G4VSW1_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4VSW1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 274 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	60.9	Low	90.5	Very high	229 Å²	229	44.4 Å²	44.4	100%	1.128	25%	0.251	S	S	*	.				0	132	0	-146.5	172.4	-111.3	0	0	106.2
2	A	83.6	Confident	90.7	Very high	96 Å²	96	42.3 Å²	42.3	79%	0.793	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-64.8	146.8	174.7	0	0	0	0	0	109.1
3	L	91	Very high	90.3	Very high	74 Å²	74	47.1 Å²	47.1	39%	0.387	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-68.1	147	172.8	-66.6	178.3	0	0	0	109.3	E5 D45 I47	L3-E5 PolarHBondContact O-N 3.11Å; L3-D45 HydrophobicContact CD1-CB 4.39Å; L3-D45 HydrophobicContact CD2-CB 4.12Å; L3-I47 HydrophobicContact CB-CG1 3.85Å; L3-I47 HydrophobicContact CD1-CD1 4.01Å; L3-I47 HydrophobicContact CD1-CG1 3.9Å; L3-I47 HydrophobicContact CG-CG1 4.49Å
4	P	94.2	Very high	89.8	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.032	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-55.9	137	172.4	-23.9	35.7	0	0	0	110.6	I46 I47 W163 P164 N165	P4-I46 HydrophobicContact CB-CG2 4.29Å; P4-I47 PolarHBondContact O-N 2.8Å; P4-W163 HydrophobicContact CB-CE3 3.52Å; P4-W163 HydrophobicContact CB-CZ3 3.73Å; P4-W163 HydrophobicContact CG-CE3 4.01Å; P4-P164 HydrophobicContact CB-CG 4.4Å; P4-P164 HydrophobicContact CG-CG 3.57Å; P4-N165 WeakPolarHBondContact CG-OD1 3.49Å
5	E	94.8	Very high	89.1	Confident	38 Å²	38	53.2 Å²	53.2	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.4	179.4	-62.5	-158.1	167.1	0	0	111.4	L3 K32 I47 R49 H67	L3-E5 PolarHBondContact O-N 3.11Å; E5-K32 IonicContact OE1-NZ 2.72Å; E5-K32 PolarHBondContact OE1-NZ 2.61Å; E5-I47 CarbonylContact C-O 3.59Å; E5-I47 VanDerWaalsContact CA-O 3.28Å; E5-I47 WeakPolarHBondContact CA-O 3Å; E5-I47 HydrophobicContact CG-CB 4.26Å; E5-I47 HydrophobicContact CG-CG2 4.43Å; E5-R49 IonicContact OE2-CZ 3.34Å; E5-R49 IonicContact OE2-NE 2.78Å; E5-R49 PolarHBondContact OE2-NE 3Å; E5-R49 IonicContact OE2-NH2 3.55Å; E5-R49 PolarHBondContact OE2-NH2 3.01Å; E5-H67 PolarHBondContact O-N 2.92Å
6	V	95.7	Very high	88.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.1	163.8	174.6	0	0	0	0	107.8	I46 I47 I48 R49 G68 I70 L158 W163	V6-I46 HydrophobicContact CG2-CD1 4.12Å; V6-I47 PolarHBondContact N-O 2.72Å; V6-I48 HydrophobicContact CB-CG1 4.16Å; V6-I48 CarbonylContact O-C 3.56Å; V6-I48 VanDerWaalsContact O-CA 3.26Å; V6-I48 WeakPolarHBondContact O-CA 3.41Å; V6-R49 PolarHBondContact O-N 3.17Å; V6-G68 CarbonylContact C-O 3.54Å; V6-G68 VanDerWaalsContact CA-O 3.25Å; V6-G68 WeakPolarHBondContact CA-O 3.41Å; V6-I70 HydrophobicContact CG1-CD1 3.99Å; V6-I70 HydrophobicContact CG1-CG1 3.99Å; V6-L158 HydrophobicContact CG2-CD2 4.32Å; V6-W163 HydrophobicContact CG2-CH2 3.54Å; V6-W163 HydrophobicContact CG2-CZ3 4.15Å
7	V	95.3	Very high	88.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.1	177.1	163.8	0	0	0	0	109.6	I9 R49 L51 V66 G68 V69 I70	V7-I9 HydrophobicContact CG1-CD1 3.81Å; V7-I9 HydrophobicContact CG1-CG1 3.64Å; V7-R49 WeakPolarHBondContact CA-O 3.48Å; V7-L51 HydrophobicContact CB-CD1 4.45Å; V7-L51 HydrophobicContact CG1-CB 4.31Å; V7-L51 HydrophobicContact CG1-CD1 3.47Å; V7-L51 VanDerWaalsContact CG1-CD1 3.47Å; V7-L51 HydrophobicContact CG1-CG 4Å; V7-L51 HydrophobicContact CG2-CD1 4.07Å; V7-V66 HydrophobicContact CB-CG1 4.14Å; V7-V66 HydrophobicContact CG2-CB 4.42Å; V7-V66 HydrophobicContact CG2-CG1 3.81Å; V7-V66 HydrophobicContact CG2-CG2 3.68Å; V7-G68 PolarHBondContact N-O 3.43Å; V7-V69 HydrophobicContact CB-CG2 4.49Å; V7-V69 HydrophobicContact CG1-CG2 4.35Å; V7-V69 CarbonylContact O-C 3.39Å; V7-V69 WeakPolarHBondContact O-CA 3.33Å; V7-I70 PolarHBondContact O-N 3.36Å
8	Y	95.4	Very high	87.9	Confident	3 Å²	3	51 Å²	51	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.6	171.7	173.6	-97.9	0	0	0	109.9	D10 C16 L18 L21 R49 S50 L51 I70 C72	Y8-D10 HydrophobicContact CE1-CB 4.01Å; Y8-C16 WeakPolarHBondContact OH-CB 3.23Å; Y8-C16 PolarHBondContact OH-O 3.47Å; Y8-L18 HydrophobicContact CD1-CB 3.77Å; Y8-L18 HydrophobicContact CD1-CD1 4.25Å; Y8-L18 HydrophobicContact CD1-CD2 4.18Å; Y8-L18 HydrophobicContact CD1-CG 4.27Å; Y8-L18 HydrophobicContact CD2-CB 4.46Å; Y8-L18 HydrophobicContact CD2-CD1 3.62Å; Y8-L18 HydrophobicContact CD2-CG 4.48Å; Y8-L18 HydrophobicContact CE1-CB 3.71Å; Y8-L18 HydrophobicContact CE2-CB 4.38Å; Y8-L18 HydrophobicContact CE2-CD1 4.03Å; Y8-L18 HydrophobicContact CG-CB 4.14Å; Y8-L18 HydrophobicContact CG-CD1 3.72Å; Y8-L18 HydrophobicContact CG-CD2 4.12Å; Y8-L18 HydrophobicContact CG-CG 4.19Å; Y8-L21 HydrophobicContact CE2-CD1 3.74Å; Y8-R49 PolarHBondContact N-O 3.27Å; Y8-S50 CarbonylContact O-C 3.48Å; Y8-S50 WeakPolarHBondContact O-CA 3.47Å; Y8-L51 PolarHBondContact O-N 3.21Å; Y8-I70 WeakPolarHBondContact CA-O 3.22Å; Y8-I70 HydrophobicContact CD2-CB 4.11Å; Y8-I70 HydrophobicContact CD2-CG2 3.92Å; Y8-I70 HydrophobicContact CE2-CG2 4.27Å; Y8-C72 HydrophobicContact CE2-CB 4.4Å; Y8-C72 WeakPolarHBondContact CE2-SG 3.35Å; Y8-C72 PolarHBondContact OH-SG 2.8Å
9	I	95.2	Very high	87.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121.1	178.8	-53.7	166.1	0	0	0	108.6	V7 L51 K53 A56 F63 V69 I70 I71 C72 L87	V7-I9 HydrophobicContact CG1-CD1 3.81Å; V7-I9 HydrophobicContact CG1-CG1 3.64Å; I9-L51 HydrophobicContact CG1-CB 4.1Å; I9-K53 HydrophobicContact CG2-CB 4.34Å; I9-A56 HydrophobicContact CD1-CB 3.65Å; I9-A56 HydrophobicContact CG1-CB 4.24Å; I9-A56 HydrophobicContact CG2-CB 4.43Å; I9-F63 HydrophobicContact CD1-CE2 4.35Å; I9-F63 HydrophobicContact CD1-CZ 3.66Å; I9-V69 HydrophobicContact CD1-CG2 4.31Å; I9-I70 PolarHBondContact N-O 3.1Å; I9-I71 WeakPolarHBondContact O-CA 3.5Å; I9-C72 PolarHBondContact O-N 2.99Å; I9-L87 HydrophobicContact CB-CD1 4.22Å; I9-L87 HydrophobicContact CD1-CD1 4.23Å; I9-L87 HydrophobicContact CD1-CD2 3.86Å; I9-L87 HydrophobicContact CG2-CD1 3.6Å
10	D	94.6	Very high	87.1	Confident	42 Å²	42	56.6 Å²	56.6	23%	0.225	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	105.2	171.6	-177.4	21.8	0	0	0	110.4	Y8 S12 G15 C16	Y8-D10 HydrophobicContact CE1-CB 4.01Å; D10-S12 WeakPolarHBondContact OD1-CB 3.27Å; D10-S12 PolarHBondContact OD1-N 3.29Å; D10-S12 PolarHBondContact OD1-OG 3.44Å; D10-S12 PolarHBondContact OD2-OG 3.06Å; D10-G15 VanDerWaalsContact OD2-CA 3.24Å; D10-G15 WeakPolarHBondContact OD2-CA 3.44Å; D10-C16 PolarHBondContact OD2-N 3.49Å
11	A	94.5	Very high	86.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.008	30%	0.303	C	S	.	.			trans	-100.6	5.3	171.7	0	0	0	0	0	113.3	K53 C72 S80 D83 L87	A11-K53 HydrophobicContact CB-CD 3.96Å; A11-C72 CarbonylContact C-O 3.59Å; A11-C72 WeakPolarHBondContact CA-O 3.48Å; A11-C72 VanDerWaalsContact CB-O 3.31Å; A11-C72 WeakPolarHBondContact CB-O 3.08Å; A11-C72 PolarHBondContact N-O 2.9Å; A11-S80 WeakPolarHBondContact O-CB 3.16Å; A11-S80 PolarHBondContact O-OG 3.32Å; A11-D83 HydrophobicContact CB-CB 4.3Å; A11-L87 HydrophobicContact CB-CD1 4.2Å
12	S	92.8	Very high	88	Confident	19 Å²	19	43.4 Å²	43.4	13%	0.133	25%	0.25	C	S	.	.			trans	-69.6	153	176.4	77.2	0	0	0	0	111.5	D10 G15 C16 C72 S74	D10-S12 WeakPolarHBondContact OD1-CB 3.27Å; D10-S12 PolarHBondContact OD1-N 3.29Å; D10-S12 PolarHBondContact OD1-OG 3.44Å; D10-S12 PolarHBondContact OD2-OG 3.06Å; S12-G15 VanDerWaalsContact OG-C 3.28Å; S12-G15 WeakPolarHBondContact OG-CA 3.5Å; S12-G15 PolarHBondContact OG-N 2.85Å; S12-C16 PolarHBondContact OG-N 3.42Å; S12-C72 PolarHBondContact N-O 2.97Å; S12-S74 WeakPolarHBondContact CB-OG 3.38Å
13	E	86.5	Confident	87.6	Confident	105 Å²	105	45 Å²	45	49%	0.491	25%	0.246	S	C	.	.	S	Bend	trans	-81.7	-27.3	176.3	-67.4	-166.5	165.9	0	0	112.7	S74 K77 S79	E13-S74 PolarHBondContact N-OG 2.77Å; E13-K77 HydrophobicContact CG-CB 4.43Å; E13-K77 HydrophobicContact CG-CG 4.21Å; E13-K77 WeakPolarHBondContact OE2-CD 3.35Å; E13-S79 WeakPolarHBondContact OE1-CB 3.47Å; E13-S79 PolarHBondContact OE1-OG 3.13Å
14	N	82.2	Confident	87	Confident	136 Å²	136	48 Å²	48	73%	0.727	26%	0.262	S	S	*	.	S	Bend	trans	-88.4	-7.4	-176.6	-64.1	-26.8	0	0	0	113
15	G	79.8	Confident	86.6	Confident	50 Å²	50	49 Å²	49	52%	0.515	27%	0.267	S	S	.	.			trans	78.9	134.2	-169.2	0	0	0	0	0	111.5	D10 S12	D10-G15 VanDerWaalsContact OD2-CA 3.24Å; D10-G15 WeakPolarHBondContact OD2-CA 3.44Å; S12-G15 VanDerWaalsContact OG-C 3.28Å; S12-G15 WeakPolarHBondContact OG-CA 3.5Å; S12-G15 PolarHBondContact OG-N 2.85Å
16	C	81	Confident	86.1	Confident	32 Å²	32	50.6 Å²	50.6	22%	0.216	28%	0.282	C	S	.	.			trans	-125.2	117.9	168.7	-170.2	0	0	0	0	107.2	Y8 D10 S12 C72	Y8-C16 WeakPolarHBondContact OH-CB 3.23Å; Y8-C16 PolarHBondContact OH-O 3.47Å; D10-C16 PolarHBondContact OD2-N 3.49Å; S12-C16 PolarHBondContact OG-N 3.42Å; C16-C72 HydrophobicContact CB-CB 3.92Å
17	D	80.9	Confident	85.6	Confident	83 Å²	83	54.4 Å²	54.4	44%	0.444	31%	0.305	S	S	.	.			trans	-83.6	120.7	176.7	-179.1	1.2	0	0	0	108.7	R19 T20 L21	D17-R19 PolarHBondContact O-N 3.03Å; D17-R19 VanDerWaalsContact O-N 3.08Å; D17-R19 PolarHBondContact OD1-N 3.04Å; D17-T20 HydrophobicContact CB-CG2 3.89Å; D17-T20 WeakPolarHBondContact O-CA 3.45Å; D17-T20 WeakPolarHBondContact O-CB 3.46Å; D17-T20 PolarHBondContact O-N 3.4Å; D17-T20 PolarHBondContact O-OG1 3.03Å; D17-L21 PolarHBondContact O-N 3.35Å
18	L	83.1	Confident	85	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-48.6	-36.8	174	175.2	59.8	0	0	0	112.5	Y8 T20 L21 L22 L25 F33 I48	Y8-L18 HydrophobicContact CD1-CB 3.77Å; Y8-L18 HydrophobicContact CD1-CD1 4.25Å; Y8-L18 HydrophobicContact CD1-CD2 4.18Å; Y8-L18 HydrophobicContact CD1-CG 4.27Å; Y8-L18 HydrophobicContact CD2-CB 4.46Å; Y8-L18 HydrophobicContact CD2-CD1 3.62Å; Y8-L18 HydrophobicContact CD2-CG 4.48Å; Y8-L18 HydrophobicContact CE1-CB 3.71Å; Y8-L18 HydrophobicContact CE2-CB 4.38Å; Y8-L18 HydrophobicContact CE2-CD1 4.03Å; Y8-L18 HydrophobicContact CG-CB 4.14Å; Y8-L18 HydrophobicContact CG-CD1 3.72Å; Y8-L18 HydrophobicContact CG-CD2 4.12Å; Y8-L18 HydrophobicContact CG-CG 4.19Å; L18-T20 VanDerWaalsContact C-N 3.28Å; L18-T20 PolarHBondContact O-N 3.13Å; L18-L21 WeakPolarHBondContact O-CB 3.31Å; L18-L21 PolarHBondContact O-N 3.26Å; L18-L21 VanDerWaalsContact O-N 3.14Å; L18-L22 HydrophobicContact CD1-CD1 3.93Å; L18-L22 PolarHBondContact O-N 2.65Å; L18-L25 HydrophobicContact CD1-CD1 4.2Å; L18-L25 HydrophobicContact CD2-CD1 3.93Å; L18-L25 HydrophobicContact CG-CD1 3.59Å; L18-F33 HydrophobicContact CD2-CD2 3.49Å; L18-F33 VanDerWaalsContact CD2-CD2 3.49Å; L18-F33 HydrophobicContact CD2-CE2 3.74Å; L18-F33 HydrophobicContact CD2-CG 4.34Å; L18-I48 HydrophobicContact CD1-CG2 4.1Å; L18-I48 HydrophobicContact CD2-CB 4.42Å; L18-I48 HydrophobicContact CD2-CG2 3.53Å; L18-I48 HydrophobicContact CG-CG2 4.44Å
19	R	80.3	Confident	84.6	Confident	122 Å²	122	61.3 Å²	61.3	46%	0.46	35%	0.35	S	S	.	.	H	α-helix	trans	-70.2	-23.1	178.8	-68.2	178.9	173.6	162.7	-2.7	113.7	D17 L21 L25 T27	D17-R19 PolarHBondContact O-N 3.03Å; D17-R19 VanDerWaalsContact O-N 3.08Å; D17-R19 PolarHBondContact OD1-N 3.04Å; R19-L21 VanDerWaalsContact C-N 3.31Å; R19-L25 HydrophobicContact CG-CD1 4.47Å; R19-T27 PolarHBondContact NH2-OG1 2.83Å
20	T	79.8	Confident	83.9	Confident	91 Å²	91	69.3 Å²	69.3	56%	0.558	39%	0.393	S	S	*	.	H	α-helix	trans	-78.8	-19.3	172.4	64.4	0	0	0	0	112.5	D17 L18	D17-T20 HydrophobicContact CB-CG2 3.89Å; D17-T20 WeakPolarHBondContact O-CA 3.45Å; D17-T20 WeakPolarHBondContact O-CB 3.46Å; D17-T20 PolarHBondContact O-N 3.4Å; D17-T20 PolarHBondContact O-OG1 3.03Å; L18-T20 VanDerWaalsContact C-N 3.28Å; L18-T20 PolarHBondContact O-N 3.13Å
21	L	81.3	Confident	83.6	Confident	6 Å²	6	69.7 Å²	69.7	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-88.5	-29.7	175.1	-66.1	178.1	0	0	0	112.7	Y8 D17 L18 R19 C72 V102 I136 V151	Y8-L21 HydrophobicContact CE2-CD1 3.74Å; D17-L21 PolarHBondContact O-N 3.35Å; L18-L21 WeakPolarHBondContact O-CB 3.31Å; L18-L21 PolarHBondContact O-N 3.26Å; L18-L21 VanDerWaalsContact O-N 3.14Å; R19-L21 VanDerWaalsContact C-N 3.31Å; L21-C72 VanDerWaalsContact CD1-SG 3.51Å; L21-V102 HydrophobicContact CD2-CG1 4.46Å; L21-I136 HydrophobicContact CD2-CD1 3.48Å; L21-I136 VanDerWaalsContact CD2-CD1 3.48Å; L21-I136 HydrophobicContact CD2-CG1 3.86Å; L21-V151 WeakPolarHBondContact O-CG1 3.17Å; L21-V151 WeakPolarHBondContact O-CG2 3.17Å
22	L	85.9	Confident	83.5	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	41%	0.411	C	S	.	.			trans	-135.6	98.5	-174.4	-62.5	174.9	0	0	0	109.9	L18 N24 L25 I48 I154 I155	L18-L22 HydrophobicContact CD1-CD1 3.93Å; L18-L22 PolarHBondContact O-N 2.65Å; L22-N24 PolarHBondContact O-N 2.76Å; L22-L25 HydrophobicContact CB-CD1 3.91Å; L22-L25 HydrophobicContact CB-CD2 4.2Å; L22-L25 HydrophobicContact CB-CG 3.84Å; L22-L25 HydrophobicContact CD1-CD2 4.31Å; L22-L25 WeakPolarHBondContact O-CG 3.26Å; L22-I48 HydrophobicContact CD1-CD1 3.41Å; L22-I48 VanDerWaalsContact CD1-CD1 3.41Å; L22-I154 HydrophobicContact CD2-CG2 4.18Å; L22-I155 HydrophobicContact CD2-CD1 3.48Å; L22-I155 VanDerWaalsContact CD2-CD1 3.48Å; L22-I155 HydrophobicContact CD2-CG1 4.23Å
23	D	75.7	Confident	83.5	Confident	130 Å²	130	72.6 Å²	72.6	70%	0.695	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-3.2	-171.5	-65.6	-27.2	0	0	0	114.8
24	N	77.5	Confident	83.9	Confident	135 Å²	135	68 Å²	68	72%	0.722	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	33	-173.2	-67.2	-49.6	0	0	0	113.7	L22 L35	L22-N24 PolarHBondContact O-N 2.76Å; N24-L35 HydrophobicContact CB-CD1 4.44Å
25	L	85.5	Confident	84.4	Confident	27 Å²	27	62 Å²	62	14%	0.141	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-86	120.3	178.6	-68	-179	0	0	0	112.4	L18 R19 L22 F33 L35 I48	L18-L25 HydrophobicContact CD1-CD1 4.2Å; L18-L25 HydrophobicContact CD2-CD1 3.93Å; L18-L25 HydrophobicContact CG-CD1 3.59Å; R19-L25 HydrophobicContact CG-CD1 4.47Å; L22-L25 HydrophobicContact CB-CD1 3.91Å; L22-L25 HydrophobicContact CB-CD2 4.2Å; L22-L25 HydrophobicContact CB-CG 3.84Å; L22-L25 HydrophobicContact CD1-CD2 4.31Å; L22-L25 WeakPolarHBondContact O-CG 3.26Å; L25-F33 HydrophobicContact CB-CB 4.04Å; L25-F33 HydrophobicContact CB-CD1 4.32Å; L25-F33 HydrophobicContact CB-CG 4.42Å; L25-F33 HydrophobicContact CD1-CB 4.14Å; L25-F33 HydrophobicContact CD1-CG 4.19Å; L25-F33 HydrophobicContact CD2-CB 3.99Å; L25-F33 HydrophobicContact CG-CB 4.27Å; L25-L35 HydrophobicContact CD2-CB 3.94Å; L25-L35 HydrophobicContact CD2-CD1 4.15Å; L25-L35 HydrophobicContact CD2-CG 4.49Å; L25-I48 HydrophobicContact CD2-CD1 3.77Å
26	S	84.6	Confident	85.1	Confident	71 Å²	71	65.7 Å²	65.7	50%	0.497	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	120.8	169.1	59.8	0	0	0	0	109.7	V28 F33 G34	S26-V28 PolarHBondContact O-N 3.45Å; S26-F33 CarbonylContact O-C 3.43Å; S26-F33 VanDerWaalsContact O-CA 3.28Å; S26-F33 WeakPolarHBondContact O-CA 3.38Å; S26-G34 PolarHBondContact N-O 3.16Å; S26-G34 PolarHBondContact O-N 3.01Å; S26-G34 WeakPolarHBondContact OG-CA 3.3Å; S26-G34 PolarHBondContact OG-O 3.06Å
27	T	85.1	Confident	85.7	Confident	80 Å²	80	64.4 Å²	64.4	49%	0.491	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.2	-180	-57.8	0	0	0	0	110	R19 F33	R19-T27 PolarHBondContact NH2-OG1 2.83Å; T27-F33 HydrophobicContact CG2-CE1 4.35Å
28	V	83.3	Confident	86.3	Confident	90 Å²	90	64 Å²	64	55%	0.545	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-47.4	178.2	177.6	0	0	0	0	110.2	S26 K32 I47	S26-V28 PolarHBondContact O-N 3.45Å; V28-K32 WeakPolarHBondContact CA-O 3.16Å; V28-K32 HydrophobicContact CB-CB 4.31Å; V28-K32 WeakPolarHBondContact CB-O 3.44Å; V28-K32 PolarHBondContact N-O 2.83Å; V28-I47 HydrophobicContact CG2-CD1 3.93Å
29	C	86.3	Confident	86.7	Confident	58 Å²	58	64.4 Å²	64.4	39%	0.392	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	-179.2	168.2	68.9	0	0	0	0	110.1	S31 K32	C29-S31 PolarHBondContact O-N 2.8Å; C29-K32 PolarHBondContact N-O 3.32Å; C29-K32 VanDerWaalsContact N-O 3.11Å; C29-K32 PolarHBondContact O-N 3.46Å; C29-K32 VanDerWaalsContact SG-CB 3.55Å
30	D	82.2	Confident	87.1	Confident	169 Å²	169	66.6 Å²	66.6	90%	0.904	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.1	-38.1	-171	-62.8	-17	0	0	0	114.8
31	S	87.8	Confident	87.6	Confident	50 Å²	50	69.9 Å²	69.9	35%	0.35	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	9.4	-179.4	63.6	0	0	0	0	114.4	C29 R49 S50	C29-S31 PolarHBondContact O-N 2.8Å; S31-R49 CarbonylContact O-C 3.48Å; S31-R49 VanDerWaalsContact O-CA 3.28Å; S31-R49 WeakPolarHBondContact O-CA 3.47Å; S31-S50 WeakPolarHBondContact CB-O 3.28Å; S31-S50 PolarHBondContact O-N 3.24Å
32	K	91.6	Very high	88.2	Confident	64 Å²	64	70.5 Å²	70.5	28%	0.278	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.6	179	-63.7	-173	171.3	-159.8	0	111.6	E5 V28 C29 I47 I48 R49	E5-K32 IonicContact OE1-NZ 2.72Å; E5-K32 PolarHBondContact OE1-NZ 2.61Å; V28-K32 WeakPolarHBondContact CA-O 3.16Å; V28-K32 HydrophobicContact CB-CB 4.31Å; V28-K32 WeakPolarHBondContact CB-O 3.44Å; V28-K32 PolarHBondContact N-O 2.83Å; C29-K32 PolarHBondContact N-O 3.32Å; C29-K32 VanDerWaalsContact N-O 3.11Å; C29-K32 PolarHBondContact O-N 3.46Å; C29-K32 VanDerWaalsContact SG-CB 3.55Å; K32-I47 HydrophobicContact CB-CG2 4Å; K32-I47 HydrophobicContact CD-CG2 4.09Å; K32-I47 HydrophobicContact CG-CG2 4.17Å; K32-I48 WeakPolarHBondContact CA-O 3.47Å; K32-R49 HydrophobicContact CG-CB 4.25Å; K32-R49 HydrophobicContact CG-CG 4.25Å
33	F	93.2	Very high	88.6	Confident	16 Å²	16	71.5 Å²	71.5	7%	0.07	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.5	-179.7	-53.6	-84.2	0	0	0	109.4	L18 L25 S26 T27 I47 I48	L18-F33 HydrophobicContact CD2-CD2 3.49Å; L18-F33 VanDerWaalsContact CD2-CD2 3.49Å; L18-F33 HydrophobicContact CD2-CE2 3.74Å; L18-F33 HydrophobicContact CD2-CG 4.34Å; L25-F33 HydrophobicContact CB-CB 4.04Å; L25-F33 HydrophobicContact CB-CD1 4.32Å; L25-F33 HydrophobicContact CB-CG 4.42Å; L25-F33 HydrophobicContact CD1-CB 4.14Å; L25-F33 HydrophobicContact CD1-CG 4.19Å; L25-F33 HydrophobicContact CD2-CB 3.99Å; L25-F33 HydrophobicContact CG-CB 4.27Å; S26-F33 CarbonylContact O-C 3.43Å; S26-F33 VanDerWaalsContact O-CA 3.28Å; S26-F33 WeakPolarHBondContact O-CA 3.38Å; T27-F33 HydrophobicContact CG2-CE1 4.35Å; F33-I47 CarbonylContact O-C 3.49Å; F33-I47 WeakPolarHBondContact O-CA 2.9Å; F33-I48 PolarHBondContact N-O 3.45Å; F33-I48 PolarHBondContact O-N 3.38Å
34	G	94	Very high	89.5	Confident	9 Å²	9	65.4 Å²	65.4	9%	0.093	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.7	170.2	0	0	0	0	0	110.1	S26 I46	S26-G34 PolarHBondContact N-O 3.16Å; S26-G34 PolarHBondContact O-N 3.01Å; S26-G34 WeakPolarHBondContact OG-CA 3.3Å; S26-G34 PolarHBondContact OG-O 3.06Å; G34-I46 WeakPolarHBondContact CA-O 3.49Å
35	L	94.5	Very high	90.4	Very high	11 Å²	11	62 Å²	62	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.9	170.9	-179.8	65.7	0	0	0	108.6	N24 L25 I37 I46 I48 L158	N24-L35 HydrophobicContact CB-CD1 4.44Å; L25-L35 HydrophobicContact CD2-CB 3.94Å; L25-L35 HydrophobicContact CD2-CD1 4.15Å; L25-L35 HydrophobicContact CD2-CG 4.49Å; L35-I37 HydrophobicContact CD2-CD1 3.86Å; L35-I37 HydrophobicContact CG-CD1 4.19Å; L35-I46 HydrophobicContact CB-CD1 4.46Å; L35-I46 HydrophobicContact CB-CG1 3.88Å; L35-I46 HydrophobicContact CD2-CD1 4.15Å; L35-I46 HydrophobicContact CD2-CG1 4.44Å; L35-I46 HydrophobicContact CG-CG1 4.46Å; L35-I46 PolarHBondContact N-O 2.98Å; L35-I46 PolarHBondContact O-N 3.24Å; L35-I48 HydrophobicContact CB-CD1 4.08Å; L35-I48 HydrophobicContact CD2-CD1 3.76Å; L35-L158 HydrophobicContact CD2-CD1 3.78Å
36	K	93.9	Very high	90.8	Very high	127 Å²	127	60.8 Å²	60.8	55%	0.552	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	114	172.6	-174.7	-177.5	177.8	-162.8	0	109.1
