG2-CD1 4.32Å; I320-L324 HydrophobicContact CG2-CD1 3.95Å; I320-L324 HydrophobicContact CG2-CG 4.35Å; I320-L324 WeakPolarHBondContact O-CG 3.33Å; I320-L324 PolarHBondContact O-N 2.88Å; L321-L324 PolarHBondContact O-N 3Å; L324-A327 WeakPolarHBondContact O-CB 3.4Å; L324-A327 PolarHBondContact O-N 3.48Å; L324-T328 PolarHBondContact O-N 2.95Å; L324-T328 VanDerWaalsContact O-N 3.12Å; L324-T328 PolarHBondContact O-OG1 3.34Å; L324-F340 HydrophobicContact CD2-CZ 4.48Å
325	F	89.1	Confident	78.1	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.8	-35.6	178.2	-165.8	-94.5	0	0	0	113.1	F231 V233 L242 F245 V272 N307 L309 L321 K322 Q323 A327 T328 V329	F231-F325 HydrophobicContact CE2-CB 3.66Å; F231-F325 AromaticContact CE2-CD1 3.99Å; F231-F325 HydrophobicContact CE2-CD1 3.99Å; F231-F325 AromaticContact CE2-CG 3.79Å; F231-F325 HydrophobicContact CE2-CG 3.79Å; F231-F325 HydrophobicContact CZ-CB 3.92Å; F231-F325 HydrophobicContact CZ-CG 4.27Å; V233-F325 HydrophobicContact CB-CD1 3.8Å; V233-F325 HydrophobicContact CB-CE1 4.1Å; V233-F325 HydrophobicContact CG1-CD1 4.13Å; V233-F325 HydrophobicContact CG1-CE1 4.44Å; V233-F325 HydrophobicContact CG2-CD1 3.84Å; L242-F325 HydrophobicContact CD1-CE2 3.66Å; L242-F325 HydrophobicContact CD1-CZ 4.25Å; F245-F325 AromaticContact CD1-CD2 3.85Å; F245-F325 HydrophobicContact CD1-CD2 3.85Å; F245-F325 HydrophobicContact CD1-CE2 4.3Å; F245-F325 AromaticContact CE1-CD2 3.65Å; F245-F325 HydrophobicContact CE1-CD2 3.65Å; F245-F325 HydrophobicContact CE1-CE2 4.34Å; F245-F325 HydrophobicContact CE2-CB 4.23Å; F245-F325 HydrophobicContact CE2-CD2 4.38Å; F245-F325 HydrophobicContact CG-CD2 4.31Å; F245-F325 HydrophobicContact CZ-CB 4.18Å; F245-F325 AromaticContact CZ-CD2 3.94Å; F245-F325 HydrophobicContact CZ-CD2 3.94Å; V272-F325 HydrophobicContact CG1-CZ 4.37Å; N307-F325 HydrophobicContact CB-CE1 3.5Å; N307-F325 VanDerWaalsContact CB-CE1 3.5Å; N307-F325 HydrophobicContact CB-CZ 3.89Å; L309-F325 HydrophobicContact CD1-CD1 3.86Å; L309-F325 HydrophobicContact CD1-CD2 3.46Å; L309-F325 VanDerWaalsContact CD1-CD2 3.46Å; L309-F325 HydrophobicContact CD1-CE1 3.74Å; L309-F325 HydrophobicContact CD1-CE2 3.33Å; L309-F325 HydrophobicContact CD1-CG 3.73Å; L309-F325 HydrophobicContact CD1-CZ 3.47Å; L309-F325 VanDerWaalsContact CD1-CZ 3.47Å; L321-F325 WeakPolarHBondContact O-CB 3.27Å; L321-F325 PolarHBondContact O-N 3.41Å; K322-F325 PolarHBondContact O-N 2.79Å; Q323-F325 VanDerWaalsContact C-N 3.33Å; Q323-F325 PolarHBondContact O-N 2.85Å; F325-A327 VanDerWaalsContact C-N 3.29Å; F325-A327 PolarHBondContact O-N 3.27Å; F325-T328 VanDerWaalsContact O-CB 3.3Å; F325-T328 WeakPolarHBondContact O-CB 3.45Å; F325-T328 PolarHBondContact O-N 2.87Å; F325-V329 HydrophobicContact CD1-CG2 4.01Å; F325-V329 HydrophobicContact CE1-CG2 3.61Å; F325-V329 HydrophobicContact CZ-CG2 4.22Å; F325-V329 WeakPolarHBondContact O-CG2 3.14Å; F325-V329 PolarHBondContact O-N 3.42Å; F325-V329 VanDerWaalsContact O-N 3.09Å