37	I	94.1	Very high	91.3	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	125.2	168.3	-56.2	-57.7	0	0	0	107.6	L35 Y42 S43 A44 I46 L158 E159	L35-I37 HydrophobicContact CD2-CD1 3.86Å; L35-I37 HydrophobicContact CG-CD1 4.19Å; I37-Y42 HydrophobicContact CB-CE2 4.45Å; I37-Y42 HydrophobicContact CG2-CE2 3.67Å; I37-S43 CarbonylContact O-C 3.47Å; I37-S43 WeakPolarHBondContact O-CA 3.03Å; I37-A44 HydrophobicContact CB-CB 4.26Å; I37-A44 PolarHBondContact N-O 3.42Å; I37-A44 PolarHBondContact O-N 3.37Å; I37-I46 HydrophobicContact CD1-CD1 4.18Å; I37-I46 HydrophobicContact CG1-CD1 4.18Å; I37-I46 HydrophobicContact CG1-CG1 4.39Å; I37-I46 HydrophobicContact CG1-CG2 4.38Å; I37-L158 HydrophobicContact CD1-CB 3.87Å; I37-E159 HydrophobicContact CG2-CG 4.05Å
38	D	92.4	Very high	91.8	Very high	76 Å²	76	54.3 Å²	54.3	41%	0.406	28%	0.276	S	S	.	.			trans	-143.2	57.4	-174.2	-160.3	36.5	0	0	0	112.5	S43 K169	D38-S43 WeakPolarHBondContact OD1-CB 3.46Å; D38-K169 PolarHBondContact O-NZ 3.4Å; D38-K169 WeakPolarHBondContact OD1-CE 3.31Å; D38-K169 IonicContact OD1-NZ 3.42Å; D38-K169 PolarHBondContact OD1-NZ 3.03Å; D38-K169 IonicContact OD2-NZ 3.55Å
39	C	91.3	Very high	92.3	Very high	13 Å²	13	51.3 Å²	51.3	9%	0.088	26%	0.255	C	S	.	.			trans	-78.4	-177.2	-177.9	78.3	0	0	0	0	112.9	Y41 Y42 E159 K169	C39-Y41 PolarHBondContact O-N 3.21Å; C39-Y42 PolarHBondContact N-O 3.24Å; C39-Y42 VanDerWaalsContact SG-CD1 3.55Å; C39-Y42 VanDerWaalsContact SG-CE1 3.51Å; C39-E159 HydrophobicContact CB-CB 4.16Å; C39-E159 HydrophobicContact CB-CG 4.08Å; C39-K169 WeakPolarHBondContact O-CD 3.28Å; C39-K169 VanDerWaalsContact O-CE 3.26Å; C39-K169 WeakPolarHBondContact O-CE 3.45Å; C39-K169 PolarHBondContact O-NZ 3.46Å
40	K	89.8	Confident	92.6	Very high	168 Å²	168	50.6 Å²	50.6	73%	0.73	25%	0.251	S	S	*	.	S	Bend	trans	-57.9	-30.9	179.5	-174.2	179.4	177.4	-175.7	0	113.6
41	Y	89.7	Confident	93	Very high	159 Å²	159	43.6 Å²	43.6	62%	0.624	21%	0.213	S	C	*	.	S	Bend	trans	-101.4	-32.8	-166.4	-53.2	-68.8	0	0	0	114	C39 K169	C39-Y41 PolarHBondContact O-N 3.21Å; Y41-K169 PolarHBondContact O-N 3Å
42	Y	94.1	Very high	93.2	Very high	19 Å²	19	45.4 Å²	45.4	8%	0.075	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	172.5	-176.5	70.2	-91.9	0	0	0	111.2	I37 C39 A44 E159 H161 W163 M166 K167 K169	I37-Y42 HydrophobicContact CB-CE2 4.45Å; I37-Y42 HydrophobicContact CG2-CE2 3.67Å; C39-Y42 PolarHBondContact N-O 3.24Å; C39-Y42 VanDerWaalsContact SG-CD1 3.55Å; C39-Y42 VanDerWaalsContact SG-CE1 3.51Å; Y42-A44 HydrophobicContact CD2-CB 4.13Å; Y42-A44 HydrophobicContact CE2-CB 3.93Å; Y42-E159 WeakPolarHBondContact CE1-O 3.18Å; Y42-E159 VanDerWaalsContact OH-C 3.26Å; Y42-E159 PolarHBondContact OH-O 2.95Å; Y42-H161 PolarHBondContact OH-O 3.16Å; Y42-W163 AromaticContact CE2-CD1 3.67Å; Y42-W163 AromaticContact CZ-CD1 3.83Å; Y42-W163 VanDerWaalsContact OH-CD1 3.26Å; Y42-W163 PolarHBondContact OH-NE1 3.02Å; Y42-M166 HydrophobicContact CD2-CB 3.64Å; Y42-M166 HydrophobicContact CE2-CB 4.27Å; Y42-M166 HydrophobicContact CG-CB 4.04Å; Y42-M166 HydrophobicContact CG-SD 4.43Å; Y42-K167 CarbonylContact C-O 3.51Å; Y42-K167 VanDerWaalsContact CA-O 3.26Å; Y42-K167 WeakPolarHBondContact CA-O 3.33Å; Y42-K167 WeakPolarHBondContact CB-O 3.44Å; Y42-K169 WeakPolarHBondContact O-CE 3.49Å
43	S	94.7	Very high	93.1	Very high	25 Å²	25	45 Å²	45	18%	0.175	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	143	165.4	57.5	0	0	0	0	109.8	I37 D38 M166 K167	I37-S43 CarbonylContact O-C 3.47Å; I37-S43 WeakPolarHBondContact O-CA 3.03Å; D38-S43 WeakPolarHBondContact OD1-CB 3.46Å; S43-M166 CarbonylContact O-C 3.55Å; S43-M166 WeakPolarHBondContact O-CA 3.1Å; S43-K167 PolarHBondContact N-O 3.19Å; S43-K167 PolarHBondContact O-N 3.29Å
44	A	95	Very high	93	Very high	2 Å²	2	49.3 Å²	49.3	2%	0.017	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.2	176.3	0	0	0	0	0	109.8	I37 Y42 W163 M166	I37-A44 HydrophobicContact CB-CB 4.26Å; I37-A44 PolarHBondContact N-O 3.42Å; I37-A44 PolarHBondContact O-N 3.37Å; Y42-A44 HydrophobicContact CD2-CB 4.13Å; Y42-A44 HydrophobicContact CE2-CB 3.93Å; A44-W163 HydrophobicContact CB-CB 3.81Å; A44-W163 HydrophobicContact CB-CG 3.95Å; A44-M166 HydrophobicContact CB-CB 4.46Å
45	D	95	Very high	92.6	Very high	64 Å²	64	50.9 Å²	50.9	34%	0.342	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.7	174.8	-58.8	-58.7	0	0	0	108.3	L3 N165	L3-D45 HydrophobicContact CD1-CB 4.39Å; L3-D45 HydrophobicContact CD2-CB 4.12Å; D45-N165 PolarHBondContact N-ND2 3.17Å; D45-N165 PolarHBondContact O-ND2 3.23Å
46	I	95.1	Very high	92.4	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	161.7	179.8	72.8	173.1	0	0	0	110.6	P4 V6 G34 L35 I37 W163	P4-I46 HydrophobicContact CB-CG2 4.29Å; V6-I46 HydrophobicContact CG2-CD1 4.12Å; G34-I46 WeakPolarHBondContact CA-O 3.49Å; L35-I46 HydrophobicContact CB-CD1 4.46Å; L35-I46 HydrophobicContact CB-CG1 3.88Å; L35-I46 HydrophobicContact CD2-CD1 4.15Å; L35-I46 HydrophobicContact CD2-CG1 4.44Å; L35-I46 HydrophobicContact CG-CG1 4.46Å; L35-I46 PolarHBondContact N-O 2.98Å; L35-I46 PolarHBondContact O-N 3.24Å; I37-I46 HydrophobicContact CD1-CD1 4.18Å; I37-I46 HydrophobicContact CG1-CD1 4.18Å; I37-I46 HydrophobicContact CG1-CG1 4.39Å; I37-I46 HydrophobicContact CG1-CG2 4.38Å; I46-W163 HydrophobicContact CB-CZ3 4.4Å; I46-W163 HydrophobicContact CD1-CH2 3.72Å; I46-W163 HydrophobicContact CD1-CZ2 3.74Å; I46-W163 HydrophobicContact CD1-CZ3 4.38Å; I46-W163 HydrophobicContact CG2-CD2 3.59Å; I46-W163 HydrophobicContact CG2-CE3 3.51Å; I46-W163 HydrophobicContact CG2-CG 4.26Å; I46-W163 HydrophobicContact CG2-CH2 4.05Å; I46-W163 HydrophobicContact CG2-CZ2 4.12Å; I46-W163 HydrophobicContact CG2-CZ3 3.74Å
47	I	94.9	Very high	92.1	Very high	16 Å²	16	46.7 Å²	46.7	8%	0.082	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.8	173.5	-64.5	-66.7	0	0	0	108.9	L3 P4 E5 V6 V28 K32 F33	L3-I47 HydrophobicContact CB-CG1 3.85Å; L3-I47 HydrophobicContact CD1-CD1 4.01Å; L3-I47 HydrophobicContact CD1-CG1 3.9Å; L3-I47 HydrophobicContact CG-CG1 4.49Å; P4-I47 PolarHBondContact O-N 2.8Å; E5-I47 CarbonylContact C-O 3.59Å; E5-I47 VanDerWaalsContact CA-O 3.28Å; E5-I47 WeakPolarHBondContact CA-O 3Å; E5-I47 HydrophobicContact CG-CB 4.26Å; E5-I47 HydrophobicContact CG-CG2 4.43Å; V6-I47 PolarHBondContact N-O 2.72Å; V28-I47 HydrophobicContact CG2-CD1 3.93Å; K32-I47 HydrophobicContact CB-CG2 4Å; K32-I47 HydrophobicContact CD-CG2 4.09Å; K32-I47 HydrophobicContact CG-CG2 4.17Å; F33-I47 CarbonylContact O-C 3.49Å; F33-I47 WeakPolarHBondContact O-CA 2.9Å
48	I	94.9	Very high	91.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.3	166.2	-62	166.4	0	0	0	108.2	V6 L18 L22 L25 K32 F33 L35	V6-I48 HydrophobicContact CB-CG1 4.16Å; V6-I48 CarbonylContact O-C 3.56Å; V6-I48 VanDerWaalsContact O-CA 3.26Å; V6-I48 WeakPolarHBondContact O-CA 3.41Å; L18-I48 HydrophobicContact CD1-CG2 4.1Å; L18-I48 HydrophobicContact CD2-CB 4.42Å; L18-I48 HydrophobicContact CD2-CG2 3.53Å; L18-I48 HydrophobicContact CG-CG2 4.44Å; L22-I48 HydrophobicContact CD1-CD1 3.41Å; L22-I48 VanDerWaalsContact CD1-CD1 3.41Å; L25-I48 HydrophobicContact CD2-CD1 3.77Å; K32-I48 WeakPolarHBondContact CA-O 3.47Å; F33-I48 PolarHBondContact N-O 3.45Å; F33-I48 PolarHBondContact O-N 3.38Å; L35-I48 HydrophobicContact CB-CD1 4.08Å; L35-I48 HydrophobicContact CD2-CD1 3.76Å
49	R	93.4	Very high	90.7	Very high	26 Å²	26	54.3 Å²	54.3	10%	0.098	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.2	176.5	175.9	166.5	44.4	97.4	7.3	109.5	E5 V6 V7 Y8 S31 K32 L51 D62	E5-R49 IonicContact OE2-CZ 3.34Å; E5-R49 IonicContact OE2-NE 2.78Å; E5-R49 PolarHBondContact OE2-NE 3Å; E5-R49 IonicContact OE2-NH2 3.55Å; E5-R49 PolarHBondContact OE2-NH2 3.01Å; V6-R49 PolarHBondContact O-N 3.17Å; V7-R49 WeakPolarHBondContact CA-O 3.48Å; Y8-R49 PolarHBondContact N-O 3.27Å; S31-R49 CarbonylContact O-C 3.48Å; S31-R49 VanDerWaalsContact O-CA 3.28Å; S31-R49 WeakPolarHBondContact O-CA 3.47Å; K32-R49 HydrophobicContact CG-CB 4.25Å; K32-R49 HydrophobicContact CG-CG 4.25Å; R49-L51 HydrophobicContact CG-CD2 4.25Å; R49-L51 HydrophobicContact CG-CG 4.36Å; R49-D62 PolarHBondContact NH1-O 2.95Å; R49-D62 IonicContact NH1-OD1 3.01Å; R49-D62 PolarHBondContact NH1-OD1 3.33Å; R49-D62 PolarHBondContact NH2-O 3.15Å
50	S	92.5	Very high	89.7	Confident	43 Å²	43	57 Å²	57	30%	0.301	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.1	169.3	178.5	0	0	0	0	109.6	Y8 S31	Y8-S50 CarbonylContact O-C 3.48Å; Y8-S50 WeakPolarHBondContact O-CA 3.47Å; S31-S50 WeakPolarHBondContact CB-O 3.28Å; S31-S50 PolarHBondContact O-N 3.24Å
51	L	92	Very high	88.9	Confident	22 Å²	22	52.6 Å²	52.6	12%	0.115	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.9	177	-76.3	-175.1	0	0	0	110.6	V7 Y8 I9 R49 D62	V7-L51 HydrophobicContact CB-CD1 4.45Å; V7-L51 HydrophobicContact CG1-CB 4.31Å; V7-L51 HydrophobicContact CG1-CD1 3.47Å; V7-L51 VanDerWaalsContact CG1-CD1 3.47Å; V7-L51 HydrophobicContact CG1-CG 4Å; V7-L51 HydrophobicContact CG2-CD1 4.07Å; Y8-L51 PolarHBondContact O-N 3.21Å; I9-L51 HydrophobicContact CG1-CB 4.1Å; R49-L51 HydrophobicContact CG-CD2 4.25Å; R49-L51 HydrophobicContact CG-CG 4.36Å; L51-D62 HydrophobicContact CD1-CB 3.62Å
52	D	90.2	Very high	88.5	Confident	89 Å²	89	46.7 Å²	46.7	48%	0.476	26%	0.256	S	S	.	.			trans	-64.2	135.1	168.7	168.5	68.6	0	0	0	110.5	L54 C55 A56	D52-L54 VanDerWaalsContact C-N 3.32Å; D52-L54 PolarHBondContact O-N 3.27Å; D52-L54 WeakPolarHBondContact OD2-CA 3.46Å; D52-L54 VanDerWaalsContact OD2-CB 3.31Å; D52-L54 WeakPolarHBondContact OD2-CB 3.4Å; D52-L54 PolarHBondContact OD2-N 3.23Å; D52-C55 HydrophobicContact CB-CB 4.19Å; D52-C55 WeakPolarHBondContact O-CB 3.45Å; D52-C55 PolarHBondContact O-N 3.4Å; D52-C55 VanDerWaalsContact O-N 3.13Å; D52-C55 PolarHBondContact OD2-N 3.22Å; D52-A56 PolarHBondContact O-N 3.18Å
53	K	91.1	Very high	88	Confident	55 Å²	55	45.9 Å²	45.9	24%	0.239	25%	0.252	C	S	.	.	H	α-helix	trans	-54.1	-45.6	-179.4	178.2	179.9	73	171.3	0	112.6	I9 A11 C55 A56 L57 D83	I9-K53 HydrophobicContact CG2-CB 4.34Å; A11-K53 HydrophobicContact CB-CD 3.96Å; K53-C55 VanDerWaalsContact C-N 3.32Å; K53-C55 PolarHBondContact O-N 3.33Å; K53-A56 PolarHBondContact O-N 2.94Å; K53-L57 HydrophobicContact CG-CD1 3.91Å; K53-L57 HydrophobicContact CG-CG 4.49Å; K53-L57 WeakPolarHBondContact O-CB 3.45Å; K53-L57 WeakPolarHBondContact O-CG 3.28Å; K53-L57 PolarHBondContact O-N 3.38Å; K53-D83 HydrophobicContact CD-CB 4.1Å; K53-D83 WeakPolarHBondContact CD-OD2 3.18Å; K53-D83 WeakPolarHBondContact CE-OD2 2.92Å; K53-D83 IonicContact NZ-OD2 3.69Å; K53-D83 PolarHBondContact NZ-OD2 3.01Å
54	L	89.4	Confident	87.4	Confident	107 Å²	107	49.4 Å²	49.4	56%	0.56	27%	0.268	S	S	*	.	H	α-helix	trans	-67.9	-36.9	-178.3	-62.1	174.1	0	0	0	110.9	D52 N58	D52-L54 VanDerWaalsContact C-N 3.32Å; D52-L54 PolarHBondContact O-N 3.27Å; D52-L54 WeakPolarHBondContact OD2-CA 3.46Å; D52-L54 VanDerWaalsContact OD2-CB 3.31Å; D52-L54 WeakPolarHBondContact OD2-CB 3.4Å; D52-L54 PolarHBondContact OD2-N 3.23Å; L54-N58 WeakPolarHBondContact O-CB 3.37Å; L54-N58 PolarHBondContact O-N 3.13Å; L54-N58 PolarHBondContact O-ND2 2.78Å
55	C	87.3	Confident	86.8	Confident	41 Å²	41	56 Å²	56	28%	0.277	30%	0.304	S	S	.	.	H	α-helix	trans	-62.4	-50.6	172.5	-69.6	0	0	0	0	111.3	D52 K53 L57 N58 K59	D52-C55 HydrophobicContact CB-CB 4.19Å; D52-C55 WeakPolarHBondContact O-CB 3.45Å; D52-C55 PolarHBondContact O-N 3.4Å; D52-C55 VanDerWaalsContact O-N 3.13Å; D52-C55 PolarHBondContact OD2-N 3.22Å; K53-C55 VanDerWaalsContact C-N 3.32Å; K53-C55 PolarHBondContact O-N 3.33Å; C55-L57 VanDerWaalsContact C-N 3.34Å; C55-L57 PolarHBondContact O-N 3.48Å; C55-N58 PolarHBondContact O-N 3.04Å; C55-N58 VanDerWaalsContact O-N 3.14Å; C55-K59 HydrophobicContact CB-CD 4.43Å; C55-K59 VanDerWaalsContact O-CB 3.26Å; C55-K59 WeakPolarHBondContact O-CB 3.49Å; C55-K59 PolarHBondContact O-N 3.19Å
56	A	88.9	Confident	86.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-40.9	-178.1	0	0	0	0	0	112.9	I9 D52 K53 N58 F63 L87 L90	I9-A56 HydrophobicContact CD1-CB 3.65Å; I9-A56 HydrophobicContact CG1-CB 4.24Å; I9-A56 HydrophobicContact CG2-CB 4.43Å; D52-A56 PolarHBondContact O-N 3.18Å; K53-A56 PolarHBondContact O-N 2.94Å; A56-N58 VanDerWaalsContact C-N 3.32Å; A56-N58 PolarHBondContact O-N 3.01Å; A56-F63 HydrophobicContact CB-CE2 4.35Å; A56-L87 HydrophobicContact CB-CD2 3.8Å; A56-L90 VanDerWaalsContact O-CD2 3.23Å; A56-L90 WeakPolarHBondContact O-CD2 3.44Å
57	L	87.9	Confident	86.7	Confident	51 Å²	51	55.9 Å²	55.9	27%	0.267	30%	0.301	S	S	.	.	H	α-helix	trans	-69.3	-26.9	178.1	-71.9	172	0	0	0	113.7	K53 C55 K86 L87	K53-L57 HydrophobicContact CG-CD1 3.91Å; K53-L57 HydrophobicContact CG-CG 4.49Å; K53-L57 WeakPolarHBondContact O-CB 3.45Å; K53-L57 WeakPolarHBondContact O-CG 3.28Å; K53-L57 PolarHBondContact O-N 3.38Å; C55-L57 VanDerWaalsContact C-N 3.34Å; C55-L57 PolarHBondContact O-N 3.48Å; L57-K86 HydrophobicContact CD2-CB 3.56Å; L57-K86 HydrophobicContact CD2-CD 4.01Å; L57-K86 HydrophobicContact CD2-CG 4.47Å; L57-L87 HydrophobicContact CD2-CD2 3.74Å; L57-L87 HydrophobicContact CD2-CG 3.92Å; L57-L87 HydrophobicContact CG-CD2 4.04Å; L57-L87 HydrophobicContact CG-CG 4.47Å
58	N	85.5	Confident	86.7	Confident	133 Å²	133	55.1 Å²	55.1	71%	0.711	30%	0.297	S	S	*	.	H	α-helix	trans	-101.4	-15.9	-176.2	-69.9	-52.2	0	0	0	113.8	L54 C55 A56	L54-N58 WeakPolarHBondContact O-CB 3.37Å; L54-N58 PolarHBondContact O-N 3.13Å; L54-N58 PolarHBondContact O-ND2 2.78Å; C55-N58 PolarHBondContact O-N 3.04Å; C55-N58 VanDerWaalsContact O-N 3.14Å; A56-N58 VanDerWaalsContact C-N 3.32Å; A56-N58 PolarHBondContact O-N 3.01Å
59	K	71.9	Confident	86.8	Confident	106 Å²	106	55.1 Å²	55.1	46%	0.461	30%	0.297	S	S	.	.			trans	-125.2	101.6	-172.7	-62.5	177	-177.2	170.3	0	110.8	C55 P61 D62	C55-K59 HydrophobicContact CB-CD 4.43Å; C55-K59 VanDerWaalsContact O-CB 3.26Å; C55-K59 WeakPolarHBondContact O-CB 3.49Å; C55-K59 PolarHBondContact O-N 3.19Å; K59-P61 HydrophobicContact CB-CG 4.35Å; K59-D62 WeakPolarHBondContact CB-OD2 3.44Å
60	S	69.6	Low	87	Confident	70 Å²	70	54 Å²	54	49%	0.49	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-58	-34	167.8	58.2	0	0	0	0	115.9	D62 F63 H94	S60-D62 PolarHBondContact O-N 3.35Å; S60-F63 PolarHBondContact O-N 3.18Å; S60-H94 PolarHBondContact O-NE2 2.67Å
61	P	74.2	Confident	87.2	Confident	76 Å²	76	52 Å²	52	49%	0.494	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-65.2	-15.1	-173.5	24.4	-35.8	0	0	0	114.3	K59 F63 I64	K59-P61 HydrophobicContact CB-CG 4.35Å; P61-F63 PolarHBondContact O-N 3.04Å; P61-I64 HydrophobicContact CB-CD1 3.86Å; P61-I64 WeakPolarHBondContact O-CG1 3.26Å; P61-I64 PolarHBondContact O-N 2.65Å
62	D	81	Confident	87.4	Confident	34 Å²	34	51 Å²	51	18%	0.182	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-68.3	-14.7	179.9	-76.8	-41.1	0	0	0	113.7	R49 L51 K59 S60	R49-D62 PolarHBondContact NH1-O 2.95Å; R49-D62 IonicContact NH1-OD1 3.01Å; R49-D62 PolarHBondContact NH1-OD1 3.33Å; R49-D62 PolarHBondContact NH2-O 3.15Å; L51-D62 HydrophobicContact CD1-CB 3.62Å; K59-D62 WeakPolarHBondContact CB-OD2 3.44Å; S60-D62 PolarHBondContact O-N 3.35Å
63	F	83.6	Confident	87.7	Confident	2 Å²	2	47 Å²	47	1%	0.009	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-99.8	0.5	178	-73.9	-98	0	0	0	114	I9 A56 S60 P61 N65 V66 V69 L90 A91 H94 V96	I9-F63 HydrophobicContact CD1-CE2 4.35Å; I9-F63 HydrophobicContact CD1-CZ 3.66Å; A56-F63 HydrophobicContact CB-CE2 4.35Å; S60-F63 PolarHBondContact O-N 3.18Å; P61-F63 PolarHBondContact O-N 3.04Å; F63-N65 PolarHBondContact O-N 2.86Å; F63-V66 PolarHBondContact O-N 3.33Å; F63-V69 HydrophobicContact CE1-CB 4.38Å; F63-V69 HydrophobicContact CE1-CG2 3.93Å; F63-V69 HydrophobicContact CZ-CG2 4.48Å; F63-L90 HydrophobicContact CD2-CD2 3.58Å; F63-L90 HydrophobicContact CD2-CG 3.9Å; F63-L90 HydrophobicContact CE2-CD2 3.18Å; F63-L90 HydrophobicContact CE2-CG 3.84Å; F63-L90 HydrophobicContact CG-CD2 4.49Å; F63-L90 HydrophobicContact CG-CG 4.36Å; F63-L90 HydrophobicContact CZ-CD2 3.8Å; F63-L90 HydrophobicContact CZ-CG 4.2Å; F63-A91 HydrophobicContact CE1-CB 4.46Å; F63-H94 HydrophobicContact CB-CB 3.93Å; F63-V96 HydrophobicContact CD1-CG2 4.16Å
64	I	82.4	Confident	87.9	Confident	100 Å²	100	44.9 Å²	44.9	51%	0.513	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	128.7	-179.6	-63.7	170.9	0	0	0	110.4	P61 V66	P61-I64 HydrophobicContact CB-CD1 3.86Å; P61-I64 WeakPolarHBondContact O-CG1 3.26Å; P61-I64 PolarHBondContact O-N 2.65Å; I64-V66 PolarHBondContact O-N 3.11Å
65	N	82.3	Confident	88.2	Confident	141 Å²	141	39.9 Å²	39.9	75%	0.754	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	21.8	179.8	-57.2	-37.1	0	0	0	114.9	F63 H67	F63-N65 PolarHBondContact O-N 2.86Å; N65-H67 PolarHBondContact O-ND1 2.89Å
66	V	92.6	Very high	88.5	Confident	11 Å²	11	41.1 Å²	41.1	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	130.9	175.5	174.5	0	0	0	0	109	V7 F63 I64 G68 V96	V7-V66 HydrophobicContact CB-CG1 4.14Å; V7-V66 HydrophobicContact CG2-CB 4.42Å; V7-V66 HydrophobicContact CG2-CG1 3.81Å; V7-V66 HydrophobicContact CG2-CG2 3.68Å; F63-V66 PolarHBondContact O-N 3.33Å; I64-V66 PolarHBondContact O-N 3.11Å; V66-G68 WeakPolarHBondContact CG1-O 3.4Å; V66-V96 HydrophobicContact CG1-CG1 4.33Å
67	H	94.7	Very high	88.9	Confident	50 Å²	50	44.5 Å²	44.5	23%	0.231	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-21.6	-179.2	-67.2	59.1	0	0	0	111.8	E5 N65 S97 I98 W163	E5-H67 PolarHBondContact O-N 2.92Å; N65-H67 PolarHBondContact O-ND1 2.89Å; H67-S97 PolarHBondContact O-N 2.94Å; H67-I98 PolarHBondContact O-N 2.83Å; H67-W163 HydrophobicContact CB-CZ3 3.86Å
68	G	96.2	Very high	89.2	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	155	180	0	0	0	0	0	114.9	V6 V7 V66 V96 I98	V6-G68 CarbonylContact C-O 3.54Å; V6-G68 VanDerWaalsContact CA-O 3.25Å; V6-G68 WeakPolarHBondContact CA-O 3.41Å; V7-G68 PolarHBondContact N-O 3.43Å; V66-G68 WeakPolarHBondContact CG1-O 3.4Å; G68-V96 VanDerWaalsContact CA-CG1 3.44Å; G68-I98 CarbonylContact C-O 3.56Å; G68-I98 VanDerWaalsContact CA-O 3.25Å; G68-I98 WeakPolarHBondContact CA-O 3.26Å
69	V	96.5	Very high	89.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.8	170.5	67.7	0	0	0	0	110	V7 I9 F63 I71 A91 V96 I98 R99 V100 F131	V7-V69 HydrophobicContact CB-CG2 4.49Å; V7-V69 HydrophobicContact CG1-CG2 4.35Å; V7-V69 CarbonylContact O-C 3.39Å; V7-V69 WeakPolarHBondContact O-CA 3.33Å; I9-V69 HydrophobicContact CD1-CG2 4.31Å; F63-V69 HydrophobicContact CE1-CB 4.38Å; F63-V69 HydrophobicContact CE1-CG2 3.93Å; F63-V69 HydrophobicContact CZ-CG2 4.48Å; V69-I71 HydrophobicContact CG2-CD1 4.3Å; V69-I71 HydrophobicContact CG2-CG1 3.81Å; V69-A91 HydrophobicContact CG1-CB 3.76Å; V69-V96 HydrophobicContact CB-CG1 4.38Å; V69-V96 HydrophobicContact CG1-CG1 4.32Å; V69-I98 PolarHBondContact N-O 2.78Å; V69-R99 HydrophobicContact CG1-CG 4.35Å; V69-V100 PolarHBondContact O-N 2.97Å; V69-F131 HydrophobicContact CG1-CE1 3.93Å; V69-F131 HydrophobicContact CG1-CZ 3.76Å
70	I	97	Very high	90.9	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	115.1	171.7	-57.7	173.8	0	0	0	106.8	V6 V7 Y8 I9 V100 V102 I154	V6-I70 HydrophobicContact CG1-CD1 3.99Å; V6-I70 HydrophobicContact CG1-CG1 3.99Å; V7-I70 PolarHBondContact O-N 3.36Å; Y8-I70 WeakPolarHBondContact CA-O 3.22Å; Y8-I70 HydrophobicContact CD2-CB 4.11Å; Y8-I70 HydrophobicContact CD2-CG2 3.92Å; Y8-I70 HydrophobicContact CE2-CG2 4.27Å; I9-I70 PolarHBondContact N-O 3.1Å; I70-V100 WeakPolarHBondContact CA-O 3.36Å; I70-V100 HydrophobicContact CG1-CB 4.33Å; I70-V102 HydrophobicContact CG2-CG2 3.72Å; I70-I154 HydrophobicContact CD1-CG2 4.18Å
71	I	97	Very high	92.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	115.3	-179.2	-57.9	169.5	0	0	0	108.2	I9 V69 A84 L87 M88 V100 L101 V102 F131	I9-I71 WeakPolarHBondContact O-CA 3.5Å; V69-I71 HydrophobicContact CG2-CD1 4.3Å; V69-I71 HydrophobicContact CG2-CG1 3.81Å; I71-A84 HydrophobicContact CG2-CB 3.95Å; I71-L87 HydrophobicContact CD1-CB 3.56Å; I71-L87 HydrophobicContact CG1-CB 4.3Å; I71-L87 HydrophobicContact CG2-CD1 4Å; I71-M88 HydrophobicContact CD1-CG 4.05Å; I71-V100 PolarHBondContact N-O 3.42Å; I71-L101 HydrophobicContact CB-CD1 3.99Å; I71-L101 HydrophobicContact CG2-CD1 3.97Å; I71-L101 CarbonylContact O-C 3.54Å; I71-V102 PolarHBondContact O-N 2.64Å; I71-F131 HydrophobicContact CD1-CE1 3.66Å; I71-F131 HydrophobicContact CD1-CZ 3.78Å; I71-F131 HydrophobicContact CG1-CE1 4.35Å
72	C	96.6	Very high	93.2	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.02	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.1	170.6	-73.1	0	0	0	0	110.8	Y8 I9 A11 S12 C16 L21 V102	Y8-C72 HydrophobicContact CE2-CB 4.4Å; Y8-C72 WeakPolarHBondContact CE2-SG 3.35Å; Y8-C72 PolarHBondContact OH-SG 2.8Å; I9-C72 PolarHBondContact O-N 2.99Å; A11-C72 CarbonylContact C-O 3.59Å; A11-C72 WeakPolarHBondContact CA-O 3.48Å; A11-C72 VanDerWaalsContact CB-O 3.31Å; A11-C72 WeakPolarHBondContact CB-O 3.08Å; A11-C72 PolarHBondContact N-O 2.9Å; S12-C72 PolarHBondContact N-O 2.97Å; C16-C72 HydrophobicContact CB-CB 3.92Å; L21-C72 VanDerWaalsContact CD1-SG 3.51Å; C72-V102 CarbonylContact C-O 3.54Å; C72-V102 VanDerWaalsContact CA-O 3.27Å; C72-V102 WeakPolarHBondContact CA-O 3.39Å
73	F	96.5	Very high	93.9	Very high	5 Å²	5	32.8 Å²	32.8	2%	0.022	18%	0.177	C	C	.	.			trans	-141.8	162.1	175.7	81.4	-71.6	0	0	0	111	S80 W81 A84 L101 V102 C103 L111 M122 L133	F73-S80 WeakPolarHBondContact CA-OG 3.28Å; F73-S80 WeakPolarHBondContact CB-OG 3.49Å; F73-W81 HydrophobicContact CD2-CE3 4.07Å; F73-W81 AromaticContact CE2-CE3 3.67Å; F73-W81 HydrophobicContact CE2-CE3 3.67Å; F73-W81 HydrophobicContact CE2-CZ3 4.21Å; F73-W81 HydrophobicContact CZ-CE3 4.22Å; F73-W81 HydrophobicContact CZ-CZ3 4.3Å; F73-A84 HydrophobicContact CB-CB 3.95Å; F73-A84 HydrophobicContact CG-CB 4.36Å; F73-L101 HydrophobicContact CD1-CD1 3.47Å; F73-L101 VanDerWaalsContact CD1-CD1 3.47Å; F73-L101 HydrophobicContact CD1-CD2 4.07Å; F73-L101 HydrophobicContact CD1-CG 3.59Å; F73-L101 HydrophobicContact CE1-CD1 3.88Å; F73-L101 HydrophobicContact CE1-CD2 3.6Å; F73-L101 HydrophobicContact CE1-CG 3.43Å; F73-L101 VanDerWaalsContact CE1-CG 3.43Å; F73-L101 HydrophobicContact CG-CD1 4.24Å; F73-L101 HydrophobicContact CZ-CD2 4.07Å; F73-L101 HydrophobicContact CZ-CG 4.38Å; F73-V102 VanDerWaalsContact CD1-O 3.26Å; F73-V102 WeakPolarHBondContact CD1-O 3.25Å; F73-V102 PolarHBondContact N-O 3.24Å; F73-C103 HydrophobicContact CD1-CB 3.85Å; F73-C103 HydrophobicContact CE1-CB 3.44Å; F73-C103 VanDerWaalsContact CE1-CB 3.44Å; F73-C103 HydrophobicContact CE2-CB 4.38Å; F73-C103 HydrophobicContact CG-CB 4.45Å; F73-C103 HydrophobicContact CZ-CB 3.74Å; F73-C103 WeakPolarHBondContact O-CA 3.35Å; F73-C103 VanDerWaalsContact O-CB 3.27Å; F73-C103 WeakPolarHBondContact O-CB 3.49Å; F73-L111 HydrophobicContact CE2-CD1 4.16Å; F73-M122 HydrophobicContact CE2-CE 4.35Å; F73-M122 HydrophobicContact CZ-CE 3.9Å; F73-L133 HydrophobicContact CE1-CD1 3.82Å; F73-L133 HydrophobicContact CZ-CD1 4.11Å
74	S	95.6	Very high	94.5	Very high	9 Å²	9	32.7 Å²	32.7	6%	0.063	18%	0.177	C	C	.	.			trans	-87.7	111.1	173.7	-65.6	0	0	0	0	109.3	S12 E13 D76 K77 S80	S12-S74 WeakPolarHBondContact CB-OG 3.38Å; E13-S74 PolarHBondContact N-OG 2.77Å; S74-D76 PolarHBondContact O-N 2.73Å; S74-K77 PolarHBondContact O-N 3.12Å; S74-K77 VanDerWaalsContact O-N 3.08Å; S74-S80 PolarHBondContact N-OG 3Å
75	G	94.7	Very high	95.2	Very high	3 Å²	3	30.2 Å²	30.2	3%	0.031	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-5.7	-177.2	0	0	0	0	0	115.4	T105 S107	G75-T105 WeakPolarHBondContact CA-O 3.35Å; G75-S107 PolarHBondContact O-N 2.89Å
76	D	94.6	Very high	95.9	Very high	66 Å²	66	29 Å²	29	35%	0.353	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	9.1	179.9	68.3	-33.7	0	0	0	113.1	S74 I110	S74-D76 PolarHBondContact O-N 2.73Å; D76-I110 HydrophobicContact CB-CD1 4.25Å; D76-I110 WeakPolarHBondContact O-CG2 3.22Å
77	K	96.1	Very high	96	Very high	72 Å²	72	28.5 Å²	28.5	31%	0.313	15%	0.149	S	C	.	.			trans	-126.2	116	-178.3	-55.3	-64.4	178.3	-173.7	0	112.5	E13 S74 S79 S80 W81	E13-K77 HydrophobicContact CG-CB 4.43Å; E13-K77 HydrophobicContact CG-CG 4.21Å; E13-K77 WeakPolarHBondContact OE2-CD 3.35Å; S74-K77 PolarHBondContact O-N 3.12Å; S74-K77 VanDerWaalsContact O-N 3.08Å; K77-S79 VanDerWaalsContact C-N 3.32Å; K77-S79 PolarHBondContact O-N 2.86Å; K77-S80 PolarHBondContact O-N 2.79Å; K77-W81 PolarHBondContact O-N 3.44Å
78	V	95.8	Very high	96.1	Very high	62 Å²	62	26.1 Å²	26.1	38%	0.376	14%	0.138	S	C	.	.	H	α-helix	trans	-60.2	-38.6	177.8	179.2	0	0	0	0	112.5	W81 N82 I110	V78-W81 PolarHBondContact O-N 3.24Å; V78-N82 WeakPolarHBondContact O-CB 3.41Å; V78-N82 VanDerWaalsContact O-CG 3.22Å; V78-N82 PolarHBondContact O-N 2.84Å; V78-N82 PolarHBondContact O-ND2 2.75Å; V78-N82 VanDerWaalsContact O-ND2 3.11Å; V78-I110 WeakPolarHBondContact CG2-O 3.28Å
79	S	95.2	Very high	96	Very high	54 Å²	54	29 Å²	29	38%	0.378	16%	0.158	S	C	.	.	H	α-helix	trans	-58.3	-50.1	174.4	36.5	0	0	0	0	112.1	E13 K77 N82 D83	E13-S79 WeakPolarHBondContact OE1-CB 3.47Å; E13-S79 PolarHBondContact OE1-OG 3.13Å; K77-S79 VanDerWaalsContact C-N 3.32Å; K77-S79 PolarHBondContact O-N 2.86Å; S79-N82 PolarHBondContact O-N 2.8Å; S79-D83 PolarHBondContact O-N 3.21Å; S79-D83 VanDerWaalsContact O-N 3.1Å
80	S	96.2	Very high	95.9	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-63.5	-43.2	178.2	-173.3	0	0	0	0	111.6	A11 F73 S74 K77 N82 D83 A84	A11-S80 WeakPolarHBondContact O-CB 3.16Å; A11-S80 PolarHBondContact O-OG 3.32Å; F73-S80 WeakPolarHBondContact CA-OG 3.28Å; F73-S80 WeakPolarHBondContact CB-OG 3.49Å; S74-S80 PolarHBondContact N-OG 3Å; K77-S80 PolarHBondContact O-N 2.79Å; S80-N82 PolarHBondContact O-N 3.29Å; S80-D83 PolarHBondContact O-N 3.35Å; S80-A84 PolarHBondContact O-N 3.33Å
81	W	96.9	Very high	95.7	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.019	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-45.2	173.2	173.5	-104.2	0	0	0	112.8	F73 K77 V78 D83 A84 L85 L101 L111 F112 M122 I125 I126	F73-W81 HydrophobicContact CD2-CE3 4.07Å; F73-W81 AromaticContact CE2-CE3 3.67Å; F73-W81 HydrophobicContact CE2-CE3 3.67Å; F73-W81 HydrophobicContact CE2-CZ3 4.21Å; F73-W81 HydrophobicContact CZ-CE3 4.22Å; F73-W81 HydrophobicContact CZ-CZ3 4.3Å; K77-W81 PolarHBondContact O-N 3.44Å; V78-W81 PolarHBondContact O-N 3.24Å; W81-D83 VanDerWaalsContact C-N 3.31Å; W81-D83 PolarHBondContact O-N 3.41Å; W81-A84 PolarHBondContact O-N 3.24Å; W81-L85 WeakPolarHBondContact O-CB 3.33Å; W81-L85 PolarHBondContact O-N 3.27Å; W81-L101 HydrophobicContact CZ3-CD2 3.81Å; W81-L111 HydrophobicContact CB-CD1 4.37Å; W81-L111 HydrophobicContact CB-CD2 3.93Å; W81-L111 HydrophobicContact CD2-CD1 4.15Å; W81-L111 HydrophobicContact CE3-CD1 4.07Å; W81-L111 HydrophobicContact CG-CD1 4.29Å; W81-L111 HydrophobicContact CG-CD2 4.49Å; W81-F112 AromaticContact CE2-CZ 3.63Å; W81-F112 HydrophobicContact CZ2-CE2 4.22Å; W81-F112 AromaticContact CZ2-CZ 3.7Å; W81-F112 HydrophobicContact CZ2-CZ 3.7Å; W81-F112 AromaticContact NE1-CZ 3.41Å; W81-M122 HydrophobicContact CE3-CE 4.15Å; W81-M122 HydrophobicContact CH2-CE 4.01Å; W81-M122 HydrophobicContact CH2-CG 4.02Å; W81-M122 HydrophobicContact CZ3-CE 3.52Å; W81-M122 HydrophobicContact CZ3-CG 4.45Å; W81-I125 HydrophobicContact CH2-CG2 4.38Å; W81-I125 HydrophobicContact CZ2-CB 4.42Å; W81-I125 HydrophobicContact CZ2-CD1 4.39Å; W81-I125 HydrophobicContact CZ2-CG2 3.94Å; W81-I126 HydrophobicContact CH2-CD1 4.29Å; W81-I126 HydrophobicContact CH2-CG1 3.98Å
82	N	96.1	Very high	95.5	Very high	74 Å²	74	33.6 Å²	33.6	40%	0.396	18%	0.182	S	C	.	.	H	α-helix	trans	-64.3	-34.8	178.3	-74.5	-33.9	0	0	0	112.9	V78 S79 S80 K86	V78-N82 WeakPolarHBondContact O-CB 3.41Å; V78-N82 VanDerWaalsContact O-CG 3.22Å; V78-N82 PolarHBondContact O-N 2.84Å; V78-N82 PolarHBondContact O-ND2 2.75Å; V78-N82 VanDerWaalsContact O-ND2 3.11Å; S79-N82 PolarHBondContact O-N 2.8Å; S80-N82 PolarHBondContact O-N 3.29Å; N82-K86 WeakPolarHBondContact O-CG 3.26Å; N82-K86 PolarHBondContact O-N 3.37Å
83	D	95.7	Very high	95.3	Very high	28 Å²	28	37.4 Å²	37.4	15%	0.15	21%	0.208	C	C	.	.	H	α-helix	trans	-70.1	-43.1	173.7	-75.5	-15.9	0	0	0	111.1	A11 K53 S79 S80 W81 L85 K86 L87	A11-D83 HydrophobicContact CB-CB 4.3Å; K53-D83 HydrophobicContact CD-CB 4.1Å; K53-D83 WeakPolarHBondContact CD-OD2 3.18Å; K53-D83 WeakPolarHBondContact CE-OD2 2.92Å; K53-D83 IonicContact NZ-OD2 3.69Å; K53-D83 PolarHBondContact NZ-OD2 3.01Å; S79-D83 PolarHBondContact O-N 3.21Å; S79-D83 VanDerWaalsContact O-N 3.1Å; S80-D83 PolarHBondContact O-N 3.35Å; W81-D83 VanDerWaalsContact C-N 3.31Å; W81-D83 PolarHBondContact O-N 3.41Å; D83-L85 VanDerWaalsContact C-N 3.32Å; D83-L85 PolarHBondContact O-N 3.45Å; D83-K86 PolarHBondContact O-N 2.92Å; D83-K86 IonicContact OD1-NZ 2.64Å; D83-K86 PolarHBondContact OD1-NZ 3.42Å; D83-L87 WeakPolarHBondContact O-CG 3.47Å; D83-L87 PolarHBondContact O-N 3.06Å; D83-L87 VanDerWaalsContact O-N 3.15Å
84	A	96.7	Very high	95.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-42.4	174.1	0	0	0	0	0	111.8	I71 F73 S80 W81 K86 L87 M88 L101	I71-A84 HydrophobicContact CG2-CB 3.95Å; F73-A84 HydrophobicContact CB-CB 3.95Å; F73-A84 HydrophobicContact CG-CB 4.36Å; S80-A84 PolarHBondContact O-N 3.33Å; W81-A84 PolarHBondContact O-N 3.24Å; A84-K86 VanDerWaalsContact C-N 3.34Å; A84-K86 PolarHBondContact O-N 3.04Å; A84-L87 CarbonylContact O-C 3.51Å; A84-L87 WeakPolarHBondContact O-CB 3.33Å; A84-L87 PolarHBondContact O-N 2.98Å; A84-L87 VanDerWaalsContact O-N 3.09Å; A84-M88 VanDerWaalsContact O-CG 3.25Å; A84-M88 WeakPolarHBondContact O-CG 3.45Å; A84-M88 PolarHBondContact O-N 2.94Å; A84-L101 HydrophobicContact CB-CD1 4.01Å
85	L	96.7	Very high	94.9	Very high	48 Å²	48	45.8 Å²	45.8	25%	0.251	25%	0.251	S	S	.	.	H	α-helix	trans	-59.2	-42.7	178.3	-171.8	65.9	0	0	0	112.2	W81 D83 L87 M88 S89 I125	W81-L85 WeakPolarHBondContact O-CB 3.33Å; W81-L85 PolarHBondContact O-N 3.27Å; D83-L85 VanDerWaalsContact C-N 3.32Å; D83-L85 PolarHBondContact O-N 3.45Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L87 PolarHBondContact O-N 3.24Å; L85-M88 PolarHBondContact O-N 2.85Å; L85-S89 PolarHBondContact O-N 3.37Å; L85-S89 PolarHBondContact O-OG 2.91Å; L85-I125 HydrophobicContact CD1-CG2 3.57Å
86	K	95.6	Very high	94.8	Very high	116 Å²	116	45.7 Å²	45.7	50%	0.504	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-40.5	175.3	-66.6	166.8	-166.2	159.7	0	111.7	L57 N82 D83 A84 S89 L90	L57-K86 HydrophobicContact CD2-CB 3.56Å; L57-K86 HydrophobicContact CD2-CD 4.01Å; L57-K86 HydrophobicContact CD2-CG 4.47Å; N82-K86 WeakPolarHBondContact O-CG 3.26Å; N82-K86 PolarHBondContact O-N 3.37Å; D83-K86 PolarHBondContact O-N 2.92Å; D83-K86 IonicContact OD1-NZ 2.64Å; D83-K86 PolarHBondContact OD1-NZ 3.42Å; A84-K86 VanDerWaalsContact C-N 3.34Å; A84-K86 PolarHBondContact O-N 3.04Å; K86-S89 PolarHBondContact O-N 3.2Å; K86-L90 PolarHBondContact O-N 3.43Å
87	L	95.6	Very high	94.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-36.8	177.2	-67.1	172.2	0	0	0	111.8	I9 A11 A56 L57 I71 D83 A84 L85 L90 A91	I9-L87 HydrophobicContact CB-CD1 4.22Å; I9-L87 HydrophobicContact CD1-CD1 4.23Å; I9-L87 HydrophobicContact CD1-CD2 3.86Å; I9-L87 HydrophobicContact CG2-CD1 3.6Å; A11-L87 HydrophobicContact CB-CD1 4.2Å; A56-L87 HydrophobicContact CB-CD2 3.8Å; L57-L87 HydrophobicContact CD2-CD2 3.74Å; L57-L87 HydrophobicContact CD2-CG 3.92Å; L57-L87 HydrophobicContact CG-CD2 4.04Å; L57-L87 HydrophobicContact CG-CG 4.47Å; I71-L87 HydrophobicContact CD1-CB 3.56Å; I71-L87 HydrophobicContact CG1-CB 4.3Å; I71-L87 HydrophobicContact CG2-CD1 4Å; D83-L87 WeakPolarHBondContact O-CG 3.47Å; D83-L87 PolarHBondContact O-N 3.06Å; D83-L87 VanDerWaalsContact O-N 3.15Å; A84-L87 CarbonylContact O-C 3.51Å; A84-L87 WeakPolarHBondContact O-CB 3.33Å; A84-L87 PolarHBondContact O-N 2.98Å; A84-L87 VanDerWaalsContact O-N 3.09Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L87 PolarHBondContact O-N 3.24Å; L87-L90 WeakPolarHBondContact O-CB 3.31Å; L87-L90 PolarHBondContact O-N 3.13Å; L87-A91 PolarHBondContact O-N 3.4Å
88	M	96.4	Very high	94.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-47.3	173.4	-68.7	165.7	63.1	0	0	110.9	I71 A84 L85 L90 A91 I92 L101 H129 F131	I71-M88 HydrophobicContact CD1-CG 4.05Å; A84-M88 VanDerWaalsContact O-CG 3.25Å; A84-M88 WeakPolarHBondContact O-CG 3.45Å; A84-M88 PolarHBondContact O-N 2.94Å; L85-M88 PolarHBondContact O-N 2.85Å; M88-L90 VanDerWaalsContact C-N 3.27Å; M88-L90 PolarHBondContact O-N 3.01Å; M88-A91 WeakPolarHBondContact O-CB 3.43Å; M88-A91 PolarHBondContact O-N 3.33Å; M88-I92 WeakPolarHBondContact O-CG1 3.43Å; M88-I92 PolarHBondContact O-N 3.39Å; M88-I92 VanDerWaalsContact O-N 3.16Å; M88-L101 HydrophobicContact SD-CD1 4.42Å; M88-L101 HydrophobicContact SD-CD2 4.22Å; M88-H129 HydrophobicContact CB-CB 4.33Å; M88-H129 HydrophobicContact CE-CB 3.49Å; M88-H129 VanDerWaalsContact CE-CB 3.49Å; M88-F131 HydrophobicContact CB-CD2 4.04Å; M88-F131 HydrophobicContact CB-CE2 3.62Å; M88-F131 HydrophobicContact CB-CZ 4.02Å; M88-F131 HydrophobicContact CE-CB 4.1Å; M88-F131 HydrophobicContact CE-CD2 3.92Å; M88-F131 HydrophobicContact CE-CG 4.02Å; M88-F131 HydrophobicContact CG-CD1 4.15Å; M88-F131 HydrophobicContact CG-CD2 3.83Å; M88-F131 HydrophobicContact CG-CE1 3.98Å; M88-F131 HydrophobicContact CG-CE2 3.64Å; M88-F131 HydrophobicContact CG-CG 4.08Å; M88-F131 HydrophobicContact CG-CZ 3.72Å
89	S	94.4	Very high	94.9	Very high	60 Å²	60	41.5 Å²	41.5	42%	0.42	23%	0.233	S	C	.	.	H	α-helix	trans	-60.3	-37.8	175.1	-54.8	0	0	0	0	112.2	L85 K86 I92 S93 H129	L85-S89 PolarHBondContact O-N 3.37Å; L85-S89 PolarHBondContact O-OG 2.91Å; K86-S89 PolarHBondContact O-N 3.2Å; S89-I92 PolarHBondContact O-N 3.33Å; S89-S93 PolarHBondContact O-N 2.87Å; S89-S93 VanDerWaalsContact O-N 3.12Å; S89-H129 PolarHBondContact OG-NE2 3.32Å
90	L	93.3	Very high	95	Very high	32 Å²	32	39 Å²	39	17%	0.168	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-41	176.3	-174.8	62.8	0	0	0	112	A56 F63 K86 L87 M88 S93 H94	A56-L90 VanDerWaalsContact O-CD2 3.23Å; A56-L90 WeakPolarHBondContact O-CD2 3.44Å; F63-L90 HydrophobicContact CD2-CD2 3.58Å; F63-L90 HydrophobicContact CD2-CG 3.9Å; F63-L90 HydrophobicContact CE2-CD2 3.18Å; F63-L90 HydrophobicContact CE2-CG 3.84Å; F63-L90 HydrophobicContact CG-CD2 4.49Å; F63-L90 HydrophobicContact CG-CG 4.36Å; F63-L90 HydrophobicContact CZ-CD2 3.8Å; F63-L90 HydrophobicContact CZ-CG 4.2Å; K86-L90 PolarHBondContact O-N 3.43Å; L87-L90 WeakPolarHBondContact O-CB 3.31Å; L87-L90 PolarHBondContact O-N 3.13Å; M88-L90 VanDerWaalsContact C-N 3.27Å; M88-L90 PolarHBondContact O-N 3.01Å; L90-S93 PolarHBondContact O-N 3.44Å; L90-S93 PolarHBondContact O-OG 2.83Å; L90-H94 VanDerWaalsContact CD1-CE1 3.5Å; L90-H94 WeakPolarHBondContact CD1-CE1 3.26Å; L90-H94 PolarHBondContact O-N 3.43Å; L90-H94 PolarHBondContact O-ND1 3.4Å
91	A	94	Very high	95.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-41.6	177.4	0	0	0	0	0	112.6	F63 V69 L87 M88 H94 D95 V96 F131	F63-A91 HydrophobicContact CE1-CB 4.46Å; V69-A91 HydrophobicContact CG1-CB 3.76Å; L87-A91 PolarHBondContact O-N 3.4Å; M88-A91 WeakPolarHBondContact O-CB 3.43Å; M88-A91 PolarHBondContact O-N 3.33Å; A91-H94 PolarHBondContact O-N 3.11Å; A91-D95 PolarHBondContact O-N 2.93Å; A91-V96 PolarHBondContact O-N 3.01Å; A91-F131 HydrophobicContact CB-CE2 4.11Å; A91-F131 HydrophobicContact CB-CZ 3.81Å
92	I	93.1	Very high	95	Very high	68 Å²	68	38.8 Å²	38.8	35%	0.349	22%	0.215	S	C	.	.	H	α-helix	trans	-62.5	-44.8	174.9	-64.5	168	0	0	0	110.7	M88 S89 H94 D95 H129	M88-I92 WeakPolarHBondContact O-CG1 3.43Å; M88-I92 PolarHBondContact O-N 3.39Å; M88-I92 VanDerWaalsContact O-N 3.16Å; S89-I92 PolarHBondContact O-N 3.33Å; I92-H94 PolarHBondContact O-N 3.11Å; I92-D95 PolarHBondContact O-N 2.71Å; I92-H129 VanDerWaalsContact CD1-CA 3.5Å; I92-H129 HydrophobicContact CD1-CB 3.67Å; I92-H129 WeakPolarHBondContact CD1-CD2 3.39Å
93	S	91.8	Very high	95	Very high	83 Å²	83	35.4 Å²	35.4	58%	0.58	20%	0.197	S	C	*	.	H	α-helix	trans	-62.2	-16.1	-179.2	71.8	0	0	0	0	114.2	S89 L90	S89-S93 PolarHBondContact O-N 2.87Å; S89-S93 VanDerWaalsContact O-N 3.12Å; L90-S93 PolarHBondContact O-N 3.44Å; L90-S93 PolarHBondContact O-OG 2.83Å
94	H	91.4	Very high	94.9	Very high	61 Å²	61	40 Å²	40	28%	0.282	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	8	177.5	-68.2	81.2	0	0	0	113.5	S60 F63 L90 A91 I92 V96	S60-H94 PolarHBondContact O-NE2 2.67Å; F63-H94 HydrophobicContact CB-CB 3.93Å; L90-H94 VanDerWaalsContact CD1-CE1 3.5Å; L90-H94 WeakPolarHBondContact CD1-CE1 3.26Å; L90-H94 PolarHBondContact O-N 3.43Å; L90-H94 PolarHBondContact O-ND1 3.4Å; A91-H94 PolarHBondContact O-N 3.11Å; I92-H94 PolarHBondContact O-N 3.11Å; H94-V96 HydrophobicContact CB-CG2 4.1Å; H94-V96 PolarHBondContact O-N 3.03Å
95	D	91.6	Very high	94.7	Very high	128 Å²	128	41.8 Å²	41.8	68%	0.684	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	39.1	179.3	-164.4	31	0	0	0	113.6	A91 I92 S97 R99	A91-D95 PolarHBondContact O-N 2.93Å; I92-D95 PolarHBondContact O-N 2.71Å; D95-S97 PolarHBondContact O-N 2.84Å; D95-R99 IonicContact OD1-NH2 2.71Å
96	V	93.1	Very high	94.6	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.221	C	C	.	.			trans	-67.5	129.3	179.6	-179.2	0	0	0	0	109.2	F63 V66 G68 V69 A91 H94 I98 R99	F63-V96 HydrophobicContact CD1-CG2 4.16Å; V66-V96 HydrophobicContact CG1-CG1 4.33Å; G68-V96 VanDerWaalsContact CA-CG1 3.44Å; V69-V96 HydrophobicContact CB-CG1 4.38Å; V69-V96 HydrophobicContact CG1-CG1 4.32Å; A91-V96 PolarHBondContact O-N 3.01Å; H94-V96 HydrophobicContact CB-CG2 4.1Å; H94-V96 PolarHBondContact O-N 3.03Å; V96-I98 WeakPolarHBondContact CG1-O 3.38Å; V96-R99 PolarHBondContact O-NE 2.71Å; V96-R99 PolarHBondContact O-NH2 2.82Å
97	S	93.8	Very high	94.5	Very high	82 Å²	82	36.8 Å²	36.8	57%	0.573	21%	0.211	S	C	*	.	S	Bend	trans	-75.8	-44.4	-172.1	-50.9	0	0	0	0	114.3	H67 D95	H67-S97 PolarHBondContact O-N 2.94Å; D95-S97 PolarHBondContact O-N 2.84Å
98	I	97	Very high	94.5	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.046	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.1	176.7	-57.1	173.7	0	0	0	109.1	H67 G68 V69 V96 V100 I157 L158 H161 W163	H67-I98 PolarHBondContact O-N 2.83Å; G68-I98 CarbonylContact C-O 3.56Å; G68-I98 VanDerWaalsContact CA-O 3.25Å; G68-I98 WeakPolarHBondContact CA-O 3.26Å; V69-I98 PolarHBondContact N-O 2.78Å; V96-I98 WeakPolarHBondContact CG1-O 3.38Å; I98-V100 HydrophobicContact CG2-CG2 3.75Å; I98-I157 HydrophobicContact CG2-CG2 3.7Å; I98-L158 HydrophobicContact CD1-CD2 4.07Å; I98-H161 HydrophobicContact CD1-CB 3.54Å; I98-H161 VanDerWaalsContact CD1-CG 3.48Å; I98-H161 HydrophobicContact CG1-CB 4.03Å; I98-W163 HydrophobicContact CD1-CH2 3.69Å; I98-W163 HydrophobicContact CD1-CZ2 3.75Å
99	R	97.4	Very high	94.5	Very high	21 Å²	21	42 Å²	42	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	96.7	-177.8	-66	178.9	-162.3	144	17	110	V69 D95 V96 E130 F131 E132	V69-R99 HydrophobicContact CG1-CG 4.35Å; D95-R99 IonicContact OD1-NH2 2.71Å; V96-R99 PolarHBondContact O-NE 2.71Å; V96-R99 PolarHBondContact O-NH2 2.82Å; R99-E130 WeakPolarHBondContact CB-O 2.92Å; R99-E130 IonicContact CZ-OE2 2.99Å; R99-E130 IonicContact NH1-OE2 3.51Å; R99-E130 PolarHBondContact NH1-OE2 2.8Å; R99-E130 IonicContact NH2-OE2 3.24Å; R99-F131 VanDerWaalsContact C-CD1 3.43Å; R99-F131 HydrophobicContact CB-CD1 3.76Å; R99-F131 HydrophobicContact CB-CD2 3.72Å; R99-F131 HydrophobicContact CB-CE1 3.74Å; R99-F131 HydrophobicContact CB-CE2 3.72Å; R99-F131 HydrophobicContact CB-CG 3.75Å; R99-F131 HydrophobicContact CB-CZ 3.73Å; R99-F131 HydrophobicContact CG-CD2 4.31Å; R99-F131 HydrophobicContact CG-CE1 4.5Å; R99-F131 HydrophobicContact CG-CE2 3.92Å; R99-F131 HydrophobicContact CG-CZ 4.03Å; R99-F131 WeakPolarHBondContact O-CA 3.25Å; R99-E132 PolarHBondContact O-N 2.88Å