326	I	88.3	Confident	76.2	Confident	46 Å²	46	63.2 Å²	63.2	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-44.5	171.6	-72.6	163.6	0	0	0	109.9	V233 K322 Q323 T328 V329 T330	V233-I326 HydrophobicContact CB-CG1 4.49Å; V233-I326 HydrophobicContact CG1-CG1 3.78Å; V233-I326 HydrophobicContact CG2-CG1 3.8Å; K322-I326 HydrophobicContact CG-CD1 3.97Å; K322-I326 HydrophobicContact CG-CG1 4.48Å; K322-I326 WeakPolarHBondContact O-CB 3.22Å; K322-I326 WeakPolarHBondContact O-CG1 3.39Å; K322-I326 PolarHBondContact O-N 3.05Å; Q323-I326 PolarHBondContact O-N 3.48Å; I326-T328 VanDerWaalsContact C-N 3.28Å; I326-T328 PolarHBondContact O-N 3.03Å; I326-V329 PolarHBondContact O-N 2.8Å; I326-T330 HydrophobicContact CG2-CG2 4.12Å; I326-T330 PolarHBondContact O-N 3.16Å; I326-T330 PolarHBondContact O-OG1 3.13Å; I326-T330 VanDerWaalsContact O-OG1 3.05Å
327	A	85.8	Confident	74.3	Confident	14 Å²	14	67.5 Å²	67.5	12%	0.116	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-36.7	178.1	0	0	0	0	0	112.6	Q323 L324 F325 V329 E331 T332	Q323-A327 PolarHBondContact O-N 2.91Å; L324-A327 WeakPolarHBondContact O-CB 3.4Å; L324-A327 PolarHBondContact O-N 3.48Å; F325-A327 VanDerWaalsContact C-N 3.29Å; F325-A327 PolarHBondContact O-N 3.27Å; A327-V329 VanDerWaalsContact C-N 3.33Å; A327-E331 PolarHBondContact O-N 3.32Å; A327-T332 PolarHBondContact O-N 3.37Å
328	T	85.3	Confident	72.1	Confident	8 Å²	8	71.9 Å²	71.9	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-59.6	-41	171.6	-60.4	0	0	0	0	112.2	H241 F245 L324 F325 I326	H241-T328 HydrophobicContact CB-CG2 3.81Å; H241-T328 WeakPolarHBondContact O-CG2 3.08Å; F245-T328 HydrophobicContact CB-CG2 4.25Å; L324-T328 PolarHBondContact O-N 2.95Å; L324-T328 VanDerWaalsContact O-N 3.12Å; L324-T328 PolarHBondContact O-OG1 3.34Å; F325-T328 VanDerWaalsContact O-CB 3.3Å; F325-T328 WeakPolarHBondContact O-CB 3.45Å; F325-T328 PolarHBondContact O-N 2.87Å; I326-T328 VanDerWaalsContact C-N 3.28Å; I326-T328 PolarHBondContact O-N 3.03Å
329	V	86.6	Confident	70.1	Confident	17 Å²	17	75.2 Å²	75.2	10%	0.103	37%	0.371	C	S	.	.	H	α-helix	trans	-77.3	-35.6	-179.7	176.3	0	0	0	0	112.5	V233 A237 F325 I326 A327	V233-V329 HydrophobicContact CG1-CB 4.37Å; V233-V329 HydrophobicContact CG1-CG2 4.04Å; A237-V329 HydrophobicContact CB-CG2 4.26Å; F325-V329 HydrophobicContact CD1-CG2 4.01Å; F325-V329 HydrophobicContact CE1-CG2 3.61Å; F325-V329 HydrophobicContact CZ-CG2 4.22Å; F325-V329 WeakPolarHBondContact O-CG2 3.14Å; F325-V329 PolarHBondContact O-N 3.42Å; F325-V329 VanDerWaalsContact O-N 3.09Å; I326-V329 PolarHBondContact O-N 2.8Å; A327-V329 VanDerWaalsContact C-N 3.33Å