100	V	97.8	Very high	94.6	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.8	-176.8	-169.3	0	0	0	0	110	V69 I70 I71 I98 V102 V134 I157	V69-V100 PolarHBondContact O-N 2.97Å; I70-V100 WeakPolarHBondContact CA-O 3.36Å; I70-V100 HydrophobicContact CG1-CB 4.33Å; I71-V100 PolarHBondContact N-O 3.42Å; I98-V100 HydrophobicContact CG2-CG2 3.75Å; V100-V102 HydrophobicContact CG1-CG2 3.76Å; V100-V134 HydrophobicContact CG1-CB 4.39Å; V100-V134 HydrophobicContact CG1-CG2 3.78Å; V100-I157 HydrophobicContact CG1-CD1 4.04Å; V100-I157 HydrophobicContact CG2-CB 4.49Å; V100-I157 HydrophobicContact CG2-CD1 3.81Å; V100-I157 HydrophobicContact CG2-CG2 3.78Å
101	L	97.7	Very high	94.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.3	171.8	-173.8	68	0	0	0	108.1	I71 F73 W81 A84 M88 I126 F131 E132 L133 V134	I71-L101 HydrophobicContact CB-CD1 3.99Å; I71-L101 HydrophobicContact CG2-CD1 3.97Å; I71-L101 CarbonylContact O-C 3.54Å; F73-L101 HydrophobicContact CD1-CD1 3.47Å; F73-L101 VanDerWaalsContact CD1-CD1 3.47Å; F73-L101 HydrophobicContact CD1-CD2 4.07Å; F73-L101 HydrophobicContact CD1-CG 3.59Å; F73-L101 HydrophobicContact CE1-CD1 3.88Å; F73-L101 HydrophobicContact CE1-CD2 3.6Å; F73-L101 HydrophobicContact CE1-CG 3.43Å; F73-L101 VanDerWaalsContact CE1-CG 3.43Å; F73-L101 HydrophobicContact CG-CD1 4.24Å; F73-L101 HydrophobicContact CZ-CD2 4.07Å; F73-L101 HydrophobicContact CZ-CG 4.38Å; W81-L101 HydrophobicContact CZ3-CD2 3.81Å; A84-L101 HydrophobicContact CB-CD1 4.01Å; M88-L101 HydrophobicContact SD-CD1 4.42Å; M88-L101 HydrophobicContact SD-CD2 4.22Å; L101-I126 HydrophobicContact CD2-CD1 4.38Å; L101-I126 HydrophobicContact CD2-CG1 4.32Å; L101-F131 HydrophobicContact CB-CD1 3.97Å; L101-E132 PolarHBondContact N-O 2.74Å; L101-L133 HydrophobicContact CB-CD1 4.39Å; L101-L133 HydrophobicContact CD2-CD1 4.04Å; L101-L133 HydrophobicContact CG-CD1 4.16Å; L101-L133 CarbonylContact O-C 3.51Å; L101-L133 WeakPolarHBondContact O-CA 3.25Å; L101-V134 PolarHBondContact O-N 2.85Å
102	V	96.5	Very high	94.8	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.9	-171.2	-178	0	0	0	0	110.4	L21 I70 I71 C72 F73 V100 V134 I136 I154	L21-V102 HydrophobicContact CD2-CG1 4.46Å; I70-V102 HydrophobicContact CG2-CG2 3.72Å; I71-V102 PolarHBondContact O-N 2.64Å; C72-V102 CarbonylContact C-O 3.54Å; C72-V102 VanDerWaalsContact CA-O 3.27Å; C72-V102 WeakPolarHBondContact CA-O 3.39Å; F73-V102 VanDerWaalsContact CD1-O 3.26Å; F73-V102 WeakPolarHBondContact CD1-O 3.25Å; F73-V102 PolarHBondContact N-O 3.24Å; V100-V102 HydrophobicContact CG1-CG2 3.76Å; V102-V134 WeakPolarHBondContact CA-O 3.37Å; V102-I136 HydrophobicContact CG1-CD1 3.59Å; V102-I136 HydrophobicContact CG1-CG1 3.72Å; V102-I154 HydrophobicContact CG1-CD1 4.21Å; V102-I154 HydrophobicContact CG2-CD1 3.94Å; V102-I154 HydrophobicContact CG2-CG1 4.49Å
103	C	95.4	Very high	94.9	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	167.4	168.6	58.6	0	0	0	0	111.1	F73 V134 E135 I136	F73-C103 HydrophobicContact CD1-CB 3.85Å; F73-C103 HydrophobicContact CE1-CB 3.44Å; F73-C103 VanDerWaalsContact CE1-CB 3.44Å; F73-C103 HydrophobicContact CE2-CB 4.38Å; F73-C103 HydrophobicContact CG-CB 4.45Å; F73-C103 HydrophobicContact CZ-CB 3.74Å; F73-C103 WeakPolarHBondContact O-CA 3.35Å; F73-C103 VanDerWaalsContact O-CB 3.27Å; F73-C103 WeakPolarHBondContact O-CB 3.49Å; C103-V134 PolarHBondContact N-O 3.23Å; C103-V134 VanDerWaalsContact N-O 3.14Å; C103-E135 CarbonylContact O-C 3.49Å; C103-E135 WeakPolarHBondContact O-CA 3.23Å; C103-I136 WeakPolarHBondContact O-CG1 3.36Å; C103-I136 PolarHBondContact O-N 3.04Å
104	H	93.1	Very high	95	Very high	123 Å²	123	46.6 Å²	46.6	57%	0.569	27%	0.274	S	S	*	.	S	Bend	trans	-66.7	-62.4	174.1	-170.8	69.5	0	0	0	111.1	I136 S137	H104-I136 PolarHBondContact O-N 3.49Å; H104-S137 VanDerWaalsContact CE1-CB 3.4Å; H104-S137 WeakPolarHBondContact CE1-CB 3.47Å; H104-S137 PolarHBondContact CE1-OG 2.73Å; H104-S137 CarbonylContact O-C 3.4Å; H104-S137 PolarHBondContact O-N 3.29Å
105	T	93.3	Very high	95.2	Very high	38 Å²	38	48.5 Å²	48.5	23%	0.233	28%	0.283	C	S	.	.	S	Bend	trans	-142.2	142.2	172.2	-45.5	0	0	0	0	107.5	G75 E135 S137	G75-T105 WeakPolarHBondContact CA-O 3.35Å; T105-E135 VanDerWaalsContact CA-OE2 3.25Å; T105-E135 WeakPolarHBondContact CA-OE2 3.48Å; T105-S137 PolarHBondContact OG1-O 3.16Å
106	V	93.8	Very high	95.3	Very high	18 Å²	18	48.8 Å²	48.8	11%	0.109	30%	0.295	C	S	.	.			trans	-90.3	140.6	179.9	74.1	0	0	0	0	111.6	P108 M122 L133 E135	V106-P108 HydrophobicContact CG1-CG 4.42Å; V106-P108 HydrophobicContact CG2-CG 4.19Å; V106-M122 HydrophobicContact CG2-CE 3.22Å; V106-M122 HydrophobicContact CG2-SD 3.39Å; V106-M122 WeakPolarHBondContact CG2-SD 3.31Å; V106-L133 HydrophobicContact CB-CD2 4.49Å; V106-L133 HydrophobicContact CG1-CD2 4.49Å; V106-L133 HydrophobicContact CG2-CD2 4.46Å; V106-E135 HydrophobicContact CB-CG 4.48Å; V106-E135 HydrophobicContact CG1-CG 4.45Å; V106-E135 WeakPolarHBondContact CG1-OE1 3.5Å; V106-E135 PolarHBondContact N-OE2 3.35Å
107	S	94.7	Very high	95.4	Very high	41 Å²	41	52.4 Å²	52.4	29%	0.287	31%	0.314	S	S	.	.			trans	-129.5	77.5	174.8	-68.9	0	0	0	0	110.8	G75 S109 I110 L111	G75-S107 PolarHBondContact O-N 2.89Å; S107-S109 VanDerWaalsContact C-N 3.27Å; S107-S109 PolarHBondContact O-N 3.06Å; S107-I110 WeakPolarHBondContact O-CB 3.17Å; S107-I110 PolarHBondContact O-N 2.93Å; S107-L111 PolarHBondContact O-N 2.83Å
108	P	95.7	Very high	95.5	Very high	17 Å²	17	48.8 Å²	48.8	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-56	-38.8	-173.1	-25.5	34.5	0	0	0	113.2	V106 I110 L111 F112 A118 F119 M122	V106-P108 HydrophobicContact CG1-CG 4.42Å; V106-P108 HydrophobicContact CG2-CG 4.19Å; P108-I110 PolarHBondContact O-N 2.84Å; P108-L111 PolarHBondContact O-N 2.82Å; P108-F112 PolarHBondContact O-N 2.81Å; P108-A118 HydrophobicContact CB-CB 3.93Å; P108-A118 WeakPolarHBondContact O-CB 3.26Å; P108-F119 HydrophobicContact CG-CD2 4.11Å; P108-M122 HydrophobicContact CB-CB 4.49Å; P108-M122 HydrophobicContact CB-SD 4.17Å; P108-M122 HydrophobicContact CG-SD 3.94Å
109	S	95.8	Very high	95.4	Very high	92 Å²	92	54.6 Å²	54.6	64%	0.643	31%	0.314	S	S	*	.	H	α-helix	trans	-61.6	-25.7	177.9	-50.6	0	0	0	0	113.8	S107 P113	S107-S109 VanDerWaalsContact C-N 3.27Å; S107-S109 PolarHBondContact O-N 3.06Å; S109-P113 WeakPolarHBondContact O-CA 3.42Å
110	I	95.6	Very high	95.3	Very high	89 Å²	89	56 Å²	56	46%	0.456	33%	0.327	S	S	.	.	H	α-helix	trans	-80.9	-38.5	174.3	-59.9	179	0	0	0	110.3	D76 V78 S107 P108	D76-I110 HydrophobicContact CB-CD1 4.25Å; D76-I110 WeakPolarHBondContact O-CG2 3.22Å; V78-I110 WeakPolarHBondContact CG2-O 3.28Å; S107-I110 WeakPolarHBondContact O-CB 3.17Å; S107-I110 PolarHBondContact O-N 2.93Å; P108-I110 PolarHBondContact O-N 2.84Å
111	L	95.8	Very high	95.3	Very high	7 Å²	7	56.8 Å²	56.8	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-71.4	-33.9	179.9	-59.1	-176.5	0	0	0	112.3	F73 W81 S107 P108 P113 M122	F73-L111 HydrophobicContact CE2-CD1 4.16Å; W81-L111 HydrophobicContact CB-CD1 4.37Å; W81-L111 HydrophobicContact CB-CD2 3.93Å; W81-L111 HydrophobicContact CD2-CD1 4.15Å; W81-L111 HydrophobicContact CE3-CD1 4.07Å; W81-L111 HydrophobicContact CG-CD1 4.29Å; W81-L111 HydrophobicContact CG-CD2 4.49Å; S107-L111 PolarHBondContact O-N 2.83Å; P108-L111 PolarHBondContact O-N 2.82Å; L111-P113 VanDerWaalsContact C-CD 3.5Å; L111-P113 WeakPolarHBondContact O-CD 3.22Å; L111-M122 HydrophobicContact CD1-CE 4.05Å; L111-M122 HydrophobicContact CD1-SD 3.95Å
112	F	96.7	Very high	95.2	Very high	29 Å²	29	57 Å²	57	13%	0.127	33%	0.333	C	S	.	.			trans	-128.1	66	-177.6	-56.2	-83.9	0	0	0	111.2	W81 P108 S114 E115 A118 V121 M122 I125	W81-F112 AromaticContact CE2-CZ 3.63Å; W81-F112 HydrophobicContact CZ2-CE2 4.22Å; W81-F112 AromaticContact CZ2-CZ 3.7Å; W81-F112 HydrophobicContact CZ2-CZ 3.7Å; W81-F112 AromaticContact NE1-CZ 3.41Å; P108-F112 PolarHBondContact O-N 2.81Å; F112-S114 PolarHBondContact O-N 3.23Å; F112-S114 VanDerWaalsContact O-N 3.1Å; F112-E115 HydrophobicContact CB-CB 3.97Å; F112-E115 HydrophobicContact CB-CG 3.84Å; F112-E115 PolarHBondContact O-N 3.19Å; F112-E115 VanDerWaalsContact O-N 3.11Å; F112-A118 HydrophobicContact CB-CB 3.89Å; F112-V121 HydrophobicContact CD1-CG1 3.86Å; F112-V121 HydrophobicContact CE1-CG1 3.87Å; F112-V121 HydrophobicContact CG-CG1 4.29Å; F112-V121 HydrophobicContact CZ-CG1 4.33Å; F112-M122 HydrophobicContact CD2-CB 4.25Å; F112-M122 HydrophobicContact CE2-CB 3.68Å; F112-M122 HydrophobicContact CE2-CG 4.08Å; F112-M122 HydrophobicContact CE2-SD 4.46Å; F112-M122 HydrophobicContact CZ-CB 4.48Å; F112-I125 HydrophobicContact CE1-CD1 3.82Å; F112-I125 HydrophobicContact CZ-CD1 3.73Å
113	P	94.2	Very high	95.2	Very high	102 Å²	102	59.3 Å²	59.3	66%	0.662	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.1	-172.5	28	-36.2	0	0	0	114	S109 L111	S109-P113 WeakPolarHBondContact O-CA 3.42Å; L111-P113 VanDerWaalsContact C-CD 3.5Å; L111-P113 WeakPolarHBondContact O-CD 3.22Å
114	S	94.4	Very high	95.3	Very high	114 Å²	114	65.4 Å²	65.4	80%	0.797	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-6.9	178.9	-55.4	0	0	0	0	113.7	F112	F112-S114 PolarHBondContact O-N 3.23Å; F112-S114 VanDerWaalsContact O-N 3.1Å
115	E	95.5	Very high	95.5	Very high	100 Å²	100	61.2 Å²	61.2	47%	0.467	35%	0.351	S	S	.	.			trans	-98.5	125.8	-175.6	-61.7	-62	156.1	0	0	110.2	F112 D117 A118 V121	F112-E115 HydrophobicContact CB-CB 3.97Å; F112-E115 HydrophobicContact CB-CG 3.84Å; F112-E115 PolarHBondContact O-N 3.19Å; F112-E115 VanDerWaalsContact O-N 3.11Å; E115-D117 PolarHBondContact O-N 2.78Å; E115-A118 HydrophobicContact CB-CB 4.45Å; E115-V121 HydrophobicContact CB-CG2 4.14Å; E115-V121 HydrophobicContact CG-CG1 4.42Å; E115-V121 HydrophobicContact CG-CG2 3.98Å
116	S	93.5	Very high	95.7	Very high	135 Å²	135	59.8 Å²	59.8	94%	0.944	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-30.1	177.4	57.6	0	0	0	0	112.6
117	D	95.6	Very high	95.9	Very high	77 Å²	77	64.5 Å²	64.5	41%	0.412	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	67.1	176.4	-172.6	-2.3	0	0	0	109.8	E115 F119 S120 V121	E115-D117 PolarHBondContact O-N 2.78Å; D117-F119 PolarHBondContact O-N 3.13Å; D117-S120 PolarHBondContact O-N 3.27Å; D117-S120 WeakPolarHBondContact OD1-CB 3.02Å; D117-S120 PolarHBondContact OD1-N 3.37Å; D117-S120 PolarHBondContact OD1-OG 3Å; D117-S120 VanDerWaalsContact OD1-OG 3.13Å; D117-S120 WeakPolarHBondContact OD2-CB 2.89Å; D117-S120 PolarHBondContact OD2-OG 2.92Å; D117-V121 WeakPolarHBondContact O-CG2 3.32Å; D117-V121 PolarHBondContact O-N 3.35Å; D117-V121 VanDerWaalsContact O-N 3.16Å
118	A	96.6	Very high	95.9	Very high	6 Å²	6	68 Å²	68	5%	0.05	38%	0.381	C	S	.	.	H	α-helix	trans	-57.5	-32.7	-179.5	0	0	0	0	0	113.1	P108 F112 E115 M122	P108-A118 HydrophobicContact CB-CB 3.93Å; P108-A118 WeakPolarHBondContact O-CB 3.26Å; F112-A118 HydrophobicContact CB-CB 3.89Å; E115-A118 HydrophobicContact CB-CB 4.45Å; A118-M122 WeakPolarHBondContact O-CB 3.27Å; A118-M122 PolarHBondContact O-N 3.5Å
119	F	94.5	Very high	96	Very high	130 Å²	130	68.6 Å²	68.6	57%	0.57	38%	0.383	S	S	*	.	H	α-helix	trans	-65.8	-52	178.2	-176.4	-91.2	0	0	0	110.9	P108 D117 V121 M122 T123	P108-F119 HydrophobicContact CG-CD2 4.11Å; D117-F119 PolarHBondContact O-N 3.13Å; F119-V121 VanDerWaalsContact C-N 3.28Å; F119-V121 PolarHBondContact O-N 3.14Å; F119-M122 PolarHBondContact O-N 2.86Å; F119-M122 VanDerWaalsContact O-N 3.16Å; F119-T123 WeakPolarHBondContact O-CB 3.43Å; F119-T123 PolarHBondContact O-N 2.82Å; F119-T123 PolarHBondContact O-OG1 2.83Å; F119-T123 VanDerWaalsContact O-OG1 3.1Å
120	S	96	Very high	96	Very high	51 Å²	51	70.9 Å²	70.9	36%	0.357	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-35.1	178.5	-65.6	0	0	0	0	113	D117 R124	D117-S120 PolarHBondContact O-N 3.27Å; D117-S120 WeakPolarHBondContact OD1-CB 3.02Å; D117-S120 PolarHBondContact OD1-N 3.37Å; D117-S120 PolarHBondContact OD1-OG 3Å; D117-S120 VanDerWaalsContact OD1-OG 3.13Å; D117-S120 WeakPolarHBondContact OD2-CB 2.89Å; D117-S120 PolarHBondContact OD2-OG 2.92Å; S120-R124 VanDerWaalsContact O-CB 3.27Å; S120-R124 WeakPolarHBondContact O-CB 3.24Å; S120-R124 PolarHBondContact O-N 3.49Å
121	V	97.1	Very high	96.1	Very high	18 Å²	18	67 Å²	67	11%	0.109	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-48.5	174.3	173.8	0	0	0	0	110.6	F112 E115 D117 F119 R124 I125	F112-V121 HydrophobicContact CD1-CG1 3.86Å; F112-V121 HydrophobicContact CE1-CG1 3.87Å; F112-V121 HydrophobicContact CG-CG1 4.29Å; F112-V121 HydrophobicContact CZ-CG1 4.33Å; E115-V121 HydrophobicContact CB-CG2 4.14Å; E115-V121 HydrophobicContact CG-CG1 4.42Å; E115-V121 HydrophobicContact CG-CG2 3.98Å; D117-V121 WeakPolarHBondContact O-CG2 3.32Å; D117-V121 PolarHBondContact O-N 3.35Å; D117-V121 VanDerWaalsContact O-N 3.16Å; F119-V121 VanDerWaalsContact C-N 3.28Å; F119-V121 PolarHBondContact O-N 3.14Å; V121-R124 PolarHBondContact O-N 2.98Å; V121-I125 HydrophobicContact CG1-CD1 3.97Å; V121-I125 VanDerWaalsContact O-CG1 3.32Å; V121-I125 WeakPolarHBondContact O-CG1 3.38Å; V121-I125 PolarHBondContact O-N 3.45Å; V121-I125 VanDerWaalsContact O-N 3.13Å
122	M	96.6	Very high	96.2	Very high	4 Å²	4	69.9 Å²	69.9	2%	0.02	38%	0.376	C	S	.	.	H	α-helix	trans	-61.3	-51.1	178.5	-176.5	167.7	-178.8	0	0	112	F73 W81 V106 P108 L111 F112 A118 F119 R124 I125 I126 L133	F73-M122 HydrophobicContact CE2-CE 4.35Å; F73-M122 HydrophobicContact CZ-CE 3.9Å; W81-M122 HydrophobicContact CE3-CE 4.15Å; W81-M122 HydrophobicContact CH2-CE 4.01Å; W81-M122 HydrophobicContact CH2-CG 4.02Å; W81-M122 HydrophobicContact CZ3-CE 3.52Å; W81-M122 HydrophobicContact CZ3-CG 4.45Å; V106-M122 HydrophobicContact CG2-CE 3.22Å; V106-M122 HydrophobicContact CG2-SD 3.39Å; V106-M122 WeakPolarHBondContact CG2-SD 3.31Å; P108-M122 HydrophobicContact CB-CB 4.49Å; P108-M122 HydrophobicContact CB-SD 4.17Å; P108-M122 HydrophobicContact CG-SD 3.94Å; L111-M122 HydrophobicContact CD1-CE 4.05Å; L111-M122 HydrophobicContact CD1-SD 3.95Å; F112-M122 HydrophobicContact CD2-CB 4.25Å; F112-M122 HydrophobicContact CE2-CB 3.68Å; F112-M122 HydrophobicContact CE2-CG 4.08Å; F112-M122 HydrophobicContact CE2-SD 4.46Å; F112-M122 HydrophobicContact CZ-CB 4.48Å; A118-M122 WeakPolarHBondContact O-CB 3.27Å; A118-M122 PolarHBondContact O-N 3.5Å; F119-M122 PolarHBondContact O-N 2.86Å; F119-M122 VanDerWaalsContact O-N 3.16Å; M122-R124 VanDerWaalsContact C-N 3.32Å; M122-R124 PolarHBondContact O-N 3.33Å; M122-I125 PolarHBondContact O-N 2.82Å; M122-I125 VanDerWaalsContact O-N 3.14Å; M122-I126 HydrophobicContact CE-CD1 3.74Å; M122-I126 HydrophobicContact CG-CD1 3.7Å; M122-I126 HydrophobicContact CG-CG1 4.49Å; M122-I126 WeakPolarHBondContact O-CG1 3.27Å; M122-I126 PolarHBondContact O-N 3.43Å; M122-L133 HydrophobicContact CE-CD2 4.25Å
123	T	95.9	Very high	96.2	Very high	51 Å²	51	71 Å²	71	31%	0.313	38%	0.383	S	S	.	.	H	α-helix	trans	-58.2	-43.8	-179.9	-61.1	0	0	0	0	111.3	F119 I125 I126 L127	F119-T123 WeakPolarHBondContact O-CB 3.43Å; F119-T123 PolarHBondContact O-N 2.82Å; F119-T123 PolarHBondContact O-OG1 2.83Å; F119-T123 VanDerWaalsContact O-OG1 3.1Å; T123-I125 PolarHBondContact O-N 2.62Å; T123-I126 PolarHBondContact O-N 2.93Å; T123-L127 HydrophobicContact CG2-CD1 3.87Å; T123-L127 HydrophobicContact CG2-CG 4.31Å; T123-L127 WeakPolarHBondContact O-CB 3.39Å; T123-L127 VanDerWaalsContact O-CG 3.31Å; T123-L127 WeakPolarHBondContact O-CG 3.43Å; T123-L127 PolarHBondContact O-N 3.37Å
124	R	97.5	Very high	96.3	Very high	132 Å²	132	66.2 Å²	66.2	50%	0.498	35%	0.353	S	S	.	.	H	α-helix	trans	-59	-47.2	175.5	-179.1	174.2	62.8	-113.5	0.2	111.8	S120 V121 M122 I126 L127 D128	S120-R124 VanDerWaalsContact O-CB 3.27Å; S120-R124 WeakPolarHBondContact O-CB 3.24Å; S120-R124 PolarHBondContact O-N 3.49Å; V121-R124 PolarHBondContact O-N 2.98Å; M122-R124 VanDerWaalsContact C-N 3.32Å; M122-R124 PolarHBondContact O-N 3.33Å; R124-I126 VanDerWaalsContact C-N 3.31Å; R124-I126 PolarHBondContact O-N 3.3Å; R124-L127 PolarHBondContact O-N 3.29Å; R124-D128 VanDerWaalsContact O-CB 3.3Å; R124-D128 WeakPolarHBondContact O-CB 3.42Å; R124-D128 PolarHBondContact O-N 3.45Å
125	I	97.6	Very high	96.3	Very high	34 Å²	34	62.6 Å²	62.6	17%	0.174	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-42.2	179.3	-67.5	164.3	0	0	0	111.2	W81 L85 F112 V121 M122 T123 H129	W81-I125 HydrophobicContact CH2-CG2 4.38Å; W81-I125 HydrophobicContact CZ2-CB 4.42Å; W81-I125 HydrophobicContact CZ2-CD1 4.39Å; W81-I125 HydrophobicContact CZ2-CG2 3.94Å; L85-I125 HydrophobicContact CD1-CG2 3.57Å; F112-I125 HydrophobicContact CE1-CD1 3.82Å; F112-I125 HydrophobicContact CZ-CD1 3.73Å; V121-I125 HydrophobicContact CG1-CD1 3.97Å; V121-I125 VanDerWaalsContact O-CG1 3.32Å; V121-I125 WeakPolarHBondContact O-CG1 3.38Å; V121-I125 PolarHBondContact O-N 3.45Å; V121-I125 VanDerWaalsContact O-N 3.13Å; M122-I125 PolarHBondContact O-N 2.82Å; M122-I125 VanDerWaalsContact O-N 3.14Å; T123-I125 PolarHBondContact O-N 2.62Å; I125-H129 PolarHBondContact O-N 2.86Å; I125-H129 PolarHBondContact O-ND1 3.28Å
126	I	97.6	Very high	96.2	Very high	9 Å²	9	59.8 Å²	59.8	5%	0.046	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-47.1	179.9	-68.9	166	0	0	0	110.9	W81 L101 M122 T123 R124 H129 E130 F131 L133	W81-I126 HydrophobicContact CH2-CD1 4.29Å; W81-I126 HydrophobicContact CH2-CG1 3.98Å; L101-I126 HydrophobicContact CD2-CD1 4.38Å; L101-I126 HydrophobicContact CD2-CG1 4.32Å; M122-I126 HydrophobicContact CE-CD1 3.74Å; M122-I126 HydrophobicContact CG-CD1 3.7Å; M122-I126 HydrophobicContact CG-CG1 4.49Å; M122-I126 WeakPolarHBondContact O-CG1 3.27Å; M122-I126 PolarHBondContact O-N 3.43Å; T123-I126 PolarHBondContact O-N 2.93Å; R124-I126 VanDerWaalsContact C-N 3.31Å; R124-I126 PolarHBondContact O-N 3.3Å; I126-H129 PolarHBondContact O-N 3.4Å; I126-E130 PolarHBondContact O-N 3.12Å; I126-F131 HydrophobicContact CG2-CB 4.03Å; I126-F131 WeakPolarHBondContact CG2-O 3.5Å; I126-F131 PolarHBondContact O-N 3.2Å; I126-L133 HydrophobicContact CD1-CB 4.2Å; I126-L133 HydrophobicContact CD1-CD2 4.1Å
127	L	96.4	Very high	96.1	Very high	116 Å²	116	55.8 Å²	55.8	61%	0.607	28%	0.283	S	S	*	.	H	α-helix	trans	-67	-39.5	178.7	-67.9	176.6	0	0	0	112.5	T123 R124 H129 E130	T123-L127 HydrophobicContact CG2-CD1 3.87Å; T123-L127 HydrophobicContact CG2-CG 4.31Å; T123-L127 WeakPolarHBondContact O-CB 3.39Å; T123-L127 VanDerWaalsContact O-CG 3.31Å; T123-L127 WeakPolarHBondContact O-CG 3.43Å; T123-L127 PolarHBondContact O-N 3.37Å; R124-L127 PolarHBondContact O-N 3.29Å; L127-H129 PolarHBondContact O-N 2.78Å; L127-E130 WeakPolarHBondContact O-CA 3.49Å; L127-E130 PolarHBondContact O-N 3.2Å
128	D	96.5	Very high	95.9	Very high	114 Å²	114	53.1 Å²	53.1	61%	0.61	27%	0.27	S	S	*	.	H	α-helix	trans	-61.8	-25.6	175.9	-73.3	-15.3	0	0	0	112	R124	R124-D128 VanDerWaalsContact O-CB 3.3Å; R124-D128 WeakPolarHBondContact O-CB 3.42Å; R124-D128 PolarHBondContact O-N 3.45Å
129	H	96.5	Very high	95.6	Very high	31 Å²	31	57.3 Å²	57.3	14%	0.144	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.6	174.5	-70.5	74.8	0	0	0	113.6	M88 S89 I92 I125 I126 L127 F131	M88-H129 HydrophobicContact CB-CB 4.33Å; M88-H129 HydrophobicContact CE-CB 3.49Å; M88-H129 VanDerWaalsContact CE-CB 3.49Å; S89-H129 PolarHBondContact OG-NE2 3.32Å; I92-H129 VanDerWaalsContact CD1-CA 3.5Å; I92-H129 HydrophobicContact CD1-CB 3.67Å; I92-H129 WeakPolarHBondContact CD1-CD2 3.39Å; I125-H129 PolarHBondContact O-N 2.86Å; I125-H129 PolarHBondContact O-ND1 3.28Å; I126-H129 PolarHBondContact O-N 3.4Å; L127-H129 PolarHBondContact O-N 2.78Å; H129-F131 HydrophobicContact CB-CD2 3.77Å; H129-F131 HydrophobicContact CB-CE2 4.41Å; H129-F131 WeakPolarHBondContact O-CD2 3.37Å; H129-F131 PolarHBondContact O-N 2.67Å
130	E	96.6	Very high	95.4	Very high	139 Å²	139	59.4 Å²	59.4	65%	0.65	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	37.1	-173.4	-52.5	175.8	159	0	0	112.4	R99 I126 L127	R99-E130 WeakPolarHBondContact CB-O 2.92Å; R99-E130 IonicContact CZ-OE2 2.99Å; R99-E130 IonicContact NH1-OE2 3.51Å; R99-E130 PolarHBondContact NH1-OE2 2.8Å; R99-E130 IonicContact NH2-OE2 3.24Å; I126-E130 PolarHBondContact O-N 3.12Å; L127-E130 WeakPolarHBondContact O-CA 3.49Å; L127-E130 PolarHBondContact O-N 3.2Å
131	F	97.9	Very high	95	Very high	9 Å²	9	64.8 Å²	64.8	4%	0.039	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-91.2	148.1	172.5	-89.4	-103.1	0	0	0	110.7	V69 I71 M88 A91 R99 L101 I126 H129	V69-F131 HydrophobicContact CG1-CE1 3.93Å; V69-F131 HydrophobicContact CG1-CZ 3.76Å; I71-F131 HydrophobicContact CD1-CE1 3.66Å; I71-F131 HydrophobicContact CD1-CZ 3.78Å; I71-F131 HydrophobicContact CG1-CE1 4.35Å; M88-F131 HydrophobicContact CB-CD2 4.04Å; M88-F131 HydrophobicContact CB-CE2 3.62Å; M88-F131 HydrophobicContact CB-CZ 4.02Å; M88-F131 HydrophobicContact CE-CB 4.1Å; M88-F131 HydrophobicContact CE-CD2 3.92Å; M88-F131 HydrophobicContact CE-CG 4.02Å; M88-F131 HydrophobicContact CG-CD1 4.15Å; M88-F131 HydrophobicContact CG-CD2 3.83Å; M88-F131 HydrophobicContact CG-CE1 3.98Å; M88-F131 HydrophobicContact CG-CE2 3.64Å; M88-F131 HydrophobicContact CG-CG 4.08Å; M88-F131 HydrophobicContact CG-CZ 3.72Å; A91-F131 HydrophobicContact CB-CE2 4.11Å; A91-F131 HydrophobicContact CB-CZ 3.81Å; R99-F131 VanDerWaalsContact C-CD1 3.43Å; R99-F131 HydrophobicContact CB-CD1 3.76Å; R99-F131 HydrophobicContact CB-CD2 3.72Å; R99-F131 HydrophobicContact CB-CE1 3.74Å; R99-F131 HydrophobicContact CB-CE2 3.72Å; R99-F131 HydrophobicContact CB-CG 3.75Å; R99-F131 HydrophobicContact CB-CZ 3.73Å; R99-F131 HydrophobicContact CG-CD2 4.31Å; R99-F131 HydrophobicContact CG-CE1 4.5Å; R99-F131 HydrophobicContact CG-CE2 3.92Å; R99-F131 HydrophobicContact CG-CZ 4.03Å; R99-F131 WeakPolarHBondContact O-CA 3.25Å; L101-F131 HydrophobicContact CB-CD1 3.97Å; I126-F131 HydrophobicContact CG2-CB 4.03Å; I126-F131 WeakPolarHBondContact CG2-O 3.5Å; I126-F131 PolarHBondContact O-N 3.2Å; H129-F131 HydrophobicContact CB-CD2 3.77Å; H129-F131 HydrophobicContact CB-CE2 4.41Å; H129-F131 WeakPolarHBondContact O-CD2 3.37Å; H129-F131 PolarHBondContact O-N 2.67Å
132	E	96.5	Very high	94.5	Very high	66 Å²	66	67.9 Å²	67.9	31%	0.308	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.8	166	-162.8	-178.5	132.2	0	0	109.8	R99 L101 R153 I157	R99-E132 PolarHBondContact O-N 2.88Å; L101-E132 PolarHBondContact N-O 2.74Å; E132-R153 IonicContact OE1-CZ 3.89Å; E132-R153 IonicContact OE1-NE 3.09Å; E132-R153 PolarHBondContact OE1-NE 3.47Å; E132-R153 IonicContact OE1-NH2 2.65Å; E132-R153 PolarHBondContact OE1-NH2 2.89Å; E132-R153 IonicContact OE2-CZ 3.63Å; E132-R153 IonicContact OE2-NH2 3.12Å; E132-R153 PolarHBondContact OE2-NH2 3.38Å; E132-I157 HydrophobicContact CB-CD1 4.47Å; E132-I157 HydrophobicContact CG-CD1 4.43Å; E132-I157 WeakPolarHBondContact OE1-CD1 3.28Å
133	L	96.6	Very high	94.1	Very high	52 Å²	52	70.5 Å²	70.5	27%	0.272	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.3	174.9	178.1	66.7	0	0	0	110.2	F73 L101 V106 M122 I126	F73-L133 HydrophobicContact CE1-CD1 3.82Å; F73-L133 HydrophobicContact CZ-CD1 4.11Å; L101-L133 HydrophobicContact CB-CD1 4.39Å; L101-L133 HydrophobicContact CD2-CD1 4.04Å; L101-L133 HydrophobicContact CG-CD1 4.16Å; L101-L133 CarbonylContact O-C 3.51Å; L101-L133 WeakPolarHBondContact O-CA 3.25Å; V106-L133 HydrophobicContact CB-CD2 4.49Å; V106-L133 HydrophobicContact CG1-CD2 4.49Å; V106-L133 HydrophobicContact CG2-CD2 4.46Å; M122-L133 HydrophobicContact CE-CD2 4.25Å; I126-L133 HydrophobicContact CD1-CB 4.2Å; I126-L133 HydrophobicContact CD1-CD2 4.1Å
134	V	95.9	Very high	93.8	Very high	3 Å²	3	74.2 Å²	74.2	2%	0.018	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	113.9	174.6	-177.5	0	0	0	0	109.7	V100 L101 V102 C103 G150 R153 I154 I157	V100-V134 HydrophobicContact CG1-CB 4.39Å; V100-V134 HydrophobicContact CG1-CG2 3.78Å; L101-V134 PolarHBondContact O-N 2.85Å; V102-V134 WeakPolarHBondContact CA-O 3.37Å; C103-V134 PolarHBondContact N-O 3.23Å; C103-V134 VanDerWaalsContact N-O 3.14Å; V134-G150 WeakPolarHBondContact CG1-O 3.42Å; V134-R153 HydrophobicContact CG1-CB 3.99Å; V134-R153 HydrophobicContact CG1-CG 4.26Å; V134-R153 HydrophobicContact CG2-CB 4.45Å; V134-R153 HydrophobicContact CG2-CG 3.88Å; V134-I154 HydrophobicContact CB-CG1 4.36Å; V134-I154 HydrophobicContact CG1-CD1 4.48Å; V134-I154 HydrophobicContact CG1-CG1 3.89Å; V134-I154 HydrophobicContact CG2-CG1 4.49Å; V134-I157 HydrophobicContact CG2-CD1 3.82Å
135	E	94.9	Very high	93.4	Very high	37 Å²	37	77.7 Å²	77.7	17%	0.173	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127.6	169.7	-65.8	-173.6	-110.4	0	0	110	C103 T105 V106 S137 P138 G150	C103-E135 CarbonylContact O-C 3.49Å; C103-E135 WeakPolarHBondContact O-CA 3.23Å; T105-E135 VanDerWaalsContact CA-OE2 3.25Å; T105-E135 WeakPolarHBondContact CA-OE2 3.48Å; V106-E135 HydrophobicContact CB-CG 4.48Å; V106-E135 HydrophobicContact CG1-CG 4.45Å; V106-E135 WeakPolarHBondContact CG1-OE1 3.5Å; V106-E135 PolarHBondContact N-OE2 3.35Å; E135-S137 VanDerWaalsContact C-N 3.32Å; E135-P138 HydrophobicContact CB-CB 3.89Å; E135-P138 HydrophobicContact CB-CG 4.36Å; E135-G150 WeakPolarHBondContact O-CA 3.5Å; E135-G150 PolarHBondContact O-N 2.94Å
136	I	93.2	Very high	93	Very high	42 Å²	42	80 Å²	80	22%	0.215	43%	0.427	C	S	.	.	S	Bend	trans	-71	-32.1	177	-58.9	-56.6	0	0	0	111.3	L21 V102 C103 H104 I154	L21-I136 HydrophobicContact CD2-CD1 3.48Å; L21-I136 VanDerWaalsContact CD2-CD1 3.48Å; L21-I136 HydrophobicContact CD2-CG1 3.86Å; V102-I136 HydrophobicContact CG1-CD1 3.59Å; V102-I136 HydrophobicContact CG1-CG1 3.72Å; C103-I136 WeakPolarHBondContact O-CG1 3.36Å; C103-I136 PolarHBondContact O-N 3.04Å; H104-I136 PolarHBondContact O-N 3.49Å; I136-I154 HydrophobicContact CD1-CD1 3.95Å
137	S	91.1	Very high	92.7	Very high	51 Å²	51	85 Å²	85	36%	0.357	45%	0.451	S	S	.	.	S	Bend	trans	-143.9	72.2	179.6	-58.6	0	0	0	0	108.9	H104 T105 E135	H104-S137 VanDerWaalsContact CE1-CB 3.4Å; H104-S137 WeakPolarHBondContact CE1-CB 3.47Å; H104-S137 PolarHBondContact CE1-OG 2.73Å; H104-S137 CarbonylContact O-C 3.4Å; H104-S137 PolarHBondContact O-N 3.29Å; T105-S137 PolarHBondContact OG1-O 3.16Å; E135-S137 VanDerWaalsContact C-N 3.32Å
138	P	92.5	Very high	92.5	Very high	20 Å²	20	84 Å²	84	13%	0.13	44%	0.443	C	S	.	.			trans	-63.7	163.4	174.9	28.4	-33.6	0	0	0	110.6	E135 I143 F149	E135-P138 HydrophobicContact CB-CB 3.89Å; E135-P138 HydrophobicContact CB-CG 4.36Å; P138-I143 HydrophobicContact CB-CG1 4.28Å; P138-I143 HydrophobicContact CG-CD1 3.96Å; P138-I143 HydrophobicContact CG-CG1 3.79Å; P138-F149 HydrophobicContact CG-CB 4Å; P138-F149 HydrophobicContact CG-CD2 3.75Å; P138-F149 HydrophobicContact CG-CE2 4.43Å; P138-F149 HydrophobicContact CG-CG 3.93Å
139	N	91	Very high	92.3	Very high	94 Å²	94	83.4 Å²	83.4	50%	0.503	44%	0.435	S	S	.	.			trans	-67.5	141.1	172.3	-64.3	-52.6	0	0	0	109.8	D141 T142	N139-D141 PolarHBondContact O-N 2.75Å; N139-T142 HydrophobicContact CB-CG2 4.18Å; N139-T142 PolarHBondContact N-OG1 2.88Å; N139-T142 PolarHBondContact O-N 2.94Å; N139-T142 PolarHBondContact O-OG1 3.38Å
140	E	88.3	Confident	92.1	Very high	174 Å²	174	82 Å²	82	81%	0.813	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-58.2	-35.8	-177.7	-65.5	-175.1	169.7	0	0	112.3	T142 I143	E140-T142 PolarHBondContact O-N 3.12Å; E140-I143 PolarHBondContact O-N 2.89Å
141	D	88.8	Confident	91.9	Very high	164 Å²	164	77.6 Å²	77.6	88%	0.877	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-68.5	-15.1	178.5	-61.1	-38.3	0	0	0	113.9	N139	N139-D141 PolarHBondContact O-N 2.75Å
142	T	85.7	Confident	91.6	Very high	83 Å²	83	84.4 Å²	84.4	51%	0.509	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-99.6	-4.3	-179.7	60.4	0	0	0	0	113.1	N139 E140	N139-T142 HydrophobicContact CB-CG2 4.18Å; N139-T142 PolarHBondContact N-OG1 2.88Å; N139-T142 PolarHBondContact O-N 2.94Å; N139-T142 PolarHBondContact O-OG1 3.38Å; E140-T142 PolarHBondContact O-N 3.12Å
143	I	90	Very high	91.6	Very high	59 Å²	59	85.2 Å²	85.2	30%	0.303	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-86.2	119.2	-178.5	-59	168.3	0	0	0	108.9	P138 E140 F149	P138-I143 HydrophobicContact CB-CG1 4.28Å; P138-I143 HydrophobicContact CG-CD1 3.96Å; P138-I143 HydrophobicContact CG-CG1 3.79Å; E140-I143 PolarHBondContact O-N 2.89Å; I143-F149 HydrophobicContact CD1-CD1 4.1Å; I143-F149 HydrophobicContact CD1-CE1 3.77Å; I143-F149 HydrophobicContact CD1-CE2 4.3Å; I143-F149 HydrophobicContact CD1-CZ 3.87Å; I143-F149 HydrophobicContact CG1-CD1 4.31Å; I143-F149 HydrophobicContact CG1-CE1 4.42Å; I143-F149 HydrophobicContact CG2-CD1 3.81Å; I143-F149 HydrophobicContact CG2-CE1 3.9Å
144	E	89.3	Confident	91.5	Very high	129 Å²	129	82.9 Å²	82.9	60%	0.603	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-77.1	144.3	173.5	-61.1	-169.6	-171.2	0	0	111.3	G146 E147	E144-G146 PolarHBondContact O-N 3.49Å; E144-E147 HydrophobicContact CB-CB 4.38Å; E144-E147 HydrophobicContact CB-CG 3.81Å; E144-E147 PolarHBondContact O-N 3.46Å; E144-E147 VanDerWaalsContact O-N 3.15Å
145	E	88.7	Confident	91.4	Very high	206 Å²	206	84.9 Å²	84.9	96%	0.963	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	123.7	-177.1	-172.1	-178.7	178.5	0	0	111.2	E147	E145-E147 VanDerWaalsContact C-N 3.31Å
146	G	89.2	Confident	91.3	Very high	81 Å²	81	84 Å²	84	84%	0.835	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-6.7	179.4	0	0	0	0	0	114.5	E144	E144-G146 PolarHBondContact O-N 3.49Å
147	E	90.1	Very high	91.4	Very high	116 Å²	116	82.7 Å²	82.7	54%	0.542	43%	0.431	S	S	.	.			trans	-78.4	142.1	174.4	-66.2	-158.7	149.5	0	0	112.1	E144 E145	E144-E147 HydrophobicContact CB-CB 4.38Å; E144-E147 HydrophobicContact CB-CG 3.81Å; E144-E147 PolarHBondContact O-N 3.46Å; E144-E147 VanDerWaalsContact O-N 3.15Å; E145-E147 VanDerWaalsContact C-N 3.31Å
148	E	92.1	Very high	91.7	Very high	95 Å²	95	80.3 Å²	80.3	44%	0.444	41%	0.414	S	S	.	.			trans	-87.7	136	173.9	-65.4	177.4	149.5	0	0	109.8	K152 R153 S156	E148-K152 HydrophobicContact CB-CB 4.46Å; E148-R153 HydrophobicContact CB-CB 4.39Å; E148-R153 WeakPolarHBondContact O-CB 3.2Å; E148-R153 WeakPolarHBondContact O-CD 3.39Å; E148-S156 WeakPolarHBondContact OE2-CB 3.45Å; E148-S156 PolarHBondContact OE2-OG 3.09Å
149	F	92.6	Very high	91.7	Very high	100 Å²	100	82.4 Å²	82.4	44%	0.439	42%	0.422	S	S	.	.			trans	-128.5	172.3	175	61	-88.9	0	0	0	111.4	P138 I143 R153	P138-F149 HydrophobicContact CG-CB 4Å; P138-F149 HydrophobicContact CG-CD2 3.75Å; P138-F149 HydrophobicContact CG-CE2 4.43Å; P138-F149 HydrophobicContact CG-CG 3.93Å; I143-F149 HydrophobicContact CD1-CD1 4.1Å; I143-F149 HydrophobicContact CD1-CE1 3.77Å; I143-F149 HydrophobicContact CD1-CE2 4.3Å; I143-F149 HydrophobicContact CD1-CZ 3.87Å; I143-F149 HydrophobicContact CG1-CD1 4.31Å; I143-F149 HydrophobicContact CG1-CE1 4.42Å; I143-F149 HydrophobicContact CG2-CD1 3.81Å; I143-F149 HydrophobicContact CG2-CE1 3.9Å; F149-R153 PolarHBondContact O-N 3.06Å
150	G	92.2	Very high	91.8	Very high	3 Å²	3	83.2 Å²	83.2	3%	0.031	43%	0.431	C	S	.	.	H	α-helix	trans	54.3	-139.6	179.9	0	0	0	0	0	114.5	V134 E135 K152 R153 I154	V134-G150 WeakPolarHBondContact CG1-O 3.42Å; E135-G150 WeakPolarHBondContact O-CA 3.5Å; E135-G150 PolarHBondContact O-N 2.94Å; G150-K152 PolarHBondContact O-N 3.47Å; G150-R153 WeakPolarHBondContact O-CB 3.33Å; G150-R153 PolarHBondContact O-N 3.3Å; G150-I154 PolarHBondContact O-N 3.07Å
151	V	92.6	Very high	92.1	Very high	46 Å²	46	76.7 Å²	76.7	28%	0.279	40%	0.4	S	S	.	.	H	α-helix	trans	-56.9	-38.7	-175.7	171.6	0	0	0	0	112.2	L21 R153 I154 I155	L21-V151 WeakPolarHBondContact O-CG1 3.17Å; L21-V151 WeakPolarHBondContact O-CG2 3.17Å; V151-R153 VanDerWaalsContact C-N 3.29Å; V151-R153 PolarHBondContact O-N 3.26Å; V151-I154 PolarHBondContact O-N 2.92Å; V151-I155 HydrophobicContact CG1-CG1 4.38Å; V151-I155 WeakPolarHBondContact O-CG1 3.35Å; V151-I155 PolarHBondContact O-N 2.89Å
152	K	92.7	Very high	92.3	Very high	151 Å²	151	75.2 Å²	75.2	66%	0.657	39%	0.391	S	S	*	.	H	α-helix	trans	-59.3	-43.6	177.9	-69	-177.9	179.6	177.1	0	111	E148 G150 I154 I155 S156	E148-K152 HydrophobicContact CB-CB 4.46Å; G150-K152 PolarHBondContact O-N 3.47Å; K152-I154 PolarHBondContact O-N 3.4Å; K152-I155 PolarHBondContact O-N 2.81Å; K152-S156 PolarHBondContact O-N 2.95Å; K152-S156 PolarHBondContact O-OG 2.91Å
153	R	95.2	Very high	92.7	Very high	84 Å²	84	71.4 Å²	71.4	32%	0.317	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-41.9	177.9	-173.5	58.6	-170.5	164.7	5.4	112.4	E132 V134 E148 F149 G150 V151 I155 S156 I157	E132-R153 IonicContact OE1-CZ 3.89Å; E132-R153 IonicContact OE1-NE 3.09Å; E132-R153 PolarHBondContact OE1-NE 3.47Å; E132-R153 IonicContact OE1-NH2 2.65Å; E132-R153 PolarHBondContact OE1-NH2 2.89Å; E132-R153 IonicContact OE2-CZ 3.63Å; E132-R153 IonicContact OE2-NH2 3.12Å; E132-R153 PolarHBondContact OE2-NH2 3.38Å; V134-R153 HydrophobicContact CG1-CB 3.99Å; V134-R153 HydrophobicContact CG1-CG 4.26Å; V134-R153 HydrophobicContact CG2-CB 4.45Å; V134-R153 HydrophobicContact CG2-CG 3.88Å; E148-R153 HydrophobicContact CB-CB 4.39Å; E148-R153 WeakPolarHBondContact O-CB 3.2Å; E148-R153 WeakPolarHBondContact O-CD 3.39Å; F149-R153 PolarHBondContact O-N 3.06Å; G150-R153 WeakPolarHBondContact O-CB 3.33Å; G150-R153 PolarHBondContact O-N 3.3Å; V151-R153 VanDerWaalsContact C-N 3.29Å; V151-R153 PolarHBondContact O-N 3.26Å; R153-I155 VanDerWaalsContact C-N 3.32Å; R153-I155 PolarHBondContact O-N 2.92Å; R153-S156 PolarHBondContact O-N 3.38Å; R153-I157 HydrophobicContact CG-CD1 4.35Å; R153-I157 WeakPolarHBondContact O-CG1 3.4Å; R153-I157 PolarHBondContact O-N 3.48Å
154	I	94.9	Very high	92.8	Very high	2 Å²	2	72.6 Å²	72.6	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-58.5	-46.1	175.1	-57.6	176.4	0	0	0	110.5	L22 I70 V102 V134 I136 G150 V151 K152 S156 I157 L158	L22-I154 HydrophobicContact CD2-CG2 4.18Å; I70-I154 HydrophobicContact CD1-CG2 4.18Å; V102-I154 HydrophobicContact CG1-CD1 4.21Å; V102-I154 HydrophobicContact CG2-CD1 3.94Å; V102-I154 HydrophobicContact CG2-CG1 4.49Å; V134-I154 HydrophobicContact CB-CG1 4.36Å; V134-I154 HydrophobicContact CG1-CD1 4.48Å; V134-I154 HydrophobicContact CG1-CG1 3.89Å; V134-I154 HydrophobicContact CG2-CG1 4.49Å; I136-I154 HydrophobicContact CD1-CD1 3.95Å; G150-I154 PolarHBondContact O-N 3.07Å; V151-I154 PolarHBondContact O-N 2.92Å; K152-I154 PolarHBondContact O-N 3.4Å; I154-S156 PolarHBondContact O-N 3.15Å; I154-I157 PolarHBondContact O-N 3.05Å; I154-L158 HydrophobicContact CG2-CD1 4.39Å; I154-L158 WeakPolarHBondContact O-CG 3.33Å; I154-L158 PolarHBondContact O-N 2.8Å; I154-L158 VanDerWaalsContact O-N 3.12Å
155	I	93.8	Very high	92.9	Very high	45 Å²	45	68.4 Å²	68.4	23%	0.231	36%	0.361	C	S	.	.	H	α-helix	trans	-60.4	-45.5	177.1	-65.9	-64	0	0	0	110.8	L22 V151 K152 R153 I157 L158 E159	L22-I155 HydrophobicContact CD2-CD1 3.48Å; L22-I155 VanDerWaalsContact CD2-CD1 3.48Å; L22-I155 HydrophobicContact CD2-CG1 4.23Å; V151-I155 HydrophobicContact CG1-CG1 4.38Å; V151-I155 WeakPolarHBondContact O-CG1 3.35Å; V151-I155 PolarHBondContact O-N 2.89Å; K152-I155 PolarHBondContact O-N 2.81Å; R153-I155 VanDerWaalsContact C-N 3.32Å; R153-I155 PolarHBondContact O-N 2.92Å; I155-I157 VanDerWaalsContact C-N 3.34Å; I155-I157 PolarHBondContact O-N 3.04Å; I155-L158 CarbonylContact O-C 3.51Å; I155-L158 WeakPolarHBondContact O-CA 3.38Å; I155-L158 WeakPolarHBondContact O-CB 3.49Å; I155-L158 PolarHBondContact O-N 3.47Å; I155-E159 HydrophobicContact CG2-CG 4.02Å; I155-E159 WeakPolarHBondContact O-CB 3.45Å; I155-E159 WeakPolarHBondContact O-CG 3.43Å; I155-E159 PolarHBondContact O-N 2.82Å
156	S	93.9	Very high	93.2	Very high	19 Å²	19	61.7 Å²	61.7	13%	0.133	33%	0.33	C	S	.	.	H	α-helix	trans	-63.3	-36.4	179.3	-63.8	0	0	0	0	113.4	E148 K152 R153 I154 L158 E159 T160	E148-S156 WeakPolarHBondContact OE2-CB 3.45Å; E148-S156 PolarHBondContact OE2-OG 3.09Å; K152-S156 PolarHBondContact O-N 2.95Å; K152-S156 PolarHBondContact O-OG 2.91Å; R153-S156 PolarHBondContact O-N 3.38Å; I154-S156 PolarHBondContact O-N 3.15Å; S156-L158 VanDerWaalsContact C-N 3.34Å; S156-E159 PolarHBondContact O-N 2.94Å; S156-T160 WeakPolarHBondContact O-CB 3.46Å; S156-T160 WeakPolarHBondContact O-CG2 3.27Å; S156-T160 PolarHBondContact O-N 3.26Å; S156-T160 PolarHBondContact O-OG1 2.9Å
157	I	95.5	Very high	93.3	Very high	15 Å²	15	63.8 Å²	63.8	8%	0.077	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-44.7	170.8	-64.3	164.3	0	0	0	110.5	I98 V100 E132 V134 R153 I154 I155 T160 H161	I98-I157 HydrophobicContact CG2-CG2 3.7Å; V100-I157 HydrophobicContact CG1-CD1 4.04Å; V100-I157 HydrophobicContact CG2-CB 4.49Å; V100-I157 HydrophobicContact CG2-CD1 3.81Å; V100-I157 HydrophobicContact CG2-CG2 3.78Å; E132-I157 HydrophobicContact CB-CD1 4.47Å; E132-I157 HydrophobicContact CG-CD1 4.43Å; E132-I157 WeakPolarHBondContact OE1-CD1 3.28Å; V134-I157 HydrophobicContact CG2-CD1 3.82Å; R153-I157 HydrophobicContact CG-CD1 4.35Å; R153-I157 WeakPolarHBondContact O-CG1 3.4Å; R153-I157 PolarHBondContact O-N 3.48Å; I154-I157 PolarHBondContact O-N 3.05Å; I155-I157 VanDerWaalsContact C-N 3.34Å; I155-I157 PolarHBondContact O-N 3.04Å; I157-T160 PolarHBondContact O-N 2.8Å; I157-T160 PolarHBondContact O-OG1 3.32Å; I157-H161 PolarHBondContact O-N 3.45Å
158	L	95.5	Very high	93.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-69	-35.1	179	-63.6	175	0	0	0	112.3	V6 L35 I37 I98 I154 I155 S156 W163	V6-L158 HydrophobicContact CG2-CD2 4.32Å; L35-L158 HydrophobicContact CD2-CD1 3.78Å; I37-L158 HydrophobicContact CD1-CB 3.87Å; I98-L158 HydrophobicContact CD1-CD2 4.07Å; I154-L158 HydrophobicContact CG2-CD1 4.39Å; I154-L158 WeakPolarHBondContact O-CG 3.33Å; I154-L158 PolarHBondContact O-N 2.8Å; I154-L158 VanDerWaalsContact O-N 3.12Å; I155-L158 CarbonylContact O-C 3.51Å; I155-L158 WeakPolarHBondContact O-CA 3.38Å; I155-L158 WeakPolarHBondContact O-CB 3.49Å; I155-L158 PolarHBondContact O-N 3.47Å; S156-L158 VanDerWaalsContact C-N 3.34Å; L158-W163 HydrophobicContact CD2-CH2 4.49Å; L158-W163 HydrophobicContact CD2-CZ2 4.19Å; L158-W163 PolarHBondContact O-NE1 3.32Å
159	E	94.3	Very high	93.2	Very high	64 Å²	64	61.1 Å²	61.1	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-74.7	-25.8	177.8	-73.2	-172.4	171.7	0	0	113.7	I37 C39 Y42 I155 S156	I37-E159 HydrophobicContact CG2-CG 4.05Å; C39-E159 HydrophobicContact CB-CB 4.16Å; C39-E159 HydrophobicContact CB-CG 4.08Å; Y42-E159 WeakPolarHBondContact CE1-O 3.18Å; Y42-E159 VanDerWaalsContact OH-C 3.26Å; Y42-E159 PolarHBondContact OH-O 2.95Å; I155-E159 HydrophobicContact CG2-CG 4.02Å; I155-E159 WeakPolarHBondContact O-CB 3.45Å; I155-E159 WeakPolarHBondContact O-CG 3.43Å; I155-E159 PolarHBondContact O-N 2.82Å; S156-E159 PolarHBondContact O-N 2.94Å
160	T	92.7	Very high	92.2	Very high	111 Å²	111	58.9 Å²	58.9	68%	0.681	31%	0.314	S	S	*	.	H	α-helix	trans	-84.2	-16.2	179.2	49.3	0	0	0	0	112.9	S156 I157	S156-T160 WeakPolarHBondContact O-CB 3.46Å; S156-T160 WeakPolarHBondContact O-CG2 3.27Å; S156-T160 PolarHBondContact O-N 3.26Å; S156-T160 PolarHBondContact O-OG1 2.9Å; I157-T160 PolarHBondContact O-N 2.8Å; I157-T160 PolarHBondContact O-OG1 3.32Å
161	H	94.6	Very high	90.5	Very high	37 Å²	37	64 Å²	64	17%	0.171	34%	0.337	C	S	.	.	S	Bend	trans	-70.6	147.1	177.7	-171.3	66.6	0	0	0	113.3	Y42 I98 I157 W163	Y42-H161 PolarHBondContact OH-O 3.16Å; I98-H161 HydrophobicContact CD1-CB 3.54Å; I98-H161 VanDerWaalsContact CD1-CG 3.48Å; I98-H161 HydrophobicContact CG1-CB 4.03Å; I157-H161 PolarHBondContact O-N 3.45Å; H161-W163 HydrophobicContact CB-CZ2 4.18Å; H161-W163 AromaticContact CD2-CD2 3.72Å; H161-W163 AromaticContact CD2-CE2 3.78Å; H161-W163 AromaticContact CD2-CE3 3.79Å; H161-W163 AromaticContact CD2-CZ2 3.95Å; H161-W163 AromaticContact CD2-CZ3 3.95Å; H161-W163 PolarHBondContact O-N 3.45Å
162	I	91.9	Very high	88.5	Confident	134 Å²	134	67.8 Å²	67.8	69%	0.687	36%	0.356	S	S	*	.			trans	-88.9	92	177.3	-60.7	178.2	0	0	0	109.3	M166	I162-M166 VanDerWaalsContact CA-CE 3.41Å; I162-M166 HydrophobicContact CB-CE 3.86Å; I162-M166 HydrophobicContact CG1-CE 4.39Å; I162-M166 HydrophobicContact CG2-CE 3.38Å