330	T	81.8	Confident	68.3	Low	81 Å²	81	73.2 Å²	73.2	50%	0.497	36%	0.358	S	S	.	.	H	α-helix	trans	-92.2	2.2	-175.2	59.7	0	0	0	0	114.8	I326 T332	I326-T330 HydrophobicContact CG2-CG2 4.12Å; I326-T330 PolarHBondContact O-N 3.16Å; I326-T330 PolarHBondContact O-OG1 3.13Å; I326-T330 VanDerWaalsContact O-OG1 3.05Å; T330-T332 VanDerWaalsContact C-N 3.29Å; T330-T332 PolarHBondContact O-N 2.04Å; T330-T332 PolarHBondContact OG1-OG1 3.32Å
331	E	68.6	Low	66.1	Low	80 Å²	80	79.8 Å²	79.8	37%	0.374	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	33.3	178.2	-54.4	-175.4	-165.7	0	0	114	K238 K275 A327 E333	K238-E331 HydrophobicContact CD-CG 4.43Å; K238-E331 WeakPolarHBondContact CD-OE1 3.24Å; K238-E331 WeakPolarHBondContact CE-OE1 3.16Å; K238-E331 IonicContact NZ-OE1 3.09Å; K238-E331 PolarHBondContact NZ-OE1 3.11Å; K238-E331 VanDerWaalsContact NZ-OE1 3.09Å; K238-E331 IonicContact NZ-OE2 2.77Å; K238-E331 PolarHBondContact NZ-OE2 3.45Å; K275-E331 IonicContact NZ-OE1 3.11Å; A327-E331 PolarHBondContact O-N 3.32Å; E331-E333 PolarHBondContact O-N 3.21Å
332	T	58.3	Low	63.8	Low	68 Å²	68	89.1 Å²	89.1	42%	0.417	43%	0.432	S	S	.	.			trans	-88.8	83.3	-178.6	3.6	0	0	0	0	111.6	A327 T330 K334	A327-T332 PolarHBondContact O-N 3.37Å; T330-T332 VanDerWaalsContact C-N 3.29Å; T330-T332 PolarHBondContact O-N 2.04Å; T330-T332 PolarHBondContact OG1-OG1 3.32Å; T332-K334 PolarHBondContact O-N 3.47Å; T332-K334 VanDerWaalsContact O-N 3.11Å
333	E	46.4	Very low	61.4	Low	165 Å²	165	92.8 Å²	92.8	77%	0.771	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-54.4	-29	179.1	-73.1	-179.6	153.1	0	0	114.1	E331 Q335 W336	E331-E333 PolarHBondContact O-N 3.21Å; E333-Q335 PolarHBondContact O-N 3.25Å; E333-W336 PolarHBondContact O-N 3.04Å
334	K	42.8	Very low	59.5	Low	184 Å²	184	93.1 Å²	93.1	80%	0.8	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-76.5	-13.5	-168.5	-78	-175.9	176.5	178.3	0	116.5	T332	T332-K334 PolarHBondContact O-N 3.47Å; T332-K334 VanDerWaalsContact O-N 3.11Å
335	Q	43.1	Very low	57.3	Low	130 Å²	130	97.1 Å²	97.1	61%	0.607	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-95.3	-10.6	176.8	-88.1	-175.5	-16.7	0	0	113.6	E333	E333-Q335 PolarHBondContact O-N 3.25Å
336	W	43.5	Very low	55.2	Low	79 Å²	79	98.5 Å²	98.5	30%	0.299	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-54.8	-175.3	-133.1	59.9	0	0	0	110.4	M244 N248 E333 T338 F340	M244-W336 HydrophobicContact CB-CH2 4.36Å; M244-W336 HydrophobicContact CB-CZ2 4.32Å; M244-W336 HydrophobicContact CE-CH2 3.22Å; M244-W336 HydrophobicContact CE-CZ2 3.99Å; M244-W336 HydrophobicContact CE-CZ3 3.56Å; N248-W336 WeakPolarHBondContact ND2-CH2 3.1Å; N248-W336 WeakPolarHBondContact ND2-CZ2 3Å; E333-W336 PolarHBondContact O-N 3.04Å; W336-T338 VanDerWaalsContact C-N 3.34Å; W336-T338 PolarHBondContact O-N 3.21Å; W336-F340 HydrophobicContact CD2-CE2 4.31Å; W336-F340 HydrophobicContact CG-CE2 4.29Å; W336-F340 WeakPolarHBondContact O-CD2 3.1Å
337	T	42.3	Very low	52.8	Low	108 Å²	108	106.2 Å²	106.2	66%	0.663	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-16.5	-172.7	52.3	0	0	0	0	115.8