163	W	94.1	Very high	86.3	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.008	35%	0.354	C	S	.	.			trans	-73.3	136.2	178.3	-60	96.7	0	0	0	112.7	P4 V6 Y42 A44 I46 H67 I98 L158 H161 N165 M166	P4-W163 HydrophobicContact CB-CE3 3.52Å; P4-W163 HydrophobicContact CB-CZ3 3.73Å; P4-W163 HydrophobicContact CG-CE3 4.01Å; V6-W163 HydrophobicContact CG2-CH2 3.54Å; V6-W163 HydrophobicContact CG2-CZ3 4.15Å; Y42-W163 AromaticContact CE2-CD1 3.67Å; Y42-W163 AromaticContact CZ-CD1 3.83Å; Y42-W163 VanDerWaalsContact OH-CD1 3.26Å; Y42-W163 PolarHBondContact OH-NE1 3.02Å; A44-W163 HydrophobicContact CB-CB 3.81Å; A44-W163 HydrophobicContact CB-CG 3.95Å; I46-W163 HydrophobicContact CB-CZ3 4.4Å; I46-W163 HydrophobicContact CD1-CH2 3.72Å; I46-W163 HydrophobicContact CD1-CZ2 3.74Å; I46-W163 HydrophobicContact CD1-CZ3 4.38Å; I46-W163 HydrophobicContact CG2-CD2 3.59Å; I46-W163 HydrophobicContact CG2-CE3 3.51Å; I46-W163 HydrophobicContact CG2-CG 4.26Å; I46-W163 HydrophobicContact CG2-CH2 4.05Å; I46-W163 HydrophobicContact CG2-CZ2 4.12Å; I46-W163 HydrophobicContact CG2-CZ3 3.74Å; H67-W163 HydrophobicContact CB-CZ3 3.86Å; I98-W163 HydrophobicContact CD1-CH2 3.69Å; I98-W163 HydrophobicContact CD1-CZ2 3.75Å; L158-W163 HydrophobicContact CD2-CH2 4.49Å; L158-W163 HydrophobicContact CD2-CZ2 4.19Å; L158-W163 PolarHBondContact O-NE1 3.32Å; H161-W163 HydrophobicContact CB-CZ2 4.18Å; H161-W163 AromaticContact CD2-CD2 3.72Å; H161-W163 AromaticContact CD2-CE2 3.78Å; H161-W163 AromaticContact CD2-CE3 3.79Å; H161-W163 AromaticContact CD2-CZ2 3.95Å; H161-W163 AromaticContact CD2-CZ3 3.95Å; H161-W163 PolarHBondContact O-N 3.45Å; W163-N165 PolarHBondContact O-N 2.9Å; W163-N165 VanDerWaalsContact O-N 3.13Å; W163-M166 HydrophobicContact CB-CB 4.43Å; W163-M166 VanDerWaalsContact N-CE 3.3Å; W163-M166 WeakPolarHBondContact O-CB 3.18Å; W163-M166 WeakPolarHBondContact O-CE 3.31Å; W163-M166 WeakPolarHBondContact O-CG 3.33Å; W163-M166 PolarHBondContact O-N 2.65Å; W163-M166 VanDerWaalsContact O-N 3.12Å
164	P	92	Very high	84	Confident	85 Å²	85	67.3 Å²	67.3	55%	0.552	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.2	-177.5	30.3	-39.3	0	0	0	113.6	P4	P4-P164 HydrophobicContact CB-CG 4.4Å; P4-P164 HydrophobicContact CG-CG 3.57Å
165	N	93.1	Very high	81.5	Confident	41 Å²	41	71 Å²	71	22%	0.219	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	16	177.8	70	-33.6	0	0	0	113.5	P4 D45 W163	P4-N165 WeakPolarHBondContact CG-OD1 3.49Å; D45-N165 PolarHBondContact N-ND2 3.17Å; D45-N165 PolarHBondContact O-ND2 3.23Å; W163-N165 PolarHBondContact O-N 2.9Å; W163-N165 VanDerWaalsContact O-N 3.13Å
166	M	93.3	Very high	79	Confident	65 Å²	65	77.3 Å²	77.3	32%	0.32	41%	0.407	S	S	.	.			trans	-60.7	141.6	-179.5	70.1	169.3	65.9	0	0	112.4	Y42 S43 A44 I162 W163	Y42-M166 HydrophobicContact CD2-CB 3.64Å; Y42-M166 HydrophobicContact CE2-CB 4.27Å; Y42-M166 HydrophobicContact CG-CB 4.04Å; Y42-M166 HydrophobicContact CG-SD 4.43Å; S43-M166 CarbonylContact O-C 3.55Å; S43-M166 WeakPolarHBondContact O-CA 3.1Å; A44-M166 HydrophobicContact CB-CB 4.46Å; I162-M166 VanDerWaalsContact CA-CE 3.41Å; I162-M166 HydrophobicContact CB-CE 3.86Å; I162-M166 HydrophobicContact CG1-CE 4.39Å; I162-M166 HydrophobicContact CG2-CE 3.38Å; W163-M166 HydrophobicContact CB-CB 4.43Å; W163-M166 VanDerWaalsContact N-CE 3.3Å; W163-M166 WeakPolarHBondContact O-CB 3.18Å; W163-M166 WeakPolarHBondContact O-CE 3.31Å; W163-M166 WeakPolarHBondContact O-CG 3.33Å; W163-M166 PolarHBondContact O-N 2.65Å; W163-M166 VanDerWaalsContact O-N 3.12Å
167	K	92.9	Very high	76.6	Confident	124 Å²	124	81.2 Å²	81.2	54%	0.539	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.8	173.9	-63.8	171.4	-172.2	159.8	0	107.9	Y42 S43	Y42-K167 CarbonylContact C-O 3.51Å; Y42-K167 VanDerWaalsContact CA-O 3.26Å; Y42-K167 WeakPolarHBondContact CA-O 3.33Å; Y42-K167 WeakPolarHBondContact CB-O 3.44Å; S43-K167 PolarHBondContact N-O 3.19Å; S43-K167 PolarHBondContact O-N 3.29Å
168	P	90.3	Very high	74	Confident	70 Å²	70	86.2 Å²	86.2	46%	0.455	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	137.3	-177	26.6	-34.6	0	0	0	111.2	Q171	P168-Q171 HydrophobicContact CG-CG 4.4Å
169	K	88.6	Confident	71.4	Confident	85 Å²	85	88.3 Å²	88.3	37%	0.37	46%	0.462	S	S	.	.	S	Bend	trans	-84.5	151.6	171.6	-65.3	179.3	-179.2	178.3	0	109	D38 C39 Y41 Y42	D38-K169 PolarHBondContact O-NZ 3.4Å; D38-K169 WeakPolarHBondContact OD1-CE 3.31Å; D38-K169 IonicContact OD1-NZ 3.42Å; D38-K169 PolarHBondContact OD1-NZ 3.03Å; D38-K169 IonicContact OD2-NZ 3.55Å; C39-K169 WeakPolarHBondContact O-CD 3.28Å; C39-K169 VanDerWaalsContact O-CE 3.26Å; C39-K169 WeakPolarHBondContact O-CE 3.45Å; C39-K169 PolarHBondContact O-NZ 3.46Å; Y41-K169 PolarHBondContact O-N 3Å; Y42-K169 WeakPolarHBondContact O-CE 3.49Å
170	G	72.4	Confident	68.9	Low	54 Å²	54	90.6 Å²	90.6	56%	0.557	47%	0.474	S	S	*	.			trans	89.1	7.8	173.8	0	0	0	0	0	116.6	N172 N173	G170-N172 PolarHBondContact O-N 2.86Å; G170-N173 PolarHBondContact O-N 3.49Å; G170-N173 VanDerWaalsContact O-N 3.13Å
171	Q	57.2	Low	66.5	Low	111 Å²	111	90.7 Å²	90.7	52%	0.519	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-11.9	167.9	-72.5	-173.1	-8.9	0	0	113.5	P168 N173 L174 N175	P168-Q171 HydrophobicContact CG-CG 4.4Å; Q171-N173 PolarHBondContact O-N 2.7Å; Q171-L174 PolarHBondContact O-N 3.16Å; Q171-L174 VanDerWaalsContact O-N 3.17Å; Q171-N175 PolarHBondContact O-N 2.89Å
172	N	49.9	Very low	63.9	Low	125 Å²	125	92.6 Å²	92.6	67%	0.668	49%	0.485	S	S	*	.	H	α-helix	trans	-64.3	-21.3	174.2	-68	-6.4	0	0	0	113.4	G170 R176	G170-N172 PolarHBondContact O-N 2.86Å; N172-R176 PolarHBondContact O-N 3.39Å
173	N	45.8	Very low	61.5	Low	118 Å²	118	95.3 Å²	95.3	63%	0.631	49%	0.492	S	S	*	.	H	α-helix	trans	-78	-32.6	173.4	-72.6	-7.1	0	0	0	112.3	G170 Q171 R176 L177	G170-N173 PolarHBondContact O-N 3.49Å; G170-N173 VanDerWaalsContact O-N 3.13Å; Q171-N173 PolarHBondContact O-N 2.7Å; N173-R176 WeakPolarHBondContact O-CB 3Å; N173-R176 PolarHBondContact O-N 3.33Å; N173-L177 PolarHBondContact O-N 2.95Å
174	L	47.9	Very low	58.8	Low	106 Å²	106	98.9 Å²	98.9	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-71	-34.3	170.1	-85	151.5	0	0	0	111.8	Q171 R176 L177 K178	Q171-L174 PolarHBondContact O-N 3.16Å; Q171-L174 VanDerWaalsContact O-N 3.17Å; L174-R176 VanDerWaalsContact C-N 3.3Å; L174-L177 WeakPolarHBondContact O-CB 3.48Å; L174-L177 PolarHBondContact O-N 3.29Å; L174-K178 WeakPolarHBondContact O-CG 3.19Å; L174-K178 PolarHBondContact O-N 3.28Å
175	N	42.4	Very low	56.2	Low	81 Å²	81	100.8 Å²	100.8	43%	0.433	52%	0.522	S	S	.	.	H	α-helix	trans	-74	-21.9	172.2	-69.2	-16.5	0	0	0	112.5	Q171 K178 S179	Q171-N175 PolarHBondContact O-N 2.89Å; N175-K178 CarbonylContact O-C 3.58Å; N175-K178 PolarHBondContact O-N 3.03Å; N175-S179 WeakPolarHBondContact O-CB 3.44Å; N175-S179 PolarHBondContact O-N 3.41Å; N175-S179 PolarHBondContact O-OG 3.38Å
176	R	41.9	Very low	53.5	Low	177 Å²	177	106.5 Å²	106.5	67%	0.668	55%	0.552	S	S	*	*	H	α-helix	trans	-67.7	-40.6	169.3	-145.9	175.2	-171.1	-173.2	0.8	110.6	N172 N173 L174 S179 I180	N172-R176 PolarHBondContact O-N 3.39Å; N173-R176 WeakPolarHBondContact O-CB 3Å; N173-R176 PolarHBondContact O-N 3.33Å; L174-R176 VanDerWaalsContact C-N 3.3Å; R176-S179 VanDerWaalsContact CA-OG 3.3Å; R176-S179 WeakPolarHBondContact CA-OG 3.17Å; R176-S179 PolarHBondContact O-N 3.19Å; R176-S179 PolarHBondContact O-OG 3.19Å; R176-I180 VanDerWaalsContact O-CG1 3.28Å; R176-I180 WeakPolarHBondContact O-CG1 3.4Å; R176-I180 PolarHBondContact O-N 3.22Å
177	L	42.3	Very low	50.9	Low	100 Å²	100	109.2 Å²	109.2	52%	0.524	57%	0.568	S	S	.	*	H	α-helix	trans	-62.6	-44.9	170.2	-68.3	163.5	0	0	0	111.7	N173 L174 S179 I180 E181	N173-L177 PolarHBondContact O-N 2.95Å; L174-L177 WeakPolarHBondContact O-CB 3.48Å; L174-L177 PolarHBondContact O-N 3.29Å; L177-S179 VanDerWaalsContact C-N 3.29Å; L177-S179 PolarHBondContact O-N 2.91Å; L177-I180 PolarHBondContact O-N 3.06Å; L177-E181 WeakPolarHBondContact O-CG 3.41Å; L177-E181 PolarHBondContact O-N 3.42Å
178	K	41.7	Very low	48.5	Very low	120 Å²	120	112.3 Å²	112.3	52%	0.522	59%	0.585	S	S	.	*	H	α-helix	trans	-68	-24.1	174.1	-66	177.4	179.4	-180	0	114.3	L174 N175 S182	L174-K178 WeakPolarHBondContact O-CG 3.19Å; L174-K178 PolarHBondContact O-N 3.28Å; N175-K178 CarbonylContact O-C 3.58Å; N175-K178 PolarHBondContact O-N 3.03Å; K178-S182 WeakPolarHBondContact O-CB 3.37Å; K178-S182 PolarHBondContact O-N 2.94Å; K178-S182 PolarHBondContact O-OG 3.14Å
179	S	40	Very low	46.4	Very low	45 Å²	45	114.6 Å²	114.6	32%	0.315	59%	0.593	S	S	.	*	H	α-helix	trans	-83	-22.9	175.6	72.7	0	0	0	0	113	N175 R176 L177 S182 K183	N175-S179 WeakPolarHBondContact O-CB 3.44Å; N175-S179 PolarHBondContact O-N 3.41Å; N175-S179 PolarHBondContact O-OG 3.38Å; R176-S179 VanDerWaalsContact CA-OG 3.3Å; R176-S179 WeakPolarHBondContact CA-OG 3.17Å; R176-S179 PolarHBondContact O-N 3.19Å; R176-S179 PolarHBondContact O-OG 3.19Å; L177-S179 VanDerWaalsContact C-N 3.29Å; L177-S179 PolarHBondContact O-N 2.91Å; S179-S182 WeakPolarHBondContact CA-OG 3.44Å; S179-K183 WeakPolarHBondContact O-CB 3.4Å; S179-K183 PolarHBondContact O-N 3.14Å; S179-K183 VanDerWaalsContact O-N 3.13Å
180	I	42.8	Very low	44	Very low	111 Å²	111	114.4 Å²	114.4	57%	0.569	59%	0.593	S	S	*	*	H	α-helix	trans	-73.9	-39.6	166.2	-66.8	162	0	0	0	109.2	R176 L177 S182	R176-I180 VanDerWaalsContact O-CG1 3.28Å; R176-I180 WeakPolarHBondContact O-CG1 3.4Å; R176-I180 PolarHBondContact O-N 3.22Å; L177-I180 PolarHBondContact O-N 3.06Å; I180-S182 VanDerWaalsContact C-N 3.3Å; I180-S182 PolarHBondContact O-N 2.84Å
181	E	41.6	Very low	42.6	Very low	113 Å²	113	118.1 Å²	118.1	53%	0.528	60%	0.6	S	S	.	*	H	α-helix	trans	-61.4	-35.2	171.2	-71.9	174.1	161.6	0	0	112.5	L177 L185	L177-E181 WeakPolarHBondContact O-CG 3.41Å; L177-E181 PolarHBondContact O-N 3.42Å; E181-L185 WeakPolarHBondContact O-CD1 3.31Å; E181-L185 WeakPolarHBondContact O-CG 3.46Å
182	S	39.2	Very low	42	Very low	78 Å²	78	117.6 Å²	117.6	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-95.7	-12.3	-174.4	45.2	0	0	0	0	116.1	K178 S179 I180	K178-S182 WeakPolarHBondContact O-CB 3.37Å; K178-S182 PolarHBondContact O-N 2.94Å; K178-S182 PolarHBondContact O-OG 3.14Å; S179-S182 WeakPolarHBondContact CA-OG 3.44Å; I180-S182 VanDerWaalsContact C-N 3.3Å; I180-S182 PolarHBondContact O-N 2.84Å
183	K	42.8	Very low	41.6	Very low	190 Å²	190	116.1 Å²	116.1	83%	0.826	59%	0.592	S	S	*	*	H	α-helix	trans	-107.7	2.7	178.2	-70.8	-178.2	175.4	178.8	0	115.1	S179	S179-K183 WeakPolarHBondContact O-CB 3.4Å; S179-K183 PolarHBondContact O-N 3.14Å; S179-K183 VanDerWaalsContact O-N 3.13Å
184	S	37.6	Very low	41.2	Very low	77 Å²	77	115.1 Å²	115.1	54%	0.538	59%	0.586	S	S	.	*	S	Bend	trans	-112.3	9.6	175.8	-161.4	0	0	0	0	113.8	N186	S184-N186 VanDerWaalsContact C-N 3.26Å; S184-N186 PolarHBondContact O-N 3.39Å
185	L	36	Very low	40.9	Very low	126 Å²	126	114 Å²	114	66%	0.66	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	35.8	-170.5	-86.9	161.1	0	0	0	116	E181	E181-L185 WeakPolarHBondContact O-CD1 3.31Å; E181-L185 WeakPolarHBondContact O-CG 3.46Å
186	N	36	Very low	40.8	Very low	161 Å²	161	114.2 Å²	114.2	86%	0.861	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	7.6	169.7	-81	0.9	0	0	0	114.1	S184	S184-N186 VanDerWaalsContact C-N 3.26Å; S184-N186 PolarHBondContact O-N 3.39Å
187	N	39.3	Very low	40.6	Very low	121 Å²	121	109.9 Å²	109.9	65%	0.647	57%	0.571	S	S	*	*	S	Bend	trans	-120.9	119.6	176.7	-77.6	-18.7	0	0	0	110.7	N189	N187-N189 PolarHBondContact O-N 3.41Å
188	E	43.1	Very low	40.6	Very low	190 Å²	190	108 Å²	108	89%	0.888	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	6.2	-177.6	-67.4	178.7	141.6	0	0	115.6
189	N	46.9	Very low	40.7	Very low	118 Å²	118	106.1 Å²	106.1	63%	0.631	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-1.2	-172.4	-62.4	-18.2	0	0	0	114.5	N187 L193	N187-N189 PolarHBondContact O-N 3.41Å; N189-L193 PolarHBondContact O-N 2.86Å
190	H	38.3	Very low	40.9	Very low	80 Å²	80	108.5 Å²	108.5	37%	0.37	57%	0.571	S	S	.	*	H	α-helix	trans	-88.5	-19.7	-170.3	-150.9	-75.3	0	0	0	114.8	D192 L193 I194	H190-D192 VanDerWaalsContact C-N 3.31Å; H190-L193 PolarHBondContact O-N 3.08Å; H190-I194 PolarHBondContact O-N 3.06Å; H190-I194 VanDerWaalsContact O-N 3.1Å
191	L	42.5	Very low	40.9	Very low	132 Å²	132	106.5 Å²	106.5	69%	0.691	56%	0.561	S	S	*	*	H	α-helix	trans	-67.9	-35.2	169.8	-98.8	140.8	0	0	0	111	L193 N195	L191-L193 VanDerWaalsContact C-N 3.35Å; L191-N195 VanDerWaalsContact O-CB 3.27Å; L191-N195 WeakPolarHBondContact O-CB 3.45Å; L191-N195 VanDerWaalsContact O-CG 3.25Å; L191-N195 PolarHBondContact O-N 3.48Å; L191-N195 PolarHBondContact O-ND2 3.23Å; L191-N195 VanDerWaalsContact O-ND2 3.11Å
192	D	44.1	Very low	41.1	Very low	101 Å²	101	106.3 Å²	106.3	54%	0.54	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-36.2	171.3	-71.3	-21	0	0	0	111.4	H190 N196	H190-D192 VanDerWaalsContact C-N 3.31Å; D192-N196 WeakPolarHBondContact O-CB 3.22Å; D192-N196 PolarHBondContact O-N 2.6Å; D192-N196 PolarHBondContact O-ND2 3.12Å
193	L	41.9	Very low	41.7	Very low	93 Å²	93	109.4 Å²	109.4	49%	0.487	57%	0.567	S	S	.	*	H	α-helix	trans	-69.3	-40.7	-179.6	-139.2	117.1	0	0	0	112.7	N189 H190 L191 N196 L197	N189-L193 PolarHBondContact O-N 2.86Å; H190-L193 PolarHBondContact O-N 3.08Å; L191-L193 VanDerWaalsContact C-N 3.35Å; L193-N196 PolarHBondContact O-N 3.48Å; L193-L197 HydrophobicContact CD2-CD1 4.05Å; L193-L197 WeakPolarHBondContact O-CB 3.32Å; L193-L197 VanDerWaalsContact O-CD1 3.23Å; L193-L197 WeakPolarHBondContact O-CD1 3.25Å; L193-L197 PolarHBondContact O-N 2.59Å
194	I	36.8	Very low	41.9	Very low	97 Å²	97	100.9 Å²	100.9	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-71.7	-40.1	176.7	-66.4	172	0	0	0	111.1	H190 N196 L197 S198	H190-I194 PolarHBondContact O-N 3.06Å; H190-I194 VanDerWaalsContact O-N 3.1Å; I194-N196 VanDerWaalsContact C-N 3.34Å; I194-L197 PolarHBondContact O-N 2.96Å; I194-S198 WeakPolarHBondContact O-CB 3.27Å; I194-S198 PolarHBondContact O-N 3.32Å
195	N	41.7	Very low	42.4	Very low	82 Å²	82	101 Å²	101	44%	0.439	53%	0.526	S	S	.	.	H	α-helix	trans	-66.2	-37.8	173.5	-74.9	-29.5	0	0	0	111.2	L191 S198 N199	L191-N195 VanDerWaalsContact O-CB 3.27Å; L191-N195 WeakPolarHBondContact O-CB 3.45Å; L191-N195 VanDerWaalsContact O-CG 3.25Å; L191-N195 PolarHBondContact O-N 3.48Å; L191-N195 PolarHBondContact O-ND2 3.23Å; L191-N195 VanDerWaalsContact O-ND2 3.11Å; N195-S198 PolarHBondContact O-N 2.94Å; N195-N199 WeakPolarHBondContact O-CB 3.34Å; N195-N199 PolarHBondContact O-N 3.19Å; N195-N199 PolarHBondContact O-ND2 3.21Å
196	N	40.6	Very low	43.2	Very low	86 Å²	86	96 Å²	96	46%	0.46	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-39.2	173	-73.1	-28.1	0	0	0	111.7	D192 L193 I194 N199 N200	D192-N196 WeakPolarHBondContact O-CB 3.22Å; D192-N196 PolarHBondContact O-N 2.6Å; D192-N196 PolarHBondContact O-ND2 3.12Å; L193-N196 PolarHBondContact O-N 3.48Å; I194-N196 VanDerWaalsContact C-N 3.34Å; N196-N199 PolarHBondContact O-N 3.18Å; N196-N200 WeakPolarHBondContact O-CB 3.1Å; N196-N200 PolarHBondContact O-N 3Å; N196-N200 PolarHBondContact O-ND2 3.43Å; N196-N200 PolarHBondContact O-OD1 3.35Å
197	L	38.3	Very low	43.8	Very low	86 Å²	86	94.9 Å²	94.9	45%	0.45	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-47.5	173.3	-106.7	93.1	0	0	0	111.6	L193 I194 N199 N200 I201	L193-L197 HydrophobicContact CD2-CD1 4.05Å; L193-L197 WeakPolarHBondContact O-CB 3.32Å; L193-L197 VanDerWaalsContact O-CD1 3.23Å; L193-L197 WeakPolarHBondContact O-CD1 3.25Å; L193-L197 PolarHBondContact O-N 2.59Å; I194-L197 PolarHBondContact O-N 2.96Å; L197-N199 VanDerWaalsContact C-N 3.34Å; L197-N199 PolarHBondContact O-N 3.38Å; L197-N200 PolarHBondContact O-N 3.47Å; L197-I201 VanDerWaalsContact O-CB 3.31Å; L197-I201 WeakPolarHBondContact O-CB 3.15Å; L197-I201 WeakPolarHBondContact O-CD1 3.32Å; L197-I201 WeakPolarHBondContact O-CG1 3.15Å; L197-I201 PolarHBondContact O-N 3.21Å
198	S	40.8	Very low	44.4	Very low	60 Å²	60	93.8 Å²	93.8	42%	0.42	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-40.7	177.8	-168.7	0	0	0	0	111.4	I194 N195 N202	I194-S198 WeakPolarHBondContact O-CB 3.27Å; I194-S198 PolarHBondContact O-N 3.32Å; N195-S198 PolarHBondContact O-N 2.94Å; S198-N202 WeakPolarHBondContact O-CB 3.3Å; S198-N202 PolarHBondContact O-N 2.77Å; S198-N202 PolarHBondContact O-ND2 2.63Å
199	N	45.5	Very low	44.7	Very low	82 Å²	82	89.9 Å²	89.9	44%	0.439	47%	0.473	S	S	.	.	H	α-helix	trans	-68.5	-33.7	176.3	-72.1	-26.8	0	0	0	113.1	N195 N196 L197 K203	N195-N199 WeakPolarHBondContact O-CB 3.34Å; N195-N199 PolarHBondContact O-N 3.19Å; N195-N199 PolarHBondContact O-ND2 3.21Å; N196-N199 PolarHBondContact O-N 3.18Å; L197-N199 VanDerWaalsContact C-N 3.34Å; L197-N199 PolarHBondContact O-N 3.38Å; N199-K203 VanDerWaalsContact O-CG 3.26Å; N199-K203 WeakPolarHBondContact O-CG 3.47Å; N199-K203 PolarHBondContact O-N 2.75Å
200	N	44.1	Very low	45	Very low	95 Å²	95	93.1 Å²	93.1	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-78.4	-39.6	178.2	-70.5	-14.6	0	0	0	111.3	N196 L197 N202 K203	N196-N200 WeakPolarHBondContact O-CB 3.1Å; N196-N200 PolarHBondContact O-N 3Å; N196-N200 PolarHBondContact O-ND2 3.43Å; N196-N200 PolarHBondContact O-OD1 3.35Å; L197-N200 PolarHBondContact O-N 3.47Å; N200-N202 VanDerWaalsContact C-N 3.25Å; N200-N202 PolarHBondContact O-N 3.24Å; N200-K203 PolarHBondContact O-N 2.86Å; N200-K203 VanDerWaalsContact O-N 3.16Å
201	I	42.9	Very low	45.7	Very low	69 Å²	69	92.7 Å²	92.7	35%	0.354	48%	0.479	S	S	.	.	H	α-helix	trans	-60.6	-37.6	173.1	-71.8	165.4	0	0	0	110.4	L197 K203 R231	L197-I201 VanDerWaalsContact O-CB 3.31Å; L197-I201 WeakPolarHBondContact O-CB 3.15Å; L197-I201 WeakPolarHBondContact O-CD1 3.32Å; L197-I201 WeakPolarHBondContact O-CG1 3.15Å; L197-I201 PolarHBondContact O-N 3.21Å; I201-K203 VanDerWaalsContact C-N 3.35Å; I201-R231 PolarHBondContact O-NH1 2.49Å
202	N	46	Very low	46.2	Very low	109 Å²	109	87.1 Å²	87.1	58%	0.583	45%	0.449	S	S	*	.	H	α-helix	trans	-74.8	-18.3	178.6	-71.3	-26.5	0	0	0	114.1	S198 N200 R231	S198-N202 WeakPolarHBondContact O-CB 3.3Å; S198-N202 PolarHBondContact O-N 2.77Å; S198-N202 PolarHBondContact O-ND2 2.63Å; N200-N202 VanDerWaalsContact C-N 3.25Å; N200-N202 PolarHBondContact O-N 3.24Å; N202-R231 PolarHBondContact O-NH1 2.95Å
203	K	49.9	Very low	46.7	Very low	143 Å²	143	87.2 Å²	87.2	62%	0.622	45%	0.45	S	S	*	.	H	α-helix	trans	-88.9	-12	-176.8	-82.4	174.4	-177.3	176.6	0	115.5	N199 N200 I201 N205	N199-K203 VanDerWaalsContact O-CG 3.26Å; N199-K203 WeakPolarHBondContact O-CG 3.47Å; N199-K203 PolarHBondContact O-N 2.75Å; N200-K203 PolarHBondContact O-N 2.86Å; N200-K203 VanDerWaalsContact O-N 3.16Å; I201-K203 VanDerWaalsContact C-N 3.35Å; K203-N205 PolarHBondContact O-N 2.78Å
204	V	48.2	Very low	47.4	Very low	10 Å²	10	87 Å²	87	6%	0.061	46%	0.456	C	S	.	.			trans	-67.5	108.1	179.5	-177.3	0	0	0	0	108.6	L206 R231	V204-L206 HydrophobicContact CG1-CD2 4.02Å; V204-L206 HydrophobicContact CG1-CG 4.3Å; V204-R231 PolarHBondContact O-NH1 2.89Å; V204-R231 PolarHBondContact O-NH2 2.68Å
205	N	48.1	Very low	48.2	Very low	81 Å²	81	84.3 Å²	84.3	43%	0.433	44%	0.443	S	S	.	.			trans	-110.1	104.4	173	-174.4	2.3	0	0	0	107.6	K203 N207 D208	K203-N205 PolarHBondContact O-N 2.78Å; N205-N207 PolarHBondContact O-N 2.96Å; N205-N207 WeakPolarHBondContact OD1-CB 3.38Å; N205-N207 PolarHBondContact OD1-N 3.23Å; N205-D208 PolarHBondContact O-N 3.36Å; N205-D208 VanDerWaalsContact O-N 3.15Å
206	L	52.1	Low	48.7	Very low	21 Å²	21	81.8 Å²	81.8	11%	0.11	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-7.4	-176.8	-63.4	173.2	0	0	0	113.3	V204 D208 F212 I232 E235 M247	V204-L206 HydrophobicContact CG1-CD2 4.02Å; V204-L206 HydrophobicContact CG1-CG 4.3Å; L206-D208 PolarHBondContact O-N 2.93Å; L206-F212 HydrophobicContact CD2-CB 4.4Å; L206-F212 HydrophobicContact CD2-CD2 3.33Å; L206-F212 HydrophobicContact CD2-CE2 3.91Å; L206-F212 HydrophobicContact CD2-CG 4.22Å; L206-I232 HydrophobicContact CD1-CG1 3.98Å; L206-E235 WeakPolarHBondContact CB-OE2 3.46Å; L206-E235 HydrophobicContact CD1-CB 4.16Å; L206-E235 HydrophobicContact CD1-CG 4.49Å; L206-E235 WeakPolarHBondContact CD1-OE2 3.35Å; L206-E235 WeakPolarHBondContact CG-OE2 3.35Å; L206-M247 HydrophobicContact CB-CE 4.04Å; L206-M247 HydrophobicContact CD1-CE 3.47Å; L206-M247 VanDerWaalsContact CD1-CE 3.47Å; L206-M247 HydrophobicContact CD2-CE 4.16Å; L206-M247 HydrophobicContact CG-CE 4.09Å
207	N	48	Very low	49.4	Very low	137 Å²	137	84.2 Å²	84.2	73%	0.733	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-13.6	170	-82.5	-11.6	0	0	0	113.6	N205	N205-N207 PolarHBondContact O-N 2.96Å; N205-N207 WeakPolarHBondContact OD1-CB 3.38Å; N205-N207 PolarHBondContact OD1-N 3.23Å
208	D	52.6	Low	50.2	Low	97 Å²	97	86 Å²	86	52%	0.519	45%	0.45	S	S	.	.			trans	-97.9	97.7	170	-88.3	-38.6	0	0	0	109.6	N205 L206 K210 H211 F212	N205-D208 PolarHBondContact O-N 3.36Å; N205-D208 VanDerWaalsContact O-N 3.15Å; L206-D208 PolarHBondContact O-N 2.93Å; D208-K210 PolarHBondContact O-N 3.3Å; D208-H211 HydrophobicContact CB-CB 4.19Å; D208-H211 PolarHBondContact O-N 3.4Å; D208-F212 PolarHBondContact O-N 3.27Å
209	N	50.1	Low	50.7	Low	108 Å²	108	92.7 Å²	92.7	58%	0.578	48%	0.475	S	S	*	.	H	α-helix	trans	-48.4	-27.8	173.9	-74.1	-38.2	0	0	0	112.9
210	K	52.9	Low	51.1	Low	186 Å²	186	95.2 Å²	95.2	81%	0.809	49%	0.489	S	S	*	.	H	α-helix	trans	-71.3	-30.1	177	-65.4	-177.6	178.6	178.8	0	113.8	D208 S214	D208-K210 PolarHBondContact O-N 3.3Å; K210-S214 PolarHBondContact O-N 3.43Å
211	H	51.9	Low	51.7	Low	71 Å²	71	93.6 Å²	93.6	33%	0.329	48%	0.478	S	S	.	.	H	α-helix	trans	-81.1	-28.8	-179.9	-161.6	-58.7	0	0	0	111.4	D208	D208-H211 HydrophobicContact CB-CB 4.19Å; D208-H211 PolarHBondContact O-N 3.4Å
212	F	54.6	Low	52.8	Low	16 Å²	16	94.2 Å²	94.2	7%	0.07	48%	0.478	C	S	.	.	H	α-helix	trans	-74.5	-25.8	176.8	-168.4	-109.6	0	0	0	113.1	L206 D208 F216 K250 K254	L206-F212 HydrophobicContact CD2-CB 4.4Å; L206-F212 HydrophobicContact CD2-CD2 3.33Å; L206-F212 HydrophobicContact CD2-CE2 3.91Å; L206-F212 HydrophobicContact CD2-CG 4.22Å; D208-F212 PolarHBondContact O-N 3.27Å; F212-F216 HydrophobicContact CD1-CE2 4.46Å; F212-F216 HydrophobicContact CD2-CE2 4.03Å; F212-F216 HydrophobicContact CE1-CE2 4.33Å; F212-F216 AromaticContact CE2-CE2 3.9Å; F212-F216 HydrophobicContact CE2-CE2 3.9Å; F212-F216 HydrophobicContact CE2-CZ 4.08Å; F212-F216 HydrophobicContact CG-CE2 4.34Å; F212-F216 HydrophobicContact CZ-CE2 4.06Å; F212-F216 HydrophobicContact CZ-CZ 4.11Å; F212-F216 WeakPolarHBondContact O-CD2 3.41Å; F212-F216 WeakPolarHBondContact O-CE2 3.42Å; F212-K250 HydrophobicContact CE1-CB 4.48Å; F212-K254 HydrophobicContact CD1-CD 4.4Å; F212-K254 HydrophobicContact CE1-CD 3.54Å; F212-K254 HydrophobicContact CZ-CD 3.85Å; F212-K254 PolarHBondContact O-NZ 2.82Å
213	D	53	Low	54	Low	102 Å²	102	95.8 Å²	95.8	55%	0.545	48%	0.482	S	S	.	.	H	α-helix	trans	-87.8	-26	175.7	-70.9	-24	0	0	0	112.8	L215 K254	D213-L215 PolarHBondContact O-N 2.84Å; D213-K254 IonicContact OD1-NZ 3.88Å; D213-K254 PolarHBondContact OD1-NZ 3.15Å; D213-K254 VanDerWaalsContact OD1-NZ 3.12Å
214	S	56.8	Low	54.8	Low	89 Å²	89	93.6 Å²	93.6	62%	0.622	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-11.9	174.3	-174.8	0	0	0	0	114.2	K210 F216	K210-S214 PolarHBondContact O-N 3.43Å; S214-F216 PolarHBondContact O-N 3.1Å
215	L	54.6	Low	55.7	Low	41 Å²	41	93.5 Å²	93.5	22%	0.215	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.5	-179.7	-124.8	80.9	0	0	0	113.4	D213	D213-L215 PolarHBondContact O-N 2.84Å
216	F	51.8	Low	56.8	Low	28 Å²	28	94.4 Å²	94.4	12%	0.123	47%	0.473	C	S	.	.			trans	-135.3	43.7	-155.8	-68.7	-84.7	0	0	0	113.2	F212 S214 E221 F225 K254	F212-F216 HydrophobicContact CD1-CE2 4.46Å; F212-F216 HydrophobicContact CD2-CE2 4.03Å; F212-F216 HydrophobicContact CE1-CE2 4.33Å; F212-F216 AromaticContact CE2-CE2 3.9Å; F212-F216 HydrophobicContact CE2-CE2 3.9Å; F212-F216 HydrophobicContact CE2-CZ 4.08Å; F212-F216 HydrophobicContact CG-CE2 4.34Å; F212-F216 HydrophobicContact CZ-CE2 4.06Å; F212-F216 HydrophobicContact CZ-CZ 4.11Å; F212-F216 WeakPolarHBondContact O-CD2 3.41Å; F212-F216 WeakPolarHBondContact O-CE2 3.42Å; S214-F216 PolarHBondContact O-N 3.1Å; F216-E221 WeakPolarHBondContact CA-OE1 3.49Å; F216-E221 HydrophobicContact CB-CG 4.47Å; F216-E221 WeakPolarHBondContact CB-OE1 3.19Å; F216-E221 HydrophobicContact CD1-CG 4.24Å; F216-F225 HydrophobicContact CE1-CB 4.4Å; F216-F225 AromaticContact CE1-CD2 3.57Å; F216-F225 HydrophobicContact CE1-CD2 3.57Å; F216-F225 HydrophobicContact CE1-CE2 4.31Å; F216-F225 HydrophobicContact CE1-CG 4.34Å; F216-F225 AromaticContact CZ-CD2 3.71Å; F216-F225 HydrophobicContact CZ-CD2 3.71Å; F216-F225 HydrophobicContact CZ-CE2 4.18Å; F216-K254 HydrophobicContact CD1-CD 4.06Å; F216-K254 HydrophobicContact CD2-CD 4.07Å; F216-K254 HydrophobicContact CE1-CB 4.49Å; F216-K254 HydrophobicContact CE1-CD 3.81Å; F216-K254 HydrophobicContact CE2-CD 3.8Å; F216-K254 VanDerWaalsContact CE2-NZ 3.34Å; F216-K254 HydrophobicContact CG-CD 4.17Å; F216-K254 HydrophobicContact CZ-CD 3.67Å
217	N	55.3	Low	57.7	Low	138 Å²	138	99.7 Å²	99.7	74%	0.738	50%	0.495	S	S	*	.			trans	-111.4	-0.7	-176.8	-93.6	-9.6	0	0	0	114.8
218	D	54.6	Low	58.8	Low	122 Å²	122	94.1 Å²	94.1	65%	0.652	47%	0.465	S	S	*	.	S	Bend	trans	-132.3	137.8	-174.9	-78.7	-34.4	0	0	0	112.3	N220 E221	D218-N220 PolarHBondContact O-N 3.37Å; D218-E221 WeakPolarHBondContact O-CA 3.24Å; D218-E221 VanDerWaalsContact O-CB 3.22Å; D218-E221 WeakPolarHBondContact O-CB 3.4Å; D218-E221 WeakPolarHBondContact O-CG 3.47Å; D218-E221 PolarHBondContact O-N 2.83Å
219	E	51.1	Low	59.8	Low	202 Å²	202	91.7 Å²	91.7	94%	0.944	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-4.9	-178.5	-62.6	180	161.6	0	0	115.7	E221	E219-E221 PolarHBondContact O-N 2.95Å
220	N	54	Low	60.9	Low	134 Å²	134	90 Å²	90	72%	0.717	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	8	167.6	-64.2	-42.2	0	0	0	113.2	D218 F222	D218-N220 PolarHBondContact O-N 3.37Å; N220-F222 PolarHBondContact O-N 2.74Å
221	E	58.2	Low	61.7	Low	61 Å²	61	84.6 Å²	84.6	29%	0.285	42%	0.421	S	S	.	.	H	α-helix	trans	-53.4	-38.3	-170.6	-112.2	174.6	135.4	0	0	115.9	F216 D218 E219 F225	F216-E221 WeakPolarHBondContact CA-OE1 3.49Å; F216-E221 HydrophobicContact CB-CG 4.47Å; F216-E221 WeakPolarHBondContact CB-OE1 3.19Å; F216-E221 HydrophobicContact CD1-CG 4.24Å; D218-E221 WeakPolarHBondContact O-CA 3.24Å; D218-E221 VanDerWaalsContact O-CB 3.22Å; D218-E221 WeakPolarHBondContact O-CB 3.4Å; D218-E221 WeakPolarHBondContact O-CG 3.47Å; D218-E221 PolarHBondContact O-N 2.83Å; E219-E221 PolarHBondContact O-N 2.95Å; E221-F225 VanDerWaalsContact O-CB 3.26Å; E221-F225 WeakPolarHBondContact O-CB 3.44Å; E221-F225 PolarHBondContact O-N 2.85Å
222	F	65.7	Low	62.7	Low	82 Å²	82	81.6 Å²	81.6	36%	0.36	41%	0.407	S	S	.	.	H	α-helix	trans	-69.9	-49.9	-169.6	-171.2	-97.5	0	0	0	111.9	N220 E224 F225 F226 A258 I259	N220-F222 PolarHBondContact O-N 2.74Å; F222-E224 VanDerWaalsContact C-N 3.3Å; F222-E224 PolarHBondContact O-N 3.02Å; F222-F225 PolarHBondContact O-N 3.05Å; F222-F226 HydrophobicContact CD1-CD2 4.1Å; F222-F226 HydrophobicContact CD1-CE2 4.09Å; F222-F226 HydrophobicContact CD2-CE2 4.06Å; F222-F226 AromaticContact CE1-CD2 3.84Å; F222-F226 HydrophobicContact CE1-CD2 3.84Å; F222-F226 AromaticContact CE1-CE2 3.47Å; F222-F226 HydrophobicContact CE1-CE2 3.47Å; F222-F226 VanDerWaalsContact CE1-CE2 3.47Å; F222-F226 HydrophobicContact CE1-CZ 4.16Å; F222-F226 HydrophobicContact CE2-CD2 4.26Å; F222-F226 AromaticContact CE2-CE2 3.44Å; F222-F226 HydrophobicContact CE2-CE2 3.44Å; F222-F226 VanDerWaalsContact CE2-CE2 3.44Å; F222-F226 HydrophobicContact CE2-CZ 4.25Å; F222-F226 HydrophobicContact CG-CD2 4.44Å; F222-F226 HydrophobicContact CG-CE2 4.37Å; F222-F226 AromaticContact CZ-CD2 3.95Å; F222-F226 HydrophobicContact CZ-CD2 3.95Å; F222-F226 AromaticContact CZ-CE2 3.12Å; F222-F226 HydrophobicContact CZ-CE2 3.12Å; F222-F226 AromaticContact CZ-CZ 3.68Å; F222-F226 HydrophobicContact CZ-CZ 3.68Å; F222-F226 VanDerWaalsContact O-CD2 3.31Å; F222-F226 WeakPolarHBondContact O-CD2 3.4Å; F222-F226 PolarHBondContact O-N 3.34Å; F222-A258 HydrophobicContact CD2-CB 3.79Å; F222-I259 HydrophobicContact CD2-CG2 4.16Å; F222-I259 HydrophobicContact CE2-CG2 3.42Å; F222-I259 VanDerWaalsContact CE2-CG2 3.42Å; F222-I259 HydrophobicContact CZ-CG2 4.11Å
223	E	69.8	Low	63.8	Low	142 Å²	142	88.5 Å²	88.5	66%	0.664	43%	0.433	S	S	*	.	H	α-helix	trans	-68.7	-30.7	179.7	-73.3	-169.5	-179.6	0	0	112.5	K227	E223-K227 WeakPolarHBondContact O-CG 3.47Å; E223-K227 PolarHBondContact O-N 3.24Å
224	E	66.6	Low	64.9	Low	97 Å²	97	88 Å²	88	45%	0.453	43%	0.431	S	S	.	.	H	α-helix	trans	-70.1	-41.7	175.8	-167.8	160.2	-169.6	0	0	111.4	F222 F226 K227 H228	F222-E224 VanDerWaalsContact C-N 3.3Å; F222-E224 PolarHBondContact O-N 3.02Å; E224-F226 PolarHBondContact O-N 3.3Å; E224-K227 WeakPolarHBondContact O-CB 3.47Å; E224-K227 PolarHBondContact O-N 3.03Å; E224-K227 VanDerWaalsContact O-N 3.13Å; E224-H228 PolarHBondContact O-CD2 2.79Å
225	F	67.7	Low	65.5	Low	9 Å²	9	86 Å²	86	4%	0.039	41%	0.411	C	S	.	.	H	α-helix	trans	-57.2	-45.4	173.8	176.5	-101.5	0	0	0	112.9	F216 E221 F222 K227 H228 L229 I232 I251 I255	F216-F225 HydrophobicContact CE1-CB 4.4Å; F216-F225 AromaticContact CE1-CD2 3.57Å; F216-F225 HydrophobicContact CE1-CD2 3.57Å; F216-F225 HydrophobicContact CE1-CE2 4.31Å; F216-F225 HydrophobicContact CE1-CG 4.34Å; F216-F225 AromaticContact CZ-CD2 3.71Å; F216-F225 HydrophobicContact CZ-CD2 3.71Å; F216-F225 HydrophobicContact CZ-CE2 4.18Å; E221-F225 VanDerWaalsContact O-CB 3.26Å; E221-F225 WeakPolarHBondContact O-CB 3.44Å; E221-F225 PolarHBondContact O-N 2.85Å; F222-F225 PolarHBondContact O-N 3.05Å; F225-K227 PolarHBondContact O-N 3.42Å; F225-H228 PolarHBondContact O-N 2.86Å; F225-L229 HydrophobicContact CD1-CD1 4.42Å; F225-L229 HydrophobicContact CD1-CG 4.31Å; F225-L229 HydrophobicContact CE1-CD1 3.95Å; F225-L229 HydrophobicContact CE1-CD2 3.8Å; F225-L229 HydrophobicContact CE1-CG 3.73Å; F225-L229 HydrophobicContact CZ-CD2 3.81Å; F225-L229 HydrophobicContact CZ-CG 4.1Å; F225-L229 PolarHBondContact O-N 3.26Å; F225-I232 HydrophobicContact CE2-CD1 3.95Å; F225-I251 HydrophobicContact CZ-CG2 3.98Å; F225-I255 HydrophobicContact CD1-CG1 4.12Å; F225-I255 HydrophobicContact CE1-CD1 3.68Å; F225-I255 HydrophobicContact CE1-CG1 3.3Å; F225-I255 HydrophobicContact CZ-CD1 3.96Å; F225-I255 HydrophobicContact CZ-CG1 3.7Å
226	F	71.5	Confident	66.7	Low	100 Å²	100	85.8 Å²	85.8	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-64.3	-25.5	179.3	-88.2	-98.9	0	0	0	113.3	F222 E224 H228 L229	F222-F226 HydrophobicContact CD1-CD2 4.1Å; F222-F226 HydrophobicContact CD1-CE2 4.09Å; F222-F226 HydrophobicContact CD2-CE2 4.06Å; F222-F226 AromaticContact CE1-CD2 3.84Å; F222-F226 HydrophobicContact CE1-CD2 3.84Å; F222-F226 AromaticContact CE1-CE2 3.47Å; F222-F226 HydrophobicContact CE1-CE2 3.47Å; F222-F226 VanDerWaalsContact CE1-CE2 3.47Å; F222-F226 HydrophobicContact CE1-CZ 4.16Å; F222-F226 HydrophobicContact CE2-CD2 4.26Å; F222-F226 AromaticContact CE2-CE2 3.44Å; F222-F226 HydrophobicContact CE2-CE2 3.44Å; F222-F226 VanDerWaalsContact CE2-CE2 3.44Å; F222-F226 HydrophobicContact CE2-CZ 4.25Å; F222-F226 HydrophobicContact CG-CD2 4.44Å; F222-F226 HydrophobicContact CG-CE2 4.37Å; F222-F226 AromaticContact CZ-CD2 3.95Å; F222-F226 HydrophobicContact CZ-CD2 3.95Å; F222-F226 AromaticContact CZ-CE2 3.12Å; F222-F226 HydrophobicContact CZ-CE2 3.12Å; F222-F226 AromaticContact CZ-CZ 3.68Å; F222-F226 HydrophobicContact CZ-CZ 3.68Å; F222-F226 VanDerWaalsContact O-CD2 3.31Å; F222-F226 WeakPolarHBondContact O-CD2 3.4Å; F222-F226 PolarHBondContact O-N 3.34Å; E224-F226 PolarHBondContact O-N 3.3Å; F226-H228 PolarHBondContact O-N 3.34Å; F226-L229 HydrophobicContact CB-CD1 4.48Å; F226-L229 HydrophobicContact CD1-CD1 3.49Å; F226-L229 VanDerWaalsContact CD1-CD1 3.49Å; F226-L229 HydrophobicContact CD2-CD1 4.4Å; F226-L229 HydrophobicContact CE1-CD1 3.67Å; F226-L229 HydrophobicContact CG-CD1 3.9Å; F226-L229 HydrophobicContact CZ-CD1 4.2Å
227	K	72.1	Confident	67.9	Low	131 Å²	131	88.2 Å²	88.2	57%	0.57	44%	0.435	S	S	*	.	H	α-helix	trans	-69	-24.8	173.7	-66	166	-166.4	166.1	0	112.2	E223 E224 F225	E223-K227 WeakPolarHBondContact O-CG 3.47Å; E223-K227 PolarHBondContact O-N 3.24Å; E224-K227 WeakPolarHBondContact O-CB 3.47Å; E224-K227 PolarHBondContact O-N 3.03Å; E224-K227 VanDerWaalsContact O-N 3.13Å; F225-K227 PolarHBondContact O-N 3.42Å
228	H	70	Confident	68.9	Low	20 Å²	20	86.3 Å²	86.3	9%	0.093	43%	0.433	C	S	.	.	H	α-helix	trans	-94.6	-16.7	-179.9	-61.8	-60.3	0	0	0	113.7	E224 F225 F226 R231 I232	E224-H228 PolarHBondContact O-CD2 2.79Å; F225-H228 PolarHBondContact O-N 2.86Å; F226-H228 PolarHBondContact O-N 3.34Å; H228-R231 PolarHBondContact O-N 2.85Å; H228-I232 HydrophobicContact CB-CD1 3.91Å; H228-I232 HydrophobicContact CB-CG1 4.38Å; H228-I232 WeakPolarHBondContact O-CG1 3.41Å; H228-I232 PolarHBondContact O-N 2.71Å
229	L	74.7	Confident	70.1	Confident	47 Å²	47	82.6 Å²	82.6	25%	0.246	41%	0.413	C	S	.	.	H	α-helix	trans	-50.9	-44.6	-178.9	-91.5	174.5	0	0	0	115.1	F225 F226 R231 I232 R233	F225-L229 HydrophobicContact CD1-CD1 4.42Å; F225-L229 HydrophobicContact CD1-CG 4.31Å; F225-L229 HydrophobicContact CE1-CD1 3.95Å; F225-L229 HydrophobicContact CE1-CD2 3.8Å; F225-L229 HydrophobicContact CE1-CG 3.73Å; F225-L229 HydrophobicContact CZ-CD2 3.81Å; F225-L229 HydrophobicContact CZ-CG 4.1Å; F225-L229 PolarHBondContact O-N 3.26Å; F226-L229 HydrophobicContact CB-CD1 4.48Å; F226-L229 HydrophobicContact CD1-CD1 3.49Å; F226-L229 VanDerWaalsContact CD1-CD1 3.49Å; F226-L229 HydrophobicContact CD2-CD1 4.4Å; F226-L229 HydrophobicContact CE1-CD1 3.67Å; F226-L229 HydrophobicContact CG-CD1 3.9Å; F226-L229 HydrophobicContact CZ-CD1 4.2Å; L229-R231 VanDerWaalsContact C-N 3.27Å; L229-R231 PolarHBondContact O-N 3.35Å; L229-I232 PolarHBondContact O-N 3.07Å; L229-R233 WeakPolarHBondContact O-CB 3.26Å; L229-R233 PolarHBondContact O-N 3.35Å
230	P	73	Confident	71.6	Confident	71 Å²	71	77.1 Å²	77.1	46%	0.461	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-39.2	178.4	-25.5	35.4	0	0	0	112.6	D234	P230-D234 VanDerWaalsContact O-CG 3.24Å; P230-D234 PolarHBondContact O-N 3.21Å
231	R	68.4	Low	72.6	Confident	74 Å²	74	74.8 Å²	74.8	28%	0.279	38%	0.384	S	S	.	.	H	α-helix	trans	-74.1	-42.9	178.5	-174.3	177.4	171.2	163.6	6.3	111.6	I201 N202 V204 H228 L229 R233 D234 E235	I201-R231 PolarHBondContact O-NH1 2.49Å; N202-R231 PolarHBondContact O-NH1 2.95Å; V204-R231 PolarHBondContact O-NH1 2.89Å; V204-R231 PolarHBondContact O-NH2 2.68Å; H228-R231 PolarHBondContact O-N 2.85Å; L229-R231 VanDerWaalsContact C-N 3.27Å; L229-R231 PolarHBondContact O-N 3.35Å; R231-R233 VanDerWaalsContact C-N 3.26Å; R231-R233 PolarHBondContact O-N 2.75Å; R231-D234 PolarHBondContact O-N 3.03Å; R231-E235 IonicContact CZ-OE1 2.95Å; R231-E235 IonicContact NE-OE1 2.68Å; R231-E235 PolarHBondContact NE-OE1 2.99Å; R231-E235 IonicContact NH2-OE1 2.74Å; R231-E235 PolarHBondContact NH2-OE1 2.51Å; R231-E235 WeakPolarHBondContact O-CG 3.27Å; R231-E235 PolarHBondContact O-N 3.04Å
232	I	73.1	Confident	73.4	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.041	40%	0.398	C	S	.	.	H	α-helix	trans	-57	-42	174	-69	167.8	0	0	0	110.4	L206 F225 H228 L229 E235 I236 I251	L206-I232 HydrophobicContact CD1-CG1 3.98Å; F225-I232 HydrophobicContact CE2-CD1 3.95Å; H228-I232 HydrophobicContact CB-CD1 3.91Å; H228-I232 HydrophobicContact CB-CG1 4.38Å; H228-I232 WeakPolarHBondContact O-CG1 3.41Å; H228-I232 PolarHBondContact O-N 2.71Å; L229-I232 PolarHBondContact O-N 3.07Å; I232-E235 PolarHBondContact O-N 3.44Å; I232-I236 HydrophobicContact CG2-CD1 3.87Å; I232-I236 HydrophobicContact CG2-CG1 4.4Å; I232-I236 WeakPolarHBondContact O-CB 3.4Å; I232-I236 VanDerWaalsContact O-CG1 3.25Å; I232-I236 WeakPolarHBondContact O-CG1 3.44Å; I232-I236 PolarHBondContact O-N 2.87Å; I232-I251 HydrophobicContact CG2-CD1 3.28Å; I232-I251 HydrophobicContact CG2-CG1 4.07Å
233	R	78.2	Confident	73.9	Confident	160 Å²	160	75.7 Å²	75.7	60%	0.604	40%	0.398	S	S	*	.	H	α-helix	trans	-60.6	-47.1	175.5	-178.5	-160.2	68.2	-171.5	-2.1	112	L229 R231 E235 I236 A237	L229-R233 WeakPolarHBondContact O-CB 3.26Å; L229-R233 PolarHBondContact O-N 3.35Å; R231-R233 VanDerWaalsContact C-N 3.26Å; R231-R233 PolarHBondContact O-N 2.75Å; R233-E235 VanDerWaalsContact C-N 3.3Å; R233-E235 PolarHBondContact O-N 3.23Å; R233-I236 PolarHBondContact O-N 3.19Å; R233-A237 PolarHBondContact O-N 2.85Å
234	D	75.7	Confident	74.4	Confident	93 Å²	93	74.3 Å²	74.3	50%	0.497	39%	0.387	S	S	.	.	H	α-helix	trans	-66.4	-34.7	-179.1	-64.7	-10.5	0	0	0	111.2	P230 R231	P230-D234 VanDerWaalsContact O-CG 3.24Å; P230-D234 PolarHBondContact O-N 3.21Å; R231-D234 PolarHBondContact O-N 3.03Å
235	E	70.6	Confident	74.8	Confident	45 Å²	45	75 Å²	75	21%	0.21	39%	0.39	C	S	.	.	H	α-helix	trans	-71.6	-42.7	174.4	-70.2	-177.1	-159.8	0	0	111.9	L206 R231 I232 R233 A237 S238	L206-E235 WeakPolarHBondContact CB-OE2 3.46Å; L206-E235 HydrophobicContact CD1-CB 4.16Å; L206-E235 HydrophobicContact CD1-CG 4.49Å; L206-E235 WeakPolarHBondContact CD1-OE2 3.35Å; L206-E235 WeakPolarHBondContact CG-OE2 3.35Å; R231-E235 IonicContact CZ-OE1 2.95Å; R231-E235 IonicContact NE-OE1 2.68Å; R231-E235 PolarHBondContact NE-OE1 2.99Å; R231-E235 IonicContact NH2-OE1 2.74Å; R231-E235 PolarHBondContact NH2-OE1 2.51Å; R231-E235 WeakPolarHBondContact O-CG 3.27Å; R231-E235 PolarHBondContact O-N 3.04Å; I232-E235 PolarHBondContact O-N 3.44Å; R233-E235 VanDerWaalsContact C-N 3.3Å; R233-E235 PolarHBondContact O-N 3.23Å; E235-A237 VanDerWaalsContact C-N 3.27Å; E235-A237 PolarHBondContact O-N 3.14Å; E235-S238 WeakPolarHBondContact O-CB 3.46Å; E235-S238 PolarHBondContact O-N 2.78Å; E235-S238 PolarHBondContact O-OG 3.31Å
236	I	78.3	Confident	75.2	Confident	37 Å²	37	77.5 Å²	77.5	19%	0.19	40%	0.403	C	S	.	.	H	α-helix	trans	-58.6	-39.6	173.4	-71.9	169.5	0	0	0	111.6	I232 R233 S238 L239 R244 M247 I251	I232-I236 HydrophobicContact CG2-CD1 3.87Å; I232-I236 HydrophobicContact CG2-CG1 4.4Å; I232-I236 WeakPolarHBondContact O-CB 3.4Å; I232-I236 VanDerWaalsContact O-CG1 3.25Å; I232-I236 WeakPolarHBondContact O-CG1 3.44Å; I232-I236 PolarHBondContact O-N 2.87Å; R233-I236 PolarHBondContact O-N 3.19Å; I236-S238 PolarHBondContact O-N 2.64Å; I236-S238 VanDerWaalsContact O-N 3.11Å; I236-L239 PolarHBondContact O-N 3.36Å; I236-L239 VanDerWaalsContact O-N 3.11Å; I236-R244 HydrophobicContact CG2-CB 4.42Å; I236-R244 HydrophobicContact CG2-CG 3.98Å; I236-R244 WeakPolarHBondContact O-CD 3.4Å; I236-R244 VanDerWaalsContact O-CG 3.22Å; I236-R244 WeakPolarHBondContact O-CG 3.39Å; I236-M247 HydrophobicContact CD1-CG 4.1Å; I236-M247 HydrophobicContact CG1-CB 4.24Å; I236-M247 HydrophobicContact CG1-CG 3.76Å; I236-M247 HydrophobicContact CG1-SD 4.12Å; I236-I251 HydrophobicContact CD1-CD1 3.18Å; I236-I251 HydrophobicContact CG1-CD1 4.25Å
237	A	76.4	Confident	75.4	Confident	80 Å²	80	74 Å²	74	66%	0.661	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.6	179.1	0	0	0	0	0	112.8	R233 E235	R233-A237 PolarHBondContact O-N 2.85Å; E235-A237 VanDerWaalsContact C-N 3.27Å; E235-A237 PolarHBondContact O-N 3.14Å
238	S	77.9	Confident	75.7	Confident	97 Å²	97	69.8 Å²	69.8	68%	0.678	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-10.9	178.6	76.8	0	0	0	0	114.9	E235 I236	E235-S238 WeakPolarHBondContact O-CB 3.46Å; E235-S238 PolarHBondContact O-N 2.78Å; E235-S238 PolarHBondContact O-OG 3.31Å; I236-S238 PolarHBondContact O-N 2.64Å; I236-S238 VanDerWaalsContact O-N 3.11Å