338	T	41.4	Very low	51.2	Low	112 Å²	112	110.8 Å²	110.8	69%	0.687	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-17.3	-176.1	-19.3	0	0	0	0	113.4	W336	W336-T338 VanDerWaalsContact C-N 3.34Å; W336-T338 PolarHBondContact O-N 3.21Å
339	R	45	Very low	49.4	Very low	173 Å²	173	116.2 Å²	116.2	65%	0.653	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-20.1	176.5	-85.4	-174.7	173.3	167.2	-1.4	113.9	Q341	R339-Q341 PolarHBondContact O-N 3.34Å
340	F	49.1	Very low	47.3	Very low	49 Å²	49	121.7 Å²	121.7	22%	0.215	62%	0.616	C	S	.	*			trans	-95.1	83.4	172.3	-59.3	-68.2	0	0	0	108.4	N254 V255 L324 W336 E342	N254-F340 HydrophobicContact CB-CD1 4.3Å; N254-F340 HydrophobicContact CB-CE1 4.43Å; V255-F340 HydrophobicContact CG2-CE1 4.37Å; L324-F340 HydrophobicContact CD2-CZ 4.48Å; W336-F340 HydrophobicContact CD2-CE2 4.31Å; W336-F340 HydrophobicContact CG-CE2 4.29Å; W336-F340 WeakPolarHBondContact O-CD2 3.1Å; F340-E342 PolarHBondContact O-N 3.38Å
341	Q	40.5	Very low	45.3	Very low	162 Å²	162	124.1 Å²	124.1	76%	0.757	62%	0.623	S	S	*	*			trans	-67.5	121.8	163.5	-83.6	-177	-38.9	0	0	107.7	R339 D343	R339-Q341 PolarHBondContact O-N 3.34Å; Q341-D343 PolarHBondContact O-N 3.06Å
342	E	40.9	Very low	43.8	Very low	196 Å²	196	126.9 Å²	126.9	92%	0.916	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-0.4	-177.3	-73.5	174.8	144.5	0	0	115.1	F340	F340-E342 PolarHBondContact O-N 3.38Å
343	D	38.7	Very low	42.9	Very low	154 Å²	154	130.8 Å²	130.8	82%	0.824	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	10.7	-170.3	-75.3	-29.7	0	0	0	115.7	Q341	Q341-D343 PolarHBondContact O-N 3.06Å
344	Q	44.9	Very low	42.6	Very low	107 Å²	107	128.4 Å²	128.4	50%	0.5	65%	0.645	S	S	.	*			trans	-139.6	64.6	-179	-68.7	-162.4	1.5	0	0	114.9	R256 C346	R256-Q344 VanDerWaalsContact NH1-OE1 3.16Å; Q344-C346 PolarHBondContact O-N 2.89Å
345	V	40.3	Very low	42.6	Very low	106 Å²	106	124.1 Å²	124.1	64%	0.642	63%	0.634	S	S	*	*			trans	-55.5	129.3	159.4	-178.9	0	0	0	0	108.5	T347	V345-T347 PolarHBondContact O-N 3.37Å
346	C	45.7	Very low	42.5	Very low	30 Å²	30	123.6 Å²	123.6	20%	0.203	64%	0.636	C	S	.	*			trans	-69.2	102.1	172.8	-62.8	0	0	0	0	108.6	K253 C262 Q344	K253-C346 PolarHBondContact O-SG 2.67Å; K253-C346 VanDerWaalsContact O-SG 3.32Å; C262-C346 HydrophobicContact CB-CB 3.99Å; C262-C346 WeakPolarHBondContact CB-SG 3.21Å; C262-C346 WeakPolarHBondContact SG-CB 3.36Å; C262-C346 CovalentContact SG-SG 2.04Å; C262-C346 PolarHBondContact SG-SG 3.19Å; Q344-C346 PolarHBondContact O-N 2.89Å
347	T	38.3	Very low	42.5	Very low	207 Å²	207	127.6 Å²	127.6	100%	1.27	67%	0.666	S	S	*	*			trans	-71.8	0	171.9	48.6	0	0	0	0	112.5	V345	V345-T347 PolarHBondContact O-N 3.37Å

Retrieved 347 of 347 residues in 253.5 ms (Link to these results)

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