239	L	79.5	Confident	76.1	Confident	45 Å²	45	70.7 Å²	70.7	24%	0.236	38%	0.383	C	S	.	.	S	Bend	trans	-82.9	155.6	-175.7	-67.1	177	0	0	0	112.6	I236 D243 R244 M247	I236-L239 PolarHBondContact O-N 3.36Å; I236-L239 VanDerWaalsContact O-N 3.11Å; L239-D243 HydrophobicContact CB-CB 3.92Å; L239-D243 HydrophobicContact CD1-CB 4.13Å; L239-D243 HydrophobicContact CD2-CB 4.1Å; L239-D243 HydrophobicContact CG-CB 4.27Å; L239-R244 HydrophobicContact CB-CG 3.61Å; L239-R244 WeakPolarHBondContact O-CD 3.32Å; L239-R244 PolarHBondContact O-NE 3.28Å; L239-M247 HydrophobicContact CD1-CB 4.1Å; L239-M247 HydrophobicContact CD1-CG 4.46Å; L239-M247 HydrophobicContact CD1-SD 3.7Å
240	N	81.6	Confident	76.2	Confident	86 Å²	86	73.2 Å²	73.2	46%	0.46	39%	0.392	S	S	.	.			trans	-69.7	171.8	170.9	67.6	53.9	0	0	0	111.1	T242 D243 R244	N240-T242 VanDerWaalsContact C-N 3.32Å; N240-T242 PolarHBondContact O-N 3.22Å; N240-T242 PolarHBondContact OD1-N 3.11Å; N240-D243 PolarHBondContact ND2-OD2 2.93Å; N240-D243 PolarHBondContact O-N 3.47Å; N240-D243 PolarHBondContact OD1-N 3.46Å; N240-D243 PolarHBondContact OD1-OD2 2.99Å; N240-R244 WeakPolarHBondContact O-CB 3.37Å; N240-R244 VanDerWaalsContact O-CG 3.24Å; N240-R244 WeakPolarHBondContact O-CG 3.33Å; N240-R244 PolarHBondContact O-N 3Å
241	S	74.9	Confident	76.3	Confident	85 Å²	85	70.6 Å²	70.6	59%	0.594	37%	0.374	S	S	*	.	H	α-helix	trans	-58.1	-40.6	-175.4	-157.1	0	0	0	0	114.2	H245	S241-H245 PolarHBondContact O-N 3.14Å
242	T	76.4	Confident	76.8	Confident	94 Å²	94	71.4 Å²	71.4	58%	0.577	39%	0.387	S	S	*	.	H	α-helix	trans	-70.4	-45.5	-178.8	-52.7	0	0	0	0	111.1	N240 R244 H245 N246	N240-T242 VanDerWaalsContact C-N 3.32Å; N240-T242 PolarHBondContact O-N 3.22Å; N240-T242 PolarHBondContact OD1-N 3.11Å; T242-R244 VanDerWaalsContact C-N 3.35Å; T242-R244 PolarHBondContact O-N 3.39Å; T242-H245 WeakPolarHBondContact O-CB 3.27Å; T242-H245 PolarHBondContact O-N 3.38Å; T242-N246 PolarHBondContact O-N 2.8Å; T242-N246 PolarHBondContact O-ND2 3.13Å
243	D	76.2	Confident	76.7	Confident	68 Å²	68	71.9 Å²	71.9	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-68.8	-34.2	179.5	-68.6	-26.2	0	0	0	112	L239 N240 H245 M247	L239-D243 HydrophobicContact CB-CB 3.92Å; L239-D243 HydrophobicContact CD1-CB 4.13Å; L239-D243 HydrophobicContact CD2-CB 4.1Å; L239-D243 HydrophobicContact CG-CB 4.27Å; N240-D243 PolarHBondContact ND2-OD2 2.93Å; N240-D243 PolarHBondContact O-N 3.47Å; N240-D243 PolarHBondContact OD1-N 3.46Å; N240-D243 PolarHBondContact OD1-OD2 2.99Å; D243-H245 VanDerWaalsContact C-N 3.34Å; D243-M247 VanDerWaalsContact O-CB 3.27Å; D243-M247 WeakPolarHBondContact O-CB 3.31Å; D243-M247 PolarHBondContact O-N 2.83Å
244	R	79.4	Confident	76.2	Confident	113 Å²	113	66.2 Å²	66.2	43%	0.426	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-43	171.5	-75.7	-173	-60.5	166.3	5.2	111.9	I236 L239 N240 T242 M247 A248	I236-R244 HydrophobicContact CG2-CB 4.42Å; I236-R244 HydrophobicContact CG2-CG 3.98Å; I236-R244 WeakPolarHBondContact O-CD 3.4Å; I236-R244 VanDerWaalsContact O-CG 3.22Å; I236-R244 WeakPolarHBondContact O-CG 3.39Å; L239-R244 HydrophobicContact CB-CG 3.61Å; L239-R244 WeakPolarHBondContact O-CD 3.32Å; L239-R244 PolarHBondContact O-NE 3.28Å; N240-R244 WeakPolarHBondContact O-CB 3.37Å; N240-R244 VanDerWaalsContact O-CG 3.24Å; N240-R244 WeakPolarHBondContact O-CG 3.33Å; N240-R244 PolarHBondContact O-N 3Å; T242-R244 VanDerWaalsContact C-N 3.35Å; T242-R244 PolarHBondContact O-N 3.39Å; R244-M247 PolarHBondContact O-N 3.46Å; R244-A248 VanDerWaalsContact O-CB 3.28Å; R244-A248 WeakPolarHBondContact O-CB 3.38Å; R244-A248 PolarHBondContact O-N 3.42Å
245	H	76.1	Confident	76.1	Confident	112 Å²	112	64.2 Å²	64.2	52%	0.519	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-52.2	178	-176.6	74.8	0	0	0	111.1	S241 T242 D243 M247 A248 E249	S241-H245 PolarHBondContact O-N 3.14Å; T242-H245 WeakPolarHBondContact O-CB 3.27Å; T242-H245 PolarHBondContact O-N 3.38Å; D243-H245 VanDerWaalsContact C-N 3.34Å; H245-M247 VanDerWaalsContact C-N 3.26Å; H245-M247 PolarHBondContact O-N 3.13Å; H245-A248 PolarHBondContact O-N 3.37Å; H245-E249 PolarHBondContact O-N 3.36Å
246	N	75.6	Confident	76.3	Confident	61 Å²	61	66.5 Å²	66.5	33%	0.326	37%	0.366	S	S	.	.	H	α-helix	trans	-58.5	-38	178.2	-67	-21.1	0	0	0	112.4	T242 K250	T242-N246 PolarHBondContact O-N 2.8Å; T242-N246 PolarHBondContact O-ND2 3.13Å; N246-K250 VanDerWaalsContact O-CG 3.31Å; N246-K250 WeakPolarHBondContact O-CG 3.4Å; N246-K250 PolarHBondContact O-N 3.14Å; N246-K250 VanDerWaalsContact O-N 3.14Å
247	M	74.4	Confident	75.8	Confident	26 Å²	26	69.4 Å²	69.4	13%	0.128	38%	0.378	C	S	.	.	H	α-helix	trans	-74.5	-39.3	179.4	-166	139.7	-156.7	0	0	112.4	L206 I236 L239 D243 R244 H245 E249 K250 I251	L206-M247 HydrophobicContact CB-CE 4.04Å; L206-M247 HydrophobicContact CD1-CE 3.47Å; L206-M247 VanDerWaalsContact CD1-CE 3.47Å; L206-M247 HydrophobicContact CD2-CE 4.16Å; L206-M247 HydrophobicContact CG-CE 4.09Å; I236-M247 HydrophobicContact CD1-CG 4.1Å; I236-M247 HydrophobicContact CG1-CB 4.24Å; I236-M247 HydrophobicContact CG1-CG 3.76Å; I236-M247 HydrophobicContact CG1-SD 4.12Å; L239-M247 HydrophobicContact CD1-CB 4.1Å; L239-M247 HydrophobicContact CD1-CG 4.46Å; L239-M247 HydrophobicContact CD1-SD 3.7Å; D243-M247 VanDerWaalsContact O-CB 3.27Å; D243-M247 WeakPolarHBondContact O-CB 3.31Å; D243-M247 PolarHBondContact O-N 2.83Å; R244-M247 PolarHBondContact O-N 3.46Å; H245-M247 VanDerWaalsContact C-N 3.26Å; H245-M247 PolarHBondContact O-N 3.13Å; M247-E249 VanDerWaalsContact C-N 3.34Å; M247-K250 PolarHBondContact O-N 3.49Å; M247-I251 HydrophobicContact CG-CD1 3.89Å; M247-I251 WeakPolarHBondContact O-CB 3.38Å; M247-I251 WeakPolarHBondContact O-CD1 3.5Å; M247-I251 VanDerWaalsContact O-CG1 3.27Å; M247-I251 WeakPolarHBondContact O-CG1 3.34Å; M247-I251 PolarHBondContact O-N 3.01Å
248	A	78.9	Confident	75.4	Confident	44 Å²	44	67.3 Å²	67.3	36%	0.364	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-42.2	174.3	0	0	0	0	0	111.6	R244 H245 I251 T252	R244-A248 VanDerWaalsContact O-CB 3.28Å; R244-A248 WeakPolarHBondContact O-CB 3.38Å; R244-A248 PolarHBondContact O-N 3.42Å; H245-A248 PolarHBondContact O-N 3.37Å; A248-I251 PolarHBondContact O-N 3.33Å; A248-T252 VanDerWaalsContact O-CB 3.31Å; A248-T252 WeakPolarHBondContact O-CB 3.25Å; A248-T252 PolarHBondContact O-N 3.16Å; A248-T252 PolarHBondContact O-OG1 2.93Å
249	E	78.4	Confident	74.9	Confident	38 Å²	38	67.3 Å²	67.3	18%	0.178	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-51.7	174.5	-171.6	-169.9	174	0	0	111.1	H245 M247 I251 T252 C253 H270	H245-E249 PolarHBondContact O-N 3.36Å; M247-E249 VanDerWaalsContact C-N 3.34Å; E249-I251 VanDerWaalsContact C-N 3.32Å; E249-I251 PolarHBondContact O-N 3.46Å; E249-T252 PolarHBondContact O-N 3.21Å; E249-T252 VanDerWaalsContact O-N 3.16Å; E249-C253 PolarHBondContact O-N 3.15Å; E249-C253 PolarHBondContact O-SG 3.04Å; E249-C253 VanDerWaalsContact O-SG 3.39Å; E249-H270 WeakPolarHBondContact OE1-CA 3.48Å; E249-H270 IonicContact OE1-CE1 2.77Å; E249-H270 IonicContact OE1-CG 3.94Å; E249-H270 IonicContact OE1-ND1 3.36Å; E249-H270 PolarHBondContact OE1-ND1 2.6Å
250	K	76.3	Confident	74.3	Confident	101 Å²	101	68.5 Å²	68.5	44%	0.439	38%	0.375	S	S	.	.	H	α-helix	trans	-56.6	-44.4	177.1	-75.4	175.9	-178	-178.8	0	112.6	F212 N246 M247 K254	F212-K250 HydrophobicContact CE1-CB 4.48Å; N246-K250 VanDerWaalsContact O-CG 3.31Å; N246-K250 WeakPolarHBondContact O-CG 3.4Å; N246-K250 PolarHBondContact O-N 3.14Å; N246-K250 VanDerWaalsContact O-N 3.14Å; M247-K250 PolarHBondContact O-N 3.49Å; K250-K254 WeakPolarHBondContact O-CB 3.36Å; K250-K254 WeakPolarHBondContact O-CG 3.49Å; K250-K254 PolarHBondContact O-N 2.85Å
251	I	76.5	Confident	73.9	Confident	15 Å²	15	65.1 Å²	65.1	8%	0.077	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-45.1	178.2	-74.9	160.2	0	0	0	110.8	F225 I232 I236 M247 A248 E249 K254 I255	F225-I251 HydrophobicContact CZ-CG2 3.98Å; I232-I251 HydrophobicContact CG2-CD1 3.28Å; I232-I251 HydrophobicContact CG2-CG1 4.07Å; I236-I251 HydrophobicContact CD1-CD1 3.18Å; I236-I251 HydrophobicContact CG1-CD1 4.25Å; M247-I251 HydrophobicContact CG-CD1 3.89Å; M247-I251 WeakPolarHBondContact O-CB 3.38Å; M247-I251 WeakPolarHBondContact O-CD1 3.5Å; M247-I251 VanDerWaalsContact O-CG1 3.27Å; M247-I251 WeakPolarHBondContact O-CG1 3.34Å; M247-I251 PolarHBondContact O-N 3.01Å; A248-I251 PolarHBondContact O-N 3.33Å; E249-I251 VanDerWaalsContact C-N 3.32Å; E249-I251 PolarHBondContact O-N 3.46Å; I251-K254 PolarHBondContact O-N 3.26Å; I251-I255 HydrophobicContact CG2-CD1 3.61Å; I251-I255 HydrophobicContact CG2-CG1 4.34Å; I251-I255 VanDerWaalsContact O-CG1 3.27Å; I251-I255 WeakPolarHBondContact O-CG1 3.22Å; I251-I255 PolarHBondContact O-N 3.24Å
252	T	77.9	Confident	73.9	Confident	91 Å²	91	63.3 Å²	63.3	56%	0.558	35%	0.348	S	S	*	.	H	α-helix	trans	-62.2	-48.7	-179.4	-57.8	0	0	0	0	110.6	A248 E249 K254 I255 W256	A248-T252 VanDerWaalsContact O-CB 3.31Å; A248-T252 WeakPolarHBondContact O-CB 3.25Å; A248-T252 PolarHBondContact O-N 3.16Å; A248-T252 PolarHBondContact O-OG1 2.93Å; E249-T252 PolarHBondContact O-N 3.21Å; E249-T252 VanDerWaalsContact O-N 3.16Å; T252-K254 VanDerWaalsContact C-N 3.32Å; T252-K254 PolarHBondContact O-N 2.82Å; T252-I255 PolarHBondContact O-N 2.92Å; T252-W256 WeakPolarHBondContact O-CB 3.46Å; T252-W256 PolarHBondContact O-N 3.1Å
253	C	71.7	Confident	73.7	Confident	19 Å²	19	65 Å²	65	13%	0.128	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-39.6	176.8	-68.4	0	0	0	0	112.1	E249 W256 K257 I266	E249-C253 PolarHBondContact O-N 3.15Å; E249-C253 PolarHBondContact O-SG 3.04Å; E249-C253 VanDerWaalsContact O-SG 3.39Å; C253-W256 PolarHBondContact O-N 3.43Å; C253-K257 WeakPolarHBondContact O-CG 3.39Å; C253-K257 PolarHBondContact O-N 3.02Å; C253-I266 HydrophobicContact CB-CD1 4.22Å
254	K	68.6	Low	73.8	Confident	41 Å²	41	70 Å²	70	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-68.9	-41.4	177	-74.1	-167.3	179.5	-165.5	0	112.5	F212 D213 F216 K250 I251 T252 W256 K257 A258	F212-K254 HydrophobicContact CD1-CD 4.4Å; F212-K254 HydrophobicContact CE1-CD 3.54Å; F212-K254 HydrophobicContact CZ-CD 3.85Å; F212-K254 PolarHBondContact O-NZ 2.82Å; D213-K254 IonicContact OD1-NZ 3.88Å; D213-K254 PolarHBondContact OD1-NZ 3.15Å; D213-K254 VanDerWaalsContact OD1-NZ 3.12Å; F216-K254 HydrophobicContact CD1-CD 4.06Å; F216-K254 HydrophobicContact CD2-CD 4.07Å; F216-K254 HydrophobicContact CE1-CB 4.49Å; F216-K254 HydrophobicContact CE1-CD 3.81Å; F216-K254 HydrophobicContact CE2-CD 3.8Å; F216-K254 VanDerWaalsContact CE2-NZ 3.34Å; F216-K254 HydrophobicContact CG-CD 4.17Å; F216-K254 HydrophobicContact CZ-CD 3.67Å; K250-K254 WeakPolarHBondContact O-CB 3.36Å; K250-K254 WeakPolarHBondContact O-CG 3.49Å; K250-K254 PolarHBondContact O-N 2.85Å; I251-K254 PolarHBondContact O-N 3.26Å; T252-K254 VanDerWaalsContact C-N 3.32Å; T252-K254 PolarHBondContact O-N 2.82Å; K254-W256 VanDerWaalsContact C-N 3.31Å; K254-W256 PolarHBondContact O-N 3.08Å; K254-K257 PolarHBondContact O-N 3.02Å; K254-A258 WeakPolarHBondContact O-CB 3.11Å; K254-A258 PolarHBondContact O-N 2.87Å
255	I	72.5	Confident	73.4	Confident	51 Å²	51	70 Å²	70	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-60.7	-44.5	173.1	-68.9	167	0	0	0	110.1	F225 I251 T252 A258 I259	F225-I255 HydrophobicContact CD1-CG1 4.12Å; F225-I255 HydrophobicContact CE1-CD1 3.68Å; F225-I255 HydrophobicContact CE1-CG1 3.3Å; F225-I255 HydrophobicContact CZ-CD1 3.96Å; F225-I255 HydrophobicContact CZ-CG1 3.7Å; I251-I255 HydrophobicContact CG2-CD1 3.61Å; I251-I255 HydrophobicContact CG2-CG1 4.34Å; I251-I255 VanDerWaalsContact O-CG1 3.27Å; I251-I255 WeakPolarHBondContact O-CG1 3.22Å; I251-I255 PolarHBondContact O-N 3.24Å; T252-I255 PolarHBondContact O-N 2.92Å; I255-A258 PolarHBondContact O-N 3.16Å; I255-I259 WeakPolarHBondContact O-CG1 3.38Å; I255-I259 PolarHBondContact O-N 2.83Å
256	W	74.2	Confident	73.1	Confident	92 Å²	92	65.4 Å²	65.4	35%	0.348	35%	0.354	S	S	.	.	H	α-helix	trans	-58.1	-50	179.2	-170.1	-108.8	0	0	0	111.8	T252 C253 K254 A258 I259 G261 E265 I266	T252-W256 WeakPolarHBondContact O-CB 3.46Å; T252-W256 PolarHBondContact O-N 3.1Å; C253-W256 PolarHBondContact O-N 3.43Å; K254-W256 VanDerWaalsContact C-N 3.31Å; K254-W256 PolarHBondContact O-N 3.08Å; W256-A258 VanDerWaalsContact C-N 3.32Å; W256-A258 PolarHBondContact O-N 3.32Å; W256-I259 HydrophobicContact CE3-CD1 3.76Å; W256-I259 HydrophobicContact CE3-CG1 4.4Å; W256-I259 HydrophobicContact CZ3-CD1 3.93Å; W256-I259 WeakPolarHBondContact O-CG1 3.49Å; W256-I259 PolarHBondContact O-N 3.16Å; W256-G261 VanDerWaalsContact NE1-CA 3.32Å; W256-G261 WeakPolarHBondContact O-CA 3.4Å; W256-G261 PolarHBondContact O-N 2.8Å; W256-E265 HydrophobicContact CZ2-CB 4.28Å; W256-E265 HydrophobicContact CZ2-CG 4.46Å; W256-E265 WeakPolarHBondContact CZ2-OE2 3.42Å; W256-E265 PolarHBondContact NE1-OE2 3.17Å; W256-E265 VanDerWaalsContact NE1-OE2 3.13Å; W256-I266 HydrophobicContact CG-CG2 4.07Å
257	K	69.1	Low	72.7	Confident	99 Å²	99	66.2 Å²	66.2	43%	0.43	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-42.4	175.3	-69.5	-174.1	-173.1	-161.8	0	111.9	C253 K254 I259 G260 E263	C253-K257 WeakPolarHBondContact O-CG 3.39Å; C253-K257 PolarHBondContact O-N 3.02Å; K254-K257 PolarHBondContact O-N 3.02Å; K257-I259 VanDerWaalsContact C-N 3.3Å; K257-I259 PolarHBondContact O-N 3.05Å; K257-G260 PolarHBondContact O-N 3.32Å; K257-E263 IonicContact NZ-OE1 2.64Å; K257-E263 PolarHBondContact NZ-OE1 2.93Å
258	A	66.5	Low	72.3	Confident	35 Å²	35	68.5 Å²	68.5	29%	0.289	40%	0.399	S	S	.	.	H	α-helix	trans	-68.9	-23.2	-177.8	0	0	0	0	0	114.1	F222 K254 I255 W256 G260	F222-A258 HydrophobicContact CD2-CB 3.79Å; K254-A258 WeakPolarHBondContact O-CB 3.11Å; K254-A258 PolarHBondContact O-N 2.87Å; I255-A258 PolarHBondContact O-N 3.16Å; W256-A258 VanDerWaalsContact C-N 3.32Å; W256-A258 PolarHBondContact O-N 3.32Å; A258-G260 VanDerWaalsContact C-N 3.31Å
259	I	68.5	Low	71.7	Confident	98 Å²	98	71.9 Å²	71.9	50%	0.503	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.4	172.1	64.7	173.7	0	0	0	113.5	F222 I255 W256 K257	F222-I259 HydrophobicContact CD2-CG2 4.16Å; F222-I259 HydrophobicContact CE2-CG2 3.42Å; F222-I259 VanDerWaalsContact CE2-CG2 3.42Å; F222-I259 HydrophobicContact CZ-CG2 4.11Å; I255-I259 WeakPolarHBondContact O-CG1 3.38Å; I255-I259 PolarHBondContact O-N 2.83Å; W256-I259 HydrophobicContact CE3-CD1 3.76Å; W256-I259 HydrophobicContact CE3-CG1 4.4Å; W256-I259 HydrophobicContact CZ3-CD1 3.93Å; W256-I259 WeakPolarHBondContact O-CG1 3.49Å; W256-I259 PolarHBondContact O-N 3.16Å; K257-I259 VanDerWaalsContact C-N 3.3Å; K257-I259 PolarHBondContact O-N 3.05Å
260	G	66.4	Low	70.6	Confident	70 Å²	70	75.6 Å²	75.6	72%	0.722	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	15.8	-179.4	0	0	0	0	0	114.6	K257 A258	K257-G260 PolarHBondContact O-N 3.32Å; A258-G260 VanDerWaalsContact C-N 3.31Å
261	G	72.9	Confident	69.6	Low	15 Å²	15	74.4 Å²	74.4	16%	0.155	43%	0.432	C	S	.	.			trans	-67.5	142.6	172.4	0	0	0	0	0	112.2	W256	W256-G261 VanDerWaalsContact NE1-CA 3.32Å; W256-G261 WeakPolarHBondContact O-CA 3.4Å; W256-G261 PolarHBondContact O-N 2.8Å
262	S	76.3	Confident	68.4	Low	47 Å²	47	81.1 Å²	81.1	33%	0.329	47%	0.468	S	S	.	.			trans	-82.8	152.8	-177.3	68	0	0	0	0	112.2	E264 E265	S262-E264 PolarHBondContact O-N 2.78Å; S262-E265 PolarHBondContact N-OE2 3.26Å; S262-E265 PolarHBondContact O-N 3.19Å; S262-E265 WeakPolarHBondContact OG-CG 3.36Å; S262-E265 PolarHBondContact OG-N 2.97Å; S262-E265 PolarHBondContact OG-OE2 3.06Å
263	E	71.4	Confident	66.6	Low	129 Å²	129	81.9 Å²	81.9	60%	0.603	48%	0.477	S	S	*	.	H	α-helix	trans	-66	-24.7	173.4	-67.8	-167.1	154.5	0	0	112.5	K257 E265 I266 A267	K257-E263 IonicContact NZ-OE1 2.64Å; K257-E263 PolarHBondContact NZ-OE1 2.93Å; E263-E265 VanDerWaalsContact C-N 3.31Å; E263-E265 PolarHBondContact O-N 3.46Å; E263-I266 WeakPolarHBondContact O-CG1 3.45Å; E263-I266 PolarHBondContact O-N 3.2Å; E263-A267 WeakPolarHBondContact O-CB 3.45Å; E263-A267 PolarHBondContact O-N 3.33Å
264	E	77.9	Confident	64.7	Low	173 Å²	173	93.7 Å²	93.7	81%	0.808	53%	0.53	S	S	*	.	H	α-helix	trans	-65.4	-33.6	176.8	-63.8	-178.4	179.7	0	0	112.2	S262 I266	S262-E264 PolarHBondContact O-N 2.78Å; E264-I266 VanDerWaalsContact C-N 3.28Å; E264-I266 PolarHBondContact O-N 3.11Å
265	E	71.4	Confident	64.5	Low	112 Å²	112	96.4 Å²	96.4	52%	0.523	55%	0.548	S	S	.	.	H	α-helix	trans	-73.2	-20.3	-179.7	-73.9	162.5	140.5	0	0	113.6	W256 S262 E263	W256-E265 HydrophobicContact CZ2-CB 4.28Å; W256-E265 HydrophobicContact CZ2-CG 4.46Å; W256-E265 WeakPolarHBondContact CZ2-OE2 3.42Å; W256-E265 PolarHBondContact NE1-OE2 3.17Å; W256-E265 VanDerWaalsContact NE1-OE2 3.13Å; S262-E265 PolarHBondContact N-OE2 3.26Å; S262-E265 PolarHBondContact O-N 3.19Å; S262-E265 WeakPolarHBondContact OG-CG 3.36Å; S262-E265 PolarHBondContact OG-N 2.97Å; S262-E265 PolarHBondContact OG-OE2 3.06Å; E263-E265 VanDerWaalsContact C-N 3.31Å; E263-E265 PolarHBondContact O-N 3.46Å
266	I	70.8	Confident	64.1	Low	17 Å²	17	98.7 Å²	98.7	9%	0.087	56%	0.563	C	S	.	*	H	α-helix	trans	-110.1	-4.5	179.7	60.6	172.3	0	0	0	112.6	C253 W256 E263 E264 G268 L269	C253-I266 HydrophobicContact CB-CD1 4.22Å; W256-I266 HydrophobicContact CG-CG2 4.07Å; E263-I266 WeakPolarHBondContact O-CG1 3.45Å; E263-I266 PolarHBondContact O-N 3.2Å; E264-I266 VanDerWaalsContact C-N 3.28Å; E264-I266 PolarHBondContact O-N 3.11Å; I266-G268 PolarHBondContact O-N 3.1Å; I266-G268 VanDerWaalsContact O-N 3.16Å; I266-L269 HydrophobicContact CB-CD1 4.12Å; I266-L269 HydrophobicContact CG2-CD1 4.02Å; I266-L269 PolarHBondContact O-N 3.35Å; I266-L269 VanDerWaalsContact O-N 3.14Å
267	A	65.5	Low	63.5	Low	78 Å²	78	99.1 Å²	99.1	65%	0.645	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	113	175	0	0	0	0	0	109.8	E263	E263-A267 WeakPolarHBondContact O-CB 3.45Å; E263-A267 PolarHBondContact O-N 3.33Å
268	G	67.8	Low	63.2	Low	73 Å²	73	99.1 Å²	99.1	75%	0.753	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.3	0.2	-177.3	0	0	0	0	0	115.1	I266 H270	I266-G268 PolarHBondContact O-N 3.1Å; I266-G268 VanDerWaalsContact O-N 3.16Å; G268-H270 VanDerWaalsContact C-N 3.31Å
269	L	64.4	Low	63	Low	115 Å²	115	103.1 Å²	103.1	60%	0.602	60%	0.602	S	S	*	*			trans	-80.7	-14.3	168.2	-64.1	-179.1	0	0	0	113	I266 S271	I266-L269 HydrophobicContact CB-CD1 4.12Å; I266-L269 HydrophobicContact CG2-CD1 4.02Å; I266-L269 PolarHBondContact O-N 3.35Å; I266-L269 VanDerWaalsContact O-N 3.14Å; L269-S271 PolarHBondContact O-N 3.26Å
270	H	57.2	Low	62.6	Low	116 Å²	116	103.5 Å²	103.5	54%	0.537	61%	0.609	S	S	.	*	S	Bend	trans	-67	115	172.4	-67.9	-47.7	0	0	0	109.5	E249 G268 D272	E249-H270 WeakPolarHBondContact OE1-CA 3.48Å; E249-H270 IonicContact OE1-CE1 2.77Å; E249-H270 IonicContact OE1-CG 3.94Å; E249-H270 IonicContact OE1-ND1 3.36Å; E249-H270 PolarHBondContact OE1-ND1 2.6Å; G268-H270 VanDerWaalsContact C-N 3.31Å; H270-D272 VanDerWaalsContact C-N 3.32Å; H270-D272 PolarHBondContact O-N 3.13Å
271	S	54.4	Low	62.3	Low	76 Å²	76	105.9 Å²	105.9	53%	0.531	60%	0.6	S	S	.	*			trans	-67.4	96	166.6	59.4	0	0	0	0	108.1	L269 S273	L269-S271 PolarHBondContact O-N 3.26Å; S271-S273 PolarHBondContact O-N 3.25Å; S271-S273 VanDerWaalsContact O-N 3.07Å
272	D	51.2	Low	61.5	Low	157 Å²	157	112.8 Å²	112.8	84%	0.84	64%	0.635	S	S	*	*			trans	-60.4	109.4	154.1	-78.7	-24.3	0	0	0	106.5	H270	H270-D272 VanDerWaalsContact C-N 3.32Å; H270-D272 PolarHBondContact O-N 3.13Å
273	S	40.1	Very low	60.3	Low	106 Å²	106	118.3 Å²	118.3	74%	0.741	66%	0.66	S	S	*	*			trans	-28.8	134.2	176.2	52.5	0	0	0	0	117.1	S271	S271-S273 PolarHBondContact O-N 3.25Å; S271-S273 VanDerWaalsContact O-N 3.07Å
274	E	31.6	Very low	59.3	Low	268 Å²	268	117.4 Å²	117.4	100%	1.252	67%	0.665	S	S	*	*				-111.1	0	122.8	-84	-166.6	159.4	0	0	109.5

Retrieved 274 of 274 residues in 133.8 ms (Link to these results)

